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ENERGY:      84     15692.0181     17521.7593      5761.2958       180.7102        -333070.6344     23043.3534         0.0000         0.0000     48072.9174        -222798.5801       174.8761   -270871.4975   -222420.9191       174.8761          -1264.6407     -2119.1645    921491.4634     -1264.6407     -2119.1645

ENERGY:      85     19034.4749     18377.7082      5761.3316       176.5397        -332350.3363     22972.2187         0.0000         0.0000     43641.9416        -222386.1216       158.7574   -266028.0632   -222396.4597       158.7574          -1101.4912     -2031.8233    921491.4634     -1101.4912     -2031.8233

ENERGY:      86     22361.2996     19720.3241      5758.5583       173.6091        -332514.8438     22921.5212         0.0000         0.0000     39480.2342        -222099.2973       143.6182   -261579.5315   -222396.4728       143.6182          -1408.4309     -1992.0455    921491.4634     -1408.4309     -1992.0455

ENERGY:      87     21898.5873     20858.8153      5750.7775       172.4431        -333299.4428     22859.7331         0.0000         0.0000     39513.3019        -222245.7846       143.7385   -261759.0865   -222398.3221       143.7385          -1739.2136     -2002.6067    921491.4634     -1739.2136     -2002.6067

ENERGY:      88     19807.2124     21236.1263      5737.2297       173.3188        -334313.4194     22793.0785         0.0000         0.0000     42007.3339        -222559.1198       152.8111   -264566.4537   -222408.9127       152.8111          -2036.3959     -2043.8954    921491.4634     -2036.3959     -2043.8954

ENERGY:      89     20138.2922     20745.5547      5719.3133       176.3160        -335202.8321     22743.6988         0.0000         0.0000     43113.7497        -222565.9074       156.8360   -265679.6571   -222389.0012       156.8360          -2409.8246     -2071.1686    921491.4634     -2409.8246     -2071.1686

ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:      90     22711.6048     19691.0677      5699.8921       181.1111        -335712.1130     22705.2746         0.0000         0.0000     42377.6758        -222345.4869       154.1583   -264723.1627   -222389.2091       154.1583          -2670.9831     -2080.5817    921491.4634     -2670.9831     -2080.5817

ENERGY:      91     23737.5988     18627.1146      5683.0577       187.2277        -335678.4156     22643.5819         0.0000         0.0000     42539.3830        -222260.4520       154.7466   -264799.8350   -222388.3579       154.7466          -2499.0953     -2078.8098    921491.4634     -2499.0953     -2078.8098

ENERGY:      92     21523.8220     18060.4537      5672.6738       194.0387        -335129.0783     22543.7115         0.0000         0.0000     44665.3079        -222469.0706       162.4801   -267134.3786   -222389.6056       162.4801          -1910.9683     -2078.9076    921491.4634     -1910.9683     -2078.9076

ENERGY:      93     18788.3598     18281.5995      5671.3717       200.9119        -334319.2922     22433.7892         0.0000         0.0000     46311.8833        -222631.3768       168.4699   -268943.2601   -222367.8859       168.4699          -1385.1718     -2068.2565    921491.4634     -1385.1718     -2068.2565

ENERGY:      94     18530.9329     19242.9915      5679.4418       207.1113        -333693.3060     22351.2078         0.0000         0.0000     45144.9171        -222536.7037       164.2248   -267681.6208   -222367.0862       164.2248          -1347.2600     -2063.4575    921491.4634     -1347.2600     -2063.4575

ENERGY:      95     20040.4586     20654.3437      5695.3527       212.0383        -333603.6976     22302.2586         0.0000         0.0000     42387.6997        -222311.5460       154.1948   -264699.2457   -222367.4631       154.1948          -1793.7083     -2083.6407    921491.4634     -1793.7083     -2083.6407

ENERGY:      96     20584.1064     22050.3789      5716.0483       215.1945        -334091.8991     22265.7317         0.0000         0.0000     40970.7077        -222289.7315       149.0402   -263260.4392   -222356.3659       149.0402          -2389.6990     -2142.8255    921491.4634     -2389.6990     -2142.8255

ENERGY:      97     19809.1309     22949.2012      5737.7476       216.2279        -334886.9640     22225.8322         0.0000         0.0000     41505.2398        -222443.5843       150.9847   -263948.8242   -222346.5814       150.9847          -2891.9374     -2214.1665    921491.4634     -2891.9374     -2214.1665

ENERGY:      98     19979.7557     22958.8353      5756.3117       214.8681        -335616.8430     22188.2114         0.0000         0.0000     41993.4227        -222525.4381       152.7605   -264518.8608   -222347.6396       152.7605          -3206.5490     -2272.3421    921491.4634     -3206.5490     -2272.3421

ENERGY:      99     22029.8952     22024.0795      5768.5777       211.0972        -336009.8228     22159.4702         0.0000         0.0000     41425.1769        -222391.5262       150.6934   -263816.7031   -222348.0703       150.6934          -3235.8097     -2296.7687    921491.4634     -3235.8097     -2296.7687

LDB: ============= START OF LOAD BALANCING ============== 50.9217
LDB: Largest compute 200 load 0.429198 is 1.2% of average load 36.876343
LDB: Average compute 0.051680 is 0.1% of average load 36.876343
LDB: Partitioning computes with target load 3.687634
LDB: Increased migratable compute count from 2736 to 2736
LDB: Largest unpartitionable compute is 0.056032
LDB: ============== END OF LOAD BALANCING =============== 50.9239
Info: useSync: 1 useProxySync: 0
LDB: =============== DONE WITH MIGRATION ================ 50.9248
Info: Initial time: 4 CPUs 0.473527 s/step 5.48064 days/ns 3219.38 MB memory
TIMING: 100  CPU: 48.3216, 0.472478/step  Wall: 48.3216, 0.472478/step, 0.0524975 hours remaining, 3219.378906 MB of memory in use.
ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     100     23587.3020     20475.3729      5773.0376       205.1509        -335896.4620     22125.7988         0.0000         0.0000     41455.8051        -222273.9948       150.8048   -263729.7999   -222326.1724       150.8048          -2788.3919     -2294.3879    921491.4634     -2788.3919     -2294.3879

ENERGY:     101     22287.2999     18933.8501      5770.3900       197.5201        -335238.2410     22065.3980         0.0000         0.0000     43590.2957        -222393.4872       158.5695   -265983.7829   -222319.4704       158.5695          -1880.2672     -2262.6846    921491.4634     -1880.2672     -2262.6846

ENERGY:     102     19420.3335     17951.6560      5762.8059       188.8891        -334088.2231     21980.7896         0.0000         0.0000     46153.7219        -222630.0272       167.8946   -268783.7490   -222317.3980       167.8946           -924.5794     -2215.2271    921491.4634      -924.5794     -2215.2271

ENERGY:     103     18429.6589     17794.2510      5753.5002       180.0834        -332765.4443     21898.9792         0.0000         0.0000     46061.5885        -222647.3832       167.5594   -268708.9717   -222315.0113       167.5594           -521.9323     -2162.1475    921491.4634      -521.9323     -2162.1475

ENERGY:     104     20135.5162     18313.1191      5745.4365       171.9705        -331716.6191     21838.6802         0.0000         0.0000     43114.8219        -222397.0747       156.8399   -265511.8966   -222300.0341       156.8399           -904.7452     -2132.5693    921491.4634      -904.7452     -2132.5693

ENERGY:     105     21674.8148     19112.5118      5740.5773       165.3638        -331353.5904     21791.8563         0.0000         0.0000     40663.3131        -222205.1532       147.9220   -262868.4663   -222297.2861       147.9220          -1781.0303     -2140.0924    921491.4634     -1781.0303     -2140.0924

ENERGY:     106     20688.3526     19760.1603      5739.0355       160.9482        -331684.6911     21743.4749         0.0000         0.0000     41270.8908        -222321.8288       150.1322   -263592.7197   -222299.8102       150.1322          -2687.8655     -2192.8737    921491.4634     -2687.8655     -2192.8737

ENERGY:     107     18828.1851     20041.3660      5739.7936       159.1631        -332486.5660     21693.8616         0.0000         0.0000     43452.4231        -222571.7735       158.0680   -266024.1966   -222302.3923       158.0680          -3435.4056     -2264.9714    921491.4634     -3435.4056     -2264.9714

ENERGY:     108     19374.7527     19955.6334      5740.9974       160.1493        -333435.9265     21654.4583         0.0000         0.0000     43952.1729        -222597.7626       159.8859   -266549.9355   -222305.0565       159.8859          -3989.5483     -2325.7046    921491.4634     -3989.5483     -2325.7046

ENERGY:     109     22394.0521     19651.8555      5740.7059       163.7566        -334323.6679     21623.9120         0.0000         0.0000     42380.9038        -222368.4821       154.1701   -264749.3859   -222289.2483       154.1701          -4162.2877     -2354.5142    921491.4634     -4162.2877     -2354.5142

ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     110     24310.7312     19315.3191      5736.8740       169.5643        -334907.1601     21583.6717         0.0000         0.0000     41568.0399        -222222.9600       151.2131   -263790.9999   -222288.3778       151.2131          -3608.1962     -2356.1915    921491.4634     -3608.1962     -2356.1915

ENERGY:     111     22660.5936     19186.3867      5728.6091       176.9885        -335028.8262     21518.8536         0.0000         0.0000     43385.4035        -222371.9911       157.8242   -265757.3946   -222286.8997       157.8242          -2331.3777     -2338.2312    921491.4634     -2331.3777     -2338.2312

ENERGY:     112     19381.8199     19463.5169      5716.4074       185.3624        -334677.6374     21440.9490         0.0000         0.0000     45860.8185        -222628.7633       166.8291   -268489.5818   -222302.4567       166.8291           -894.2292     -2309.1963    921491.4634      -894.2292     -2309.1963

ENERGY:     113     18216.1582     20180.8084      5702.4491       194.0323        -334046.4825     21376.2232         0.0000         0.0000     45761.5815        -222615.2299       166.4681   -268376.8115   -222273.7400       166.4681            -55.6425     -2273.8625    921491.4634       -55.6425     -2273.8625

ENERGY:     114     19843.9972     21062.4095      5689.3793       202.2945        -333472.4289     21337.7637         0.0000         0.0000     42964.6870        -222371.8976       156.2937   -265336.5847   -222272.2452       156.2937           -128.5963     -2261.6571    921491.4634      -128.5963     -2261.6571

ENERGY:     115     21448.4486     21679.6563      5680.2429       209.5308        -333239.9680     21316.4508         0.0000         0.0000     40710.1056        -222195.5331       148.0922   -262905.6387   -222272.7006       148.0922           -905.3248     -2296.5621    921491.4634      -905.3248     -2296.5621

ENERGY:     116     20838.2583     21694.4197      5677.2615       215.2237        -333429.0369     21301.4964         0.0000         0.0000     41385.0931        -222317.2842       150.5476   -263702.3773   -222276.5257       150.5476          -2000.5240     -2380.1423    921491.4634     -2000.5240     -2380.1423

ENERGY:     117     19309.7303     21105.1712      5681.4214       219.0426        -333858.2254     21295.0742         0.0000         0.0000     43733.0003        -222514.7854       159.0886   -266247.7857   -222254.7025       159.0886          -3196.9893     -2479.5443    921491.4634     -3196.9893     -2479.5443

ENERGY:     118     19488.7485     20180.1711      5691.5867       220.7069        -334305.8418     21303.6951         0.0000         0.0000     44852.5145        -222568.4190       163.1611   -267420.9335   -222257.5957       163.1611          -4287.8518     -2560.8626    921491.4634     -4287.8518     -2560.8626

ENERGY:     119     21608.8170     19327.4368      5705.7183       220.1523        -334582.5766     21318.6507         0.0000         0.0000     43971.5398        -222430.2617       159.9564   -266401.8015   -222258.7219       159.9564          -4948.0951     -2603.4635    921491.4634     -4948.0951     -2603.4635

LDB: ============= START OF LOAD BALANCING ============== 60.3581
LDB: ============== END OF LOAD BALANCING =============== 60.3581
Info: useSync: 1 useProxySync: 0
LDB: =============== DONE WITH MIGRATION ================ 60.3586
TIMING: 120  CPU: 57.755, 0.471671/step  Wall: 57.755, 0.471671/step, 0.0497875 hours remaining, 3219.644531 MB of memory in use.
ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     120     23278.7482     18843.5008      5721.1111       217.5091        -334559.3219     21317.8986         0.0000         0.0000     42838.0030        -222342.5510       155.8329   -265180.5540   -222260.9693       155.8329          -4802.3838     -2609.8233    921491.4634     -4802.3838     -2609.8233

ENERGY:     121     22753.8286     18833.9839      5735.1155       213.1885        -334109.3886     21287.1663         0.0000         0.0000     42902.9082        -222383.1976       156.0690   -265286.1058   -222238.8455       156.0690          -3789.7329     -2573.0324    921491.4634     -3789.7329     -2573.0324

ENERGY:     122     20911.3204     19183.7910      5744.9150       207.6394        -333246.0910     21235.0876         0.0000         0.0000     43471.2678        -222492.0697       158.1365   -265963.3376   -222236.2048       158.1365          -2259.2351     -2503.9466    921491.4634     -2259.2351     -2503.9466

ENERGY:     123     19716.6567     19702.2261      5748.9495       201.5075        -332195.6665     21181.3173         0.0000         0.0000     43159.1486        -222485.8609       157.0011   -265645.0095   -222233.3015       157.0011           -827.7759     -2423.1752    921491.4634      -827.7759     -2423.1752

ENERGY:     124     19701.7331     20151.8502      5747.1965       195.4812        -331340.9825     21138.0468         0.0000         0.0000     42008.6529        -222398.0218       152.8159   -264406.6747   -222234.8509       152.8159              8.3515     -2371.2952    921491.4634         8.3515     -2371.2952

ENERGY:     125     19961.8490     20319.7042      5741.5018       190.2907        -331002.3876     21106.9631         0.0000         0.0000     41347.6159        -222334.4629       150.4113   -263682.0788   -222218.5352       150.4113             16.1239     -2370.5229    921491.4634        16.1239     -2370.5229

ENERGY:     126     19913.8781     20060.3740      5734.4101       186.3237        -331257.3388     21089.4917         0.0000         0.0000     41888.6056        -222384.2557       152.3792   -264272.8613   -222220.0405       152.3792           -757.3346     -2430.8872    921491.4634      -757.3346     -2430.8872

ENERGY:     127     20034.1247     19457.5519      5728.8730       183.8512        -331985.2681     21088.4980         0.0000         0.0000     43047.2721        -222445.0973       156.5941   -265492.3694   -222223.2518       156.5941          -2122.5054     -2533.3235    921491.4634     -2122.5054     -2533.3235

ENERGY:     128     20681.9268     18818.3078      5727.0308       182.9174        -332977.2827     21101.0436         0.0000         0.0000     44006.3126        -222459.7437       160.0829   -266466.0563   -222232.5707       160.0829          -3698.9565     -2655.1908    921491.4634     -3698.9565     -2655.1908

ENERGY:     129     21368.2885     18554.7976      5729.8505       183.4688        -333997.8250     21115.0501         0.0000         0.0000     44607.0894        -222439.2801       162.2683   -267046.3695   -222215.2565       162.2683          -4993.9820     -2763.9222    921491.4634     -4993.9820     -2763.9222

ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     130     21553.6087     18898.7761      5736.4508       185.0194        -334776.0137     21118.0422         0.0000         0.0000     44811.1498        -222472.9666       163.0106   -267284.1164   -222216.5364       163.0106          -5536.0554     -2842.3154    921491.4634     -5536.0554     -2842.3154

ENERGY:     131     21530.9955     19804.6628      5745.0872       187.0957        -335083.2644     21105.7069         0.0000         0.0000     44221.5104        -222488.2059       160.8657   -266709.7162   -222215.1804       160.8657          -5164.7863     -2872.9597    921491.4634     -5164.7863     -2872.9597

ENERGY:     132     21696.5184     20951.9798      5753.4447       189.2233        -334841.7369     21081.3851         0.0000         0.0000     42732.1267        -222437.0590       155.4477   -265169.1857   -222222.8146       155.4477          -4015.6410     -2856.5553    921491.4634     -4015.6410     -2856.5553

ENERGY:     133     21569.7011     21939.4306      5759.4053       191.1377        -334187.7139     21049.8506         0.0000         0.0000     41346.5715        -222331.6172       150.4075   -263678.1887   -222209.0242       150.4075          -2436.6193     -2806.2333    921491.4634     -2436.6193     -2806.2333

ENERGY:     134     20380.1720     22407.7422      5761.0449       192.4922        -333420.8526     21018.0949         0.0000         0.0000     41320.1609        -222341.1455       150.3114   -263661.3064   -222206.0447       150.3114           -846.9781     -2759.4267    921491.4634      -846.9781     -2759.4267

ENERGY:     135     18735.1493     22221.9400      5757.7067       193.2251        -332860.3441     20999.0422         0.0000         0.0000     42497.1277        -222456.1530       154.5929   -264953.2807   -222204.4870       154.5929            191.9083     -2745.1432    921491.4634       191.9083     -2745.1432

ENERGY:     136     18381.4540     21453.0791      5750.0867       193.4037        -332655.7484     21006.3295         0.0000         0.0000     43348.3541        -222523.0414       157.6894   -265871.3955   -222211.0690       157.6894            198.1851     -2776.3542    921491.4634       198.1851     -2776.3542

ENERGY:     137     19975.5715     20347.8312      5740.3098       193.2572        -332832.5914     21040.1067         0.0000         0.0000     43092.4470        -222443.0679       156.7585   -265535.5149   -222209.8934       156.7585           -927.2501     -2841.0684    921491.4634      -927.2501     -2841.0684

ENERGY:     138     21874.8524     19195.4801      5730.8549       192.8766        -333203.4339     21083.5324         0.0000         0.0000     42784.9640        -222340.8735       155.6399   -265125.8375   -222213.1811       155.6399          -2704.7054     -2927.3524    921491.4634     -2704.7054     -2927.3524

ENERGY:     139     22116.0295     18330.1124      5724.2506       192.4679        -333575.3357     21115.6333         0.0000         0.0000     43705.6789        -222391.1632       158.9892   -266096.8421   -222217.3484       158.9892          -4443.4106     -3015.1527    921491.4634     -4443.4106     -3015.1527

TIMING: 140  CPU: 67.1779, 0.471148/step  Wall: 67.1779, 0.471148/step, 0.0471148 hours remaining, 3219.835938 MB of memory in use.
ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     140     20992.5976     17997.1577      5722.1741       192.2140        -333726.9441     21127.4061         0.0000         0.0000     45144.2513        -222551.1433       164.2224   -267695.3946   -222224.0361       164.2224          -5617.7626     -3080.3638    921491.4634     -5617.7626     -3080.3638

ENERGY:     141     20605.2148     18251.9195      5725.3083       192.2642        -333525.1324     21120.3060         0.0000         0.0000     45039.8864        -222590.2331       163.8427   -267630.1195   -222215.3920       163.8427          -6017.5038     -3087.0005    921491.4634     -6017.5038     -3087.0005

ENERGY:     142     21702.7400     18860.4298      5732.9228       192.6003        -332879.0280     21093.2714         0.0000         0.0000     42868.0674        -222428.9962       155.9422   -265297.0636   -222213.3920       155.9422          -5532.0376     -3029.5546    921491.4634     -5532.0376     -3029.5546

ENERGY:     143     22457.6180     19468.7636      5743.5741       193.1827        -331957.5932     21040.0377         0.0000         0.0000     40797.9948        -222256.4223       148.4119   -263054.4171   -222209.6223       148.4119          -4179.8277     -2928.5086    921491.4634     -4179.8277     -2928.5086

ENERGY:     144     21007.3340     19787.0058      5755.2166       193.9151        -331097.8395     20965.2215         0.0000         0.0000     41087.3102        -222301.8363       149.4643   -263389.1465   -222194.0939       149.4643          -2265.2408     -2825.3503    921491.4634     -2265.2408     -2825.3503

ENERGY:     145     18390.7600     19760.7603      5765.7577       194.6436        -330692.1921     20892.9233         0.0000         0.0000     43191.0818        -222496.2654       157.1173   -265687.3472   -222180.9591       157.1173           -495.5029     -2742.5238    921491.4634      -495.5029     -2742.5238

ENERGY:     146     17494.3905     19517.0964      5773.0763       195.1974        -330883.4474     20850.7305         0.0000         0.0000     44468.0627        -222584.8935       161.7626   -267052.9562   -222180.0851       161.7626            380.5832     -2698.3695    921491.4634       380.5832     -2698.3695

ENERGY:     147     19349.0814     19284.4052      5776.1299       195.3841        -331633.2790     20843.7952         0.0000         0.0000     43729.9298        -222454.5532       159.0775   -266184.4831   -222180.7854       159.0775             12.4496     -2697.6200    921491.4634        12.4496     -2697.6200

ENERGY:     148     21731.1608     19240.1452      5775.1361       195.0156        -332748.3459     20852.0477         0.0000         0.0000     42647.1434        -222307.6970       155.1386   -264954.8404   -222173.9040       155.1386          -1313.5162     -2742.2255    921491.4634     -1313.5162     -2742.2255

ENERGY:     149     22154.0981     19476.6233      5771.6403       193.9272        -333952.9654     20853.5363         0.0000         0.0000     43165.2620        -222337.8782       157.0234   -265503.1403   -222149.8010       157.0234          -2998.4811     -2814.2281    921491.4634     -2998.4811     -2814.2281

ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     150     21015.8992     19956.3835      5767.3089       192.0924        -334899.3753     20845.5771         0.0000         0.0000     44606.5897        -222515.5243       162.2665   -267122.1141   -222153.2665       162.2665          -4472.9373     -2881.9211    921491.4634     -4472.9373     -2881.9211

ENERGY:     151     20656.1100     20586.9276      5763.7530       189.5631        -335303.4336     20835.7247         0.0000         0.0000     44710.6379        -222560.7174       162.6450   -267271.3553   -222155.1378       162.6450          -5407.8406     -2907.6330    921491.4634     -5407.8406     -2907.6330

ENERGY:     152     21757.0223     21203.4203      5761.8055       186.4838        -335072.1088     20820.7501         0.0000         0.0000     42914.6705        -222427.9563       156.1118   -265342.6268   -222175.0515       156.1118          -5552.0272     -2878.0876    921491.4634     -5552.0272     -2878.0876

ENERGY:     153     22396.4537     21618.6022      5761.5688       183.0547        -334307.6860     20787.1624         0.0000         0.0000     41296.2811        -222264.5631       150.2245   -263560.8442   -222152.0203       150.2245          -4765.4778     -2800.4122    921491.4634     -4765.4778     -2800.4122

ENERGY:     154     20952.1344     21640.3346      5761.9239       179.5647        -333344.9136     20735.3659         0.0000         0.0000     41746.1292        -222329.4608       151.8609   -264075.5900   -222148.7915       151.8609          -3178.1876     -2707.3606    921491.4634     -3178.1876     -2707.3606

ENERGY:     155     18734.5492     21249.5939      5761.4993       176.3183        -332564.0956     20691.4724         0.0000         0.0000     43448.4575        -222502.2051       158.0535   -265950.6625   -222145.9854       158.0535          -1408.3065     -2623.9033    921491.4634     -1408.3065     -2623.9033

ENERGY:     156     18312.4484     20599.9072      5758.8570       173.6449        -332218.9144     20684.3829         0.0000         0.0000     44137.5523        -222552.1216       160.5603   -266689.6739   -222166.8045       160.5603           -219.5096     -2571.5313    921491.4634      -219.5096     -2571.5313

ENERGY:     157     20043.0837     19943.2665      5753.0947       171.8900        -332363.0655     20715.7865         0.0000         0.0000     43325.6935        -222410.2508       157.6070   -265735.9443   -222155.5007       157.6070            -38.8543     -2554.7665    921491.4634       -38.8543     -2554.7665

ENERGY:     158     21695.0845     19425.3239      5743.5667       171.3409        -332829.8098     20761.5805         0.0000         0.0000     42713.6821        -222319.2313       155.3806   -265032.9134   -222157.3218       155.3806           -715.5935     -2586.7969    921491.4634      -715.5935     -2586.7969

ENERGY:     159     21695.6535     19084.6410      5730.9315       172.1899        -333376.4003     20800.7929         0.0000         0.0000     43483.6005        -222408.5910       158.1814   -265892.1915   -222160.0967       158.1814          -1882.1012     -2660.7875    921491.4634     -1882.1012     -2660.7875

TIMING: 160  CPU: 76.5914, 0.470673/step  Wall: 76.5914, 0.470673/step, 0.0444524 hours remaining, 3220.000000 MB of memory in use.
ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     160     21093.2843     18859.3046      5717.0749       174.4915        -333735.9153     20833.5471         0.0000         0.0000     44515.8596        -222542.3532       161.9365   -267058.2128   -222175.6785       161.9365          -3202.8705     -2752.7604    921491.4634     -3202.8705     -2752.7604

ENERGY:     161     21561.6002     18685.5960      5704.9782       178.2042        -333710.7596     20865.7132         0.0000         0.0000     44220.7113        -222493.9565       160.8628   -266714.6678   -222160.9737       160.8628          -4385.1102     -2823.4851    921491.4634     -4385.1102     -2823.4851

ENERGY:     162     22512.8125     18508.1494      5697.2826       183.0024        -333202.6496     20887.8856         0.0000         0.0000     43070.6067        -222342.9103       156.6790   -265413.5170   -222161.4905       156.6790          -5004.1554     -2859.8871    921491.4634     -5004.1554     -2859.8871

ENERGY:     163     21937.9852     18346.8657      5696.1509       188.4544        -332368.8224     20884.6196         0.0000         0.0000     43005.6962        -222309.0504       156.4429   -265314.7466   -222160.7800       156.4429          -4776.8220     -2868.7270    921491.4634     -4776.8220     -2868.7270

ENERGY:     164     19652.8066     18261.0400      5702.5306       194.0206        -331567.4468     20861.9109         0.0000         0.0000     44426.5345        -222468.6036       161.6115   -266895.1381   -222170.9032       161.6115          -3836.1733     -2870.4449    921491.4634     -3836.1733     -2870.4449

ENERGY:     165     18074.0952     18343.8150      5716.1638       199.2019        -331183.0465     20849.6743         0.0000         0.0000     45425.8564        -222574.2399       165.2468   -268000.0963   -222153.1696       165.2468          -2737.5186     -2867.1446    921491.4634     -2737.5186     -2867.1446

ENERGY:     166     18979.7069     18650.1654      5734.9735       203.3281        -331407.1001     20870.8939         0.0000         0.0000     44483.6890        -222484.3433       161.8194   -266968.0323   -222151.2325       161.8194          -1964.3636     -2870.3839    921491.4634     -1964.3636     -2870.3839

ENERGY:     167     21026.8306     19216.2867      5755.9248       205.8794        -332212.1859     20917.6388         0.0000         0.0000     42775.8063        -222313.8193       155.6066   -265089.6256   -222150.5296       155.6066          -1671.2498     -2889.5868    921491.4634     -1671.2498     -2889.5868

ENERGY:     168     21619.4180     19999.6889      5775.3367       206.4584        -333382.4925     20963.4338         0.0000         0.0000     42492.3351        -222325.8216       154.5754   -264818.1567   -222149.7707       154.5754          -1735.9904     -2933.5976    921491.4634     -1735.9904     -2933.5976

ENERGY:     169     20648.4664     20870.4069      5789.9166       204.9287        -334596.5068     20994.5722         0.0000         0.0000     43600.1909        -222488.0251       158.6055   -266088.2160   -222133.5315       158.6055          -2095.8775     -2988.7947    921491.4634     -2095.8775     -2988.7947

ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     170     20485.0013     21574.3800      5797.0542       201.1981        -335480.2499     21017.8094         0.0000         0.0000     43834.2688        -222570.5381       159.4570   -266404.8069   -222135.2420       159.4570          -2696.1966     -3030.4960    921491.4634     -2696.1966     -3030.4960

ENERGY:     171     22225.3640     21884.1726      5796.1347       195.5169        -335757.0012     21036.7487         0.0000         0.0000     42205.8539        -222413.2104       153.5333   -264619.0643   -222135.5891       153.5333          -3373.1625     -3035.3577    921491.4634     -3373.1625     -3035.3577

ENERGY:     172     23612.5240     21689.2904      5788.4217       188.3823        -335345.7506     21036.2039         0.0000         0.0000     40787.7257        -222243.2027       148.3745   -263030.9283   -222132.3043       148.3745          -3754.4379     -3004.4812    921491.4634     -3754.4379     -3004.4812

ENERGY:     173     22089.5491     21081.4670      5776.7002       180.5475        -334414.6776     21003.0505         0.0000         0.0000     41986.3986        -222296.9647       152.7350   -264283.3633   -222121.1461       152.7350          -3608.5986     -2944.3814    921491.4634     -3608.5986     -2944.3814

ENERGY:     174     18699.8473     20250.6916      5763.7521       172.7179        -333314.9341     20954.5022         0.0000         0.0000     44924.4953        -222548.9278       163.4230   -267473.4231   -222120.6679       163.4230          -3086.0087     -2871.4631    921491.4634     -3086.0087     -2871.4631

ENERGY:     175     17219.9376     19455.5735      5752.1494       165.6559        -332464.6996     20928.3117         0.0000         0.0000     46291.0145        -222652.0570       168.3940   -268943.0715   -222120.1886       168.3940          -2676.4055     -2794.4451    921491.4634     -2676.4055     -2794.4451

ENERGY:     176     19195.1038     18891.7629      5743.5896       160.0071        -332124.2127     20943.2095         0.0000         0.0000     44722.5121        -222468.0277       162.6882   -267190.5398   -222127.3369       162.6882          -2658.3221     -2727.5044    921491.4634     -2658.3221     -2727.5044

ENERGY:     177     21863.3194     18664.1736      5738.9484       156.2659        -332371.2411     20981.6518         0.0000         0.0000     42714.2625        -222252.6195       155.3827   -264966.8820   -222125.5136       155.3827          -2870.6846     -2681.8089    921491.4634     -2870.6846     -2681.8089

ENERGY:     178     21917.7899     18733.9560      5737.6245       154.5770        -332975.2974     21015.2132         0.0000         0.0000     43101.1545        -222314.9824       156.7902   -265416.1369   -222126.1321       156.7902          -2936.2256     -2665.7683    921491.4634     -2936.2256     -2665.7683

ENERGY:     179     20058.5719     19018.0840      5738.2698       154.9022        -333648.1817     21038.3003         0.0000         0.0000     45070.9163        -222569.1371       163.9556   -267640.0535   -222127.1793       163.9556          -2805.2707     -2668.3444    921491.4634     -2805.2707     -2668.3444

TIMING: 180  CPU: 85.9918, 0.47002/step  Wall: 85.9918, 0.47002/step, 0.0417796 hours remaining, 3220.140625 MB of memory in use.
ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     180     19770.2943     19384.7964      5738.8341       156.9935        -334084.3523     21065.2916         0.0000         0.0000     45324.2213        -222643.9211       164.8771   -267968.1424   -222142.6344       164.8771          -2684.8629     -2671.3561    921491.4634     -2684.8629     -2671.3561

ENERGY:     181     22122.8094     19693.8083      5737.3498       160.4696        -334134.1967     21097.1422         0.0000         0.0000     42906.0429        -222416.5745       156.0804   -265322.6175   -222134.4681       156.0804          -2655.0378     -2656.7563    921491.4634     -2655.0378     -2656.7563

ENERGY:     182     23922.3456     19800.0773      5732.0748       164.8150        -333691.2983     21109.5293         0.0000         0.0000     40770.0180        -222192.4383       148.3101   -262962.4564   -222132.7634       148.3101          -2461.5986     -2635.7203    921491.4634     -2461.5986     -2635.7203

ENERGY:     183     22149.3486     19677.1534      5722.7616       169.5349        -332921.8737     21084.4911         0.0000         0.0000     41834.8235        -222283.7606       152.1836   -264118.5842   -222131.2590       152.1836          -1990.8046     -2626.5158    921491.4634     -1990.8046     -2626.5158

ENERGY:     184     18376.8757     19424.9915      5710.5469       174.1844        -332181.9080     21042.4479         0.0000         0.0000     44880.5528        -222572.3088       163.2631   -267452.8617   -222144.6140       163.2631          -1576.6177     -2645.2274    921491.4634     -1576.6177     -2645.2274

ENERGY:     185     16957.7745     19234.6873      5697.7241       178.4155        -331895.6961     21023.9443         0.0000         0.0000     46149.4989        -222653.6516       167.8792   -268803.1505   -222128.1654       167.8792          -1752.9884     -2679.2077    921491.4634     -1752.9884     -2679.2077

ENERGY:     186     19266.0406     19234.9571      5686.4352       181.9571        -332240.0936     21043.7459         0.0000         0.0000     44391.5889        -222435.3689       161.4844   -266826.9578   -222129.2885       161.4844          -2596.4733     -2731.4263    921491.4634     -2596.4733     -2731.4263

ENERGY:     187     22073.2967     19471.4303      5678.7398       184.6336        -333156.1125     21076.9264         0.0000         0.0000     42449.0057        -222222.0799       154.4178   -264671.0856   -222130.9077       154.4178          -3641.8536     -2802.0867    921491.4634     -3641.8536     -2802.0867

ENERGY:     188     22101.1830     19886.6773      5676.0120       186.3502        -334382.7609     21093.9044         0.0000         0.0000     43113.1616        -222325.4724       156.8338   -265438.6340   -222135.3906       156.8338          -4316.2655     -2887.0591    921491.4634     -4316.2655     -2887.0591

ENERGY:     189     20394.2462     20391.8602      5678.8863       187.1154        -335558.5037     21096.5840         0.0000         0.0000     45245.6388        -222564.1729       164.5912   -267809.8117   -222116.4321       164.5912          -4451.6370     -2950.0786    921491.4634     -4451.6370     -2950.0786

ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     190     20342.0726     20848.4448      5686.3598       187.0164        -336318.7429     21106.5487         0.0000         0.0000     45533.2635        -222615.0372       165.6375   -268148.3007   -222116.1588       165.6375          -4141.9210     -2962.8210    921491.4634     -4141.9210     -2962.8210

ENERGY:     191     22534.8505     21157.2826      5696.5257       186.2614        -336419.5247     21124.8644         0.0000         0.0000     43330.7337        -222389.0065       157.6253   -265719.7402   -222114.1138       157.6253          -3471.5976     -2915.5481    921491.4634     -3471.5976     -2915.5481

ENERGY:     192     23768.4829     21244.3747      5706.8010       185.1520        -335814.4789     21125.1403         0.0000         0.0000     41560.2539        -222224.2740       151.1848   -263784.5279   -222108.6417       151.1848          -2412.4655     -2830.7902    921491.4634     -2412.4655     -2830.7902

ENERGY:     193     21710.8594     21097.1072      5714.9848       184.0569        -334711.3256     21092.9042         0.0000         0.0000     42578.8350        -222332.5782       154.8901   -264911.4131   -222093.8902       154.8901          -1181.4694     -2735.1546    921491.4634     -1181.4694     -2735.1546

ENERGY:     194     18383.3649     20711.5281      5719.3482       183.2863        -333492.4630     21054.1040         0.0000         0.0000     44867.8136        -222573.0179       163.2168   -267440.8315   -222092.1688       163.2168           -314.8316     -2651.4482    921491.4634      -314.8316     -2651.4482

ENERGY:     195     17581.7012     20169.9816      5719.7968       183.0839        -332603.8307     21048.2209         0.0000         0.0000     45307.7485        -222593.2979       164.8171   -267901.0464   -222091.6060       164.8171           -398.0878     -2592.7756    921491.4634      -398.0878     -2592.7756

ENERGY:     196     19755.8662     19594.9321      5717.4229       183.5644        -332319.6949     21082.8579         0.0000         0.0000     43603.6155        -222381.4360       158.6180   -265985.0515   -222096.3126       158.6180          -1480.5940     -2574.8092    921491.4634     -1480.5940     -2574.8092

ENERGY:     197     21700.3669     19122.7581      5714.1451       184.7200        -332668.2729     21129.4587         0.0000         0.0000     42574.3654        -222242.4586       154.8738   -264816.8241   -222086.7179       154.8738          -3040.7437     -2596.5494    921491.4634     -3040.7437     -2596.5494

ENERGY:     198     21224.0060     18800.3006      5711.3574       186.3640        -333385.4996     21161.1533         0.0000         0.0000     43911.2863        -222391.0319       159.7372   -266302.3182   -222090.4391       159.7372          -4381.6808     -2646.7679    921491.4634     -4381.6808     -2646.7679

ENERGY:     199     20113.4048     18634.4040      5710.3429       188.2374        -334151.8585     21182.1776         0.0000         0.0000     45722.9588        -222600.3329       166.3276   -268323.2917   -222093.2750       166.3276          -5152.2285     -2691.5412    921491.4634     -5152.2285     -2691.5412

LDB: ============= START OF LOAD BALANCING ============== 97.9956
LDB: Largest compute 200 load 0.424219 is 1.2% of average load 36.692205
LDB: Average compute 0.051421 is 0.1% of average load 36.692205
LDB: TIME 97.9976 LOAD: AVG 36.6922 MAX 37.637  PROXIES: TOTAL 112 MAXPE 28 MAXPATCH 1 None MEM: 3220.48 MB
LDB: TIME 97.9997 LOAD: AVG 36.6922 MAX 37.6328  PROXIES: TOTAL 112 MAXPE 28 MAXPATCH 1 TorusLB MEM: 3220.48 MB
LDB: ============== END OF LOAD BALANCING =============== 98.0015
Info: useSync: 1 useProxySync: 0
LDB: =============== DONE WITH MIGRATION ================ 98.0046
Info: Initial time: 4 CPUs 0.470642 s/step 5.44725 days/ns 3221.57 MB memory
TIMING: 200  CPU: 95.3956, 0.470188/step  Wall: 95.3956, 0.470188/step, 0.0391823 hours remaining, 3221.570312 MB of memory in use.
ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     200     21073.6836     18595.6349      5711.8747       190.0258        -334670.2810     21209.9247         0.0000         0.0000     45319.1601        -222569.9771       164.8586   -267889.1372   -222114.5244       164.8586          -5241.8525     -2703.6813    921491.4634     -5241.8525     -2703.6813

ENERGY:     201     23380.1029     18674.3333      5716.2802       191.4189        -334751.7130     21239.1340         0.0000         0.0000     43222.4696        -222327.9742       157.2315   -265550.4438   -222100.1078       157.2315          -4546.2004     -2661.1900    921491.4634     -4546.2004     -2661.1900

ENERGY:     202     23622.8115     18850.8449      5722.5980       192.1474        -334305.3006     21243.2751         0.0000         0.0000     42432.5589        -222241.0647       154.3580   -264673.6236   -222096.8290       154.3580          -3005.0518     -2588.0014    921491.4634     -3005.0518     -2588.0014

ENERGY:     203     20743.8945     19130.0390      5729.2400       192.0764        -333501.9373     21215.8253         0.0000         0.0000     44059.6987        -222431.1634       160.2771   -266490.8621   -222093.6427       160.2771          -1046.8258     -2512.4435    921491.4634     -1046.8258     -2512.4435

ENERGY:     204     17862.6125     19486.9556      5734.1463       191.2124        -332722.2199     21188.8402         0.0000         0.0000     45629.4719        -222628.9809       165.9875   -268258.4528   -222116.7001       165.9875            452.9932     -2462.2929    921491.4634       452.9932     -2462.2929

ENERGY:     205     18189.0791     19868.9414      5735.7153       189.6741        -332398.2550     21197.9185         0.0000         0.0000     44690.7149        -222526.2116       162.5725   -267216.9266   -222099.8060       162.5725            731.8534     -2447.6353    921491.4634       731.8534     -2447.6353

ENERGY:     206     20668.8901     20170.9986      5732.9811       187.6404        -332716.3433     21241.8391         0.0000         0.0000     42439.0585        -222274.9356       154.3816   -264713.9941   -222100.3397       154.3816           -230.6569     -2488.2937    921491.4634      -230.6569     -2488.2937

ENERGY:     207     21693.8031     20338.2891      5726.5434       185.3060        -333603.9790     21289.9001         0.0000         0.0000     42143.6914        -222226.4458       153.3072   -264370.1373   -222103.0931       153.3072          -1896.3478     -2585.9683    921491.4634     -1896.3478     -2585.9683

ENERGY:     208     20293.2703     20371.8903      5718.1572       182.8654        -334789.2376     21322.2410         0.0000         0.0000     44428.6270        -222472.1864       161.6191   -266900.8134   -222122.6313       161.6191          -3669.0642     -2719.7951    921491.4634     -3669.0642     -2719.7951

ENERGY:     209     19428.8171     20325.0058      5710.3389       180.5135        -335910.2412     21349.5044         0.0000         0.0000     46273.6801        -222642.3814       168.3309   -268916.0615   -222106.7900       168.3309          -5197.7273     -2836.6305    921491.4634     -5197.7273     -2836.6305

ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     210     21385.1734     20194.2568      5705.3139       178.4614        -336615.7767     21385.1096         0.0000         0.0000     45251.4335        -222516.0281       164.6123   -267767.4616   -222108.2015       164.6123          -6091.3662     -2896.2627    921491.4634     -6091.3662     -2896.2627

ENERGY:     211     24099.1927     19985.8631      5704.9373       176.9105        -336667.8926     21415.1477         0.0000         0.0000     43031.7287        -222254.1128       156.5376   -265285.8414   -222106.8540       156.5376          -5900.2976     -2885.1010    921491.4634     -5900.2976     -2885.1010

ENERGY:     212     23739.2709     19730.8222      5710.0295       176.0352        -336013.6225     21412.5983         0.0000         0.0000     42995.1640        -222249.7025       156.4046   -265244.8665   -222104.2317       156.4046          -4424.1001     -2820.3210    921491.4634     -4424.1001     -2820.3210

ENERGY:     213     20150.2161     19524.5248      5720.1722       175.9508        -334874.6442     21380.5552         0.0000         0.0000     45418.7806        -222504.4446       165.2210   -267923.2252   -222097.3834       165.2210          -2174.3117     -2725.0841    921491.4634     -2174.3117     -2725.0841

ENERGY:     214     17315.5529     19421.7448      5733.3059       176.6827        -333645.3936     21358.4485         0.0000         0.0000     46958.4702        -222681.1884       170.8220   -269639.6586   -222093.7406       170.8220           -143.6685     -2626.0578    921491.4634      -143.6685     -2626.0578

ENERGY:     215     18210.5055     19441.9744      5746.5772       178.1492        -332787.3322     21379.5596         0.0000         0.0000     45302.6746        -222527.8916       164.7987   -267830.5662   -222091.0446       164.7987            784.0014     -2554.0368    921491.4634       784.0014     -2554.0368

ENERGY:     216     20973.4716     19522.5063      5756.9571       180.1770        -332560.1063     21436.4836         0.0000         0.0000     42442.1788        -222248.3318       154.3930   -264690.5106   -222073.6156       154.3930            420.9901     -2541.5428    921491.4634       420.9901     -2541.5428

ENERGY:     217     21778.3867     19581.4822      5762.2416       182.5517        -333010.6759     21497.2706         0.0000         0.0000     41983.6750        -222225.0683       152.7251   -264208.7433   -222064.4464       152.7251           -882.1699     -2598.7244    921491.4634      -882.1699     -2598.7244

ENERGY:     218     20165.9157     19540.0892      5761.2415       184.9927        -333856.1149     21546.6561         0.0000         0.0000     44178.6836        -222478.5361       160.7099   -266657.2196   -222068.8155       160.7099          -2628.0653     -2703.9747    921491.4634     -2628.0653     -2703.9747

ENERGY:     219     19429.8640     19413.3932      5754.3577       187.2447        -334778.0710     21596.8808         0.0000         0.0000     45751.9298        -222644.4007       166.4329   -268396.3305   -222073.1720       166.4329          -4457.7332     -2810.5237    921491.4634     -4457.7332     -2810.5237

TIMING: 220  CPU: 104.846, 0.472511/step  Wall: 104.846, 0.472511/step, 0.0367509 hours remaining, 3221.570312 MB of memory in use.
ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     220     21580.9144     19260.1137      5743.1672       189.1021        -335473.8432     21655.3184         0.0000         0.0000     44539.5741        -222505.6535       162.0227   -267045.2276   -222092.6289       162.0227          -5898.3511     -2876.6577    921491.4634     -5898.3511     -2876.6577

ENERGY:     221     24234.7390     19146.8279      5730.1601       190.4777        -335718.7276     21699.4244         0.0000         0.0000     42467.0192        -222250.0793       154.4833   -264717.0985   -222077.7835       154.4833          -6342.7097     -2884.3552    921491.4634     -6342.7097     -2884.3552

ENERGY:     222     23735.1223     19085.7308      5717.7679       191.2893        -335388.9915     21700.3077         0.0000         0.0000     42702.0392        -222256.7343       155.3383   -264958.7735   -222075.6638       155.3383          -5368.7279     -2838.7017    921491.4634     -5368.7279     -2838.7017

ENERGY:     223     20286.4336     19110.8426      5708.3528       191.5579        -334633.3914     21665.5242         0.0000         0.0000     45168.7534        -222501.9269       164.3115   -267670.6803   -222072.2457       164.3115          -3322.8076     -2753.9475    921491.4634     -3322.8076     -2753.9475

ENERGY:     224     17721.9819     19276.3017      5703.4616       191.3517        -333831.1560     21637.4893         0.0000         0.0000     46650.8782        -222649.6916       169.7031   -269300.5698   -222098.2846       169.7031          -1151.0970     -2650.6854    921491.4634     -1151.0970     -2650.6854

ENERGY:     225     18451.5609     19639.7349      5703.5482       190.8347        -333424.4649     21647.4588         0.0000         0.0000     45301.5807        -222489.7467       164.7947   -267791.3275   -222079.9378       164.7947            226.2572     -2563.9720    921491.4634       226.2572     -2563.9720

ENERGY:     226     20569.7731     20147.6375      5707.2430       190.0457        -333606.5695     21686.9380         0.0000         0.0000     43034.1680        -222270.7642       156.5465   -265304.9322   -222078.6803       156.5465            530.9032     -2526.3323    921491.4634       530.9032     -2526.3323

ENERGY:     227     21011.1676     20670.4533      5712.3895       189.0770        -334317.7221     21728.2283         0.0000         0.0000     42721.7946        -222284.6118       155.4101   -265006.4065   -222080.2096       155.4101           -104.6490     -2553.6074    921491.4634      -104.6490     -2553.6074

ENERGY:     228     19866.2928     21035.8345      5716.6482       188.0081        -335312.4267     21761.2923         0.0000         0.0000     44242.5386        -222501.8122       160.9422   -266744.3509   -222102.7891       160.9422          -1440.0182     -2625.9673    921491.4634     -1440.0182     -2625.9673

ENERGY:     229     19874.0813     21137.5587      5718.5477       187.0043        -336264.4468     21796.8119         0.0000         0.0000     44976.5837        -222573.8590       163.6125   -267550.4427   -222086.0489       163.6125          -3234.4607     -2710.7215    921491.4634     -3234.4607     -2710.7215

ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     230     21999.2455     20926.2538      5717.1889       185.9786        -336838.6565     21834.6450         0.0000         0.0000     43751.0554        -222424.2893       159.1543   -266175.3447   -222088.6908       159.1543          -4902.3779     -2766.0557    921491.4634     -4902.3779     -2766.0557

ENERGY:     231     23806.6617     20470.3273      5713.0793       184.9073        -336794.0752     21849.7233         0.0000         0.0000     42506.4017        -222262.9746       154.6266   -264769.3764   -222089.4821       154.6266          -5730.6841     -2773.7615    921491.4634     -5730.6841     -2773.7615

ENERGY:     232     22812.6531     19886.6601      5707.7133       183.7520        -336072.1015     21820.0135         0.0000         0.0000     43315.5695        -222345.7399       157.5701   -265661.3095   -222098.2752       157.5701          -5301.5936     -2731.4986    921491.4634     -5301.5936     -2731.4986

ENERGY:     233     20035.6404     19318.2043      5703.4910       182.6157        -334889.2830     21760.7376         0.0000         0.0000     45350.0989        -222538.4951       164.9712   -267888.5940   -222089.6820       164.9712          -3899.2116     -2646.7386    921491.4634     -3899.2116     -2646.7386

ENERGY:     234     18553.6066     18856.0076      5702.3325       181.3395        -333642.4871     21712.9298         0.0000         0.0000     46049.0874        -222587.1837       167.5139   -268636.2711   -222086.3328       167.5139          -2187.7192     -2534.9736    921491.4634     -2187.7192     -2534.9736

ENERGY:     235     19419.0964     18603.4162      5705.8180       179.9133        -332789.1748     21702.6095         0.0000         0.0000     44750.4959        -222427.8255       162.7900   -267178.3214   -222083.1201       162.7900           -820.1736     -2429.4348    921491.4634      -820.1736     -2429.4348

ENERGY:     236     20566.0776     18629.1001      5714.2865       178.3391        -332585.8844     21721.5011         0.0000         0.0000     43477.4015        -222299.1784       158.1588   -265776.5799   -222073.0116       158.1588           -108.6482     -2371.7043    921491.4634      -108.6482     -2371.7043

ENERGY:     237     20196.0057     18940.2031      5726.8243       176.7459        -333068.3182     21749.0156         0.0000         0.0000     43898.3781        -222381.1456       159.6902   -266279.5237   -222063.3602       159.6902           -172.1587     -2373.2011    921491.4634      -172.1587     -2373.2011

ENERGY:     238     19419.4413     19404.0884      5740.6977       175.0128        -333964.3148     21778.9043         0.0000         0.0000     44901.2437        -222544.9266       163.3384   -267446.1704   -222065.9774       163.3384           -987.6012     -2425.5309    921491.4634      -987.6012     -2425.5309

ENERGY:     239     20428.8616     19846.5440      5752.8836       173.1946        -334966.8374     21816.7508         0.0000         0.0000     44416.4634        -222532.1394       161.5749   -266948.6028   -222068.9822       161.5749          -2385.1780     -2499.0795    921491.4634     -2385.1780     -2499.0795

TIMING: 240  CPU: 114.288, 0.47211/step  Wall: 114.288, 0.47211/step, 0.0340968 hours remaining, 3221.570312 MB of memory in use.
ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     240     22861.0420     20119.9135      5760.6910       171.4213        -335766.3623     21854.4252         0.0000         0.0000     42641.4776        -222357.3918       155.1180   -264998.8694   -222074.0951       155.1180          -3844.9085     -2568.3896    921491.4634     -3844.9085     -2568.3896

ENERGY:     241     23920.0052     20195.4873      5762.7124       169.9828        -336129.3249     21865.1031         0.0000         0.0000     41957.8936        -222258.1406       152.6313   -264216.0341   -222063.9157       152.6313          -4724.4491     -2616.3453    921491.4634     -4724.4491     -2616.3453

ENERGY:     242     22110.7716     20111.8209      5758.5348       169.0441        -335904.8194     21831.0567         0.0000         0.0000     43526.8719        -222396.7194       158.3388   -265923.5913   -222063.5734       158.3388          -4623.1689     -2633.0913    921491.4634     -4623.1689     -2633.0913

ENERGY:     243     19462.3621     19969.6446      5749.3614       168.8705        -335233.7066     21770.4748         0.0000         0.0000     45537.0688        -222575.9244       165.6513   -268112.9932   -222061.6672       165.6513          -3760.4505     -2614.6992    921491.4634     -3760.4505     -2614.6992

ENERGY:     244     18822.2465     19849.3935      5737.4544       169.6534        -334482.6007     21720.5676         0.0000         0.0000     45629.1661        -222554.1192       165.9864   -268183.2853   -222078.7769       165.9864          -2667.7298     -2573.2149    921491.4634     -2667.7298     -2573.2149

ENERGY:     245     20148.2368     19811.7600      5725.7785       171.4559        -334087.5944     21701.2470         0.0000         0.0000     44168.5247        -222360.5915       160.6730   -266529.1162   -222068.6363       160.6730          -1771.6901     -2533.5454    921491.4634     -1771.6901     -2533.5454

ENERGY:     246     20878.5480     19853.7025      5716.8932       174.1558        -334213.1203     21705.0850         0.0000         0.0000     43600.4182        -222284.3176       158.6063   -265884.7358   -222067.4293       158.6063          -1173.7929     -2523.3912    921491.4634     -1173.7929     -2523.3912

ENERGY:     247     19868.5286     19979.6440      5712.7400       177.5412        -334802.1840     21719.8454         0.0000         0.0000     44912.1912        -222431.6935       163.3782   -267343.8847   -222068.1392       163.3782           -983.0000     -2552.5930    921491.4634      -983.0000     -2552.5930

ENERGY:     248     19035.4925     20164.4296      5713.8450       181.3144        -335623.1352     21746.4311         0.0000         0.0000     46185.9362        -222595.6864       168.0117   -268781.6227   -222090.3126       168.0117          -1359.1246     -2608.3066    921491.4634     -1359.1246     -2608.3066

ENERGY:     249     20484.3305     20353.6193      5719.1623       185.0800        -336433.0066     21788.9033         0.0000         0.0000     45370.8153        -222531.0959       165.0466   -267901.9111   -222082.9711       165.0466          -2308.0286     -2671.2386    921491.4634     -2308.0286     -2671.2386

ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     250     23155.2056     20422.5256      5726.1009       188.5682        -336907.4409     21832.9289         0.0000         0.0000     43252.1660        -222329.9457       157.3395   -265582.1117   -222084.2878       157.3395          -3365.2095     -2722.3880    921491.4634     -3365.2095     -2722.3880

ENERGY:     251     24002.1398     20302.5996      5731.6573       191.5295        -336816.8449     21849.8673         0.0000         0.0000     42475.2393        -222263.8121       154.5132   -264739.0514   -222084.8989       154.5132          -3958.0339     -2753.0724    921491.4634     -3958.0339     -2753.0724

ENERGY:     252     21994.9042     20013.1599      5733.2541       193.8023        -336093.2677     21826.9296         0.0000         0.0000     43905.3720        -222425.8455       159.7157   -266331.2176   -222091.3304       159.7157          -3843.4682     -2758.0338    921491.4634     -3843.4682     -2758.0338

ENERGY:     253     19499.8638     19667.1123      5729.5496       195.2411        -334977.1808     21784.0537         0.0000         0.0000     45520.0192        -222581.3411       165.5893   -268101.3603   -222082.7204       165.5893          -3300.1273     -2735.8132    921491.4634     -3300.1273     -2735.8132

ENERGY:     254     19073.0882     19348.2296      5720.5008       195.9622        -333839.8799     21752.6524         0.0000         0.0000     45220.9196        -222528.5271       164.5013   -267749.4466   -222080.4685       164.5013          -2707.1337     -2696.1701    921491.4634     -2707.1337     -2696.1701

ENERGY:     255     20324.2311     19109.4102      5707.6062       196.0620        -333099.9233     21746.1515         0.0000         0.0000     43667.4213        -222349.0410       158.8501   -266016.4623   -222078.3975       158.8501          -2282.5425     -2662.7814    921491.4634     -2282.5425     -2662.7814

ENERGY:     256     20899.4409     18950.9578      5693.4518       195.6570        -332975.5973     21757.6848         0.0000         0.0000     43181.1614        -222297.2437       157.0812   -265478.4051   -222071.2738       157.0812          -2042.2409     -2664.5198    921491.4634     -2042.2409     -2664.5198

ENERGY:     257     20029.5653     18878.1872      5681.1759       194.7976        -333481.0039     21780.2419         0.0000         0.0000     44488.5470        -222428.4890       161.8371   -266917.0360   -222060.1683       161.8371          -2035.5362     -2692.1442    921491.4634     -2035.5362     -2692.1442

ENERGY:     258     19453.5866     18882.0665      5673.2911       193.6684        -334373.1544     21817.5077         0.0000         0.0000     45796.2580        -222556.7761       166.5942   -268353.0341   -222062.0607       166.5942          -2331.2327     -2737.1919    921491.4634     -2331.2327     -2737.1919

ENERGY:     259     20717.7707     18984.1028      5671.3007       192.3773        -335369.5277     21871.0066         0.0000         0.0000     45431.1558        -222501.8138       165.2661   -267932.9695   -222063.7306       165.2661          -2890.3670     -2780.4961    921491.4634     -2890.3670     -2780.4961

TIMING: 260  CPU: 123.721, 0.471663/step  Wall: 123.721, 0.471663/step, 0.0314442 hours remaining, 3221.875000 MB of memory in use.
ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     260     22744.9541     19188.2461      5675.1876       191.0393        -336169.7728     21924.7893         0.0000         0.0000     44083.4308        -222362.1255       160.3634   -266445.5564   -222069.6812       160.3634          -3407.4793     -2810.9878    921491.4634     -3407.4793     -2810.9878

ENERGY:     261     23215.5573     19485.4654      5683.6413       189.7700        -336523.9800     21953.3902         0.0000         0.0000     43676.0236        -222320.1322       158.8814   -265996.1558   -222052.8235       158.8814          -3555.3694     -2822.8648    921491.4634     -3555.3694     -2822.8648

ENERGY:     262     21606.2725     19814.6777      5694.0656       188.7122        -336291.7859     21947.6074         0.0000         0.0000     44601.6347        -222438.8159       162.2485   -267040.4506   -222052.4322       162.2485          -3214.7561     -2810.4637    921491.4634     -3214.7561     -2810.4637

ENERGY:     263     19781.1229     20140.5622      5703.8103       187.9445        -335614.9713     21924.4740         0.0000         0.0000     45349.7771        -222527.2803       164.9700   -267877.0574   -222051.1546       164.9700          -2647.8115     -2773.3903    921491.4634     -2647.8115     -2773.3903

ENERGY:     264     19385.2260     20436.4305      5710.6950       187.5052        -334855.9511     21907.7772         0.0000         0.0000     44751.4785        -222476.8387       162.7936   -267228.3172   -222069.1981       162.7936          -2191.1926     -2723.5293    921491.4634     -2191.1926     -2723.5293

ENERGY:     265     19946.8414     20681.9925      5713.6242       187.4392        -334395.6631     21906.0163         0.0000         0.0000     43607.6376        -222352.1119       158.6326   -265959.7494   -222054.3370       158.6326          -2038.0573     -2683.6034    921491.4634     -2038.0573     -2683.6034

ENERGY:     266     20048.7898     20788.8700      5712.1327       187.6137        -334399.4576     21914.4805         0.0000         0.0000     43399.3798        -222348.1910       157.8750   -265747.5708   -222054.3633       157.8750          -2130.7240     -2664.5956    921491.4634     -2130.7240     -2664.5956

ENERGY:     267     19648.0905     20691.2678      5707.0583       187.8501        -334831.4854     21930.8374         0.0000         0.0000     44220.2169        -222446.1644       160.8610   -266666.3813   -222055.6583       160.8610          -2435.4234     -2662.6783    921491.4634     -2435.4234     -2662.6783

ENERGY:     268     19962.9160     20375.7516      5700.1930       187.9286        -335513.7448     21959.1257         0.0000         0.0000     44823.5377        -222504.2922       163.0557   -267327.8299   -222075.9873       163.0557          -2903.2124     -2658.6180    921491.4634     -2903.2124     -2658.6180

ENERGY:     269     21396.7812     19927.1703      5694.0390       187.7639        -336221.0660     21997.2160         0.0000         0.0000     44586.5100        -222431.5856       162.1935   -267018.0956   -222066.1971       162.1935          -3401.4128     -2647.2949    921491.4634     -3401.4128     -2647.2949

ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     270     22620.1932     19450.9168      5690.3173       187.1618        -336650.6774     22028.8070         0.0000         0.0000     44308.0076        -222365.2736       161.1804   -266673.2812   -222067.0432       161.1804          -3583.3633     -2617.7583    921491.4634     -3583.3633     -2617.7583

ENERGY:     271     22345.5823     19078.8066      5690.0209       186.1610        -336571.7891     22035.2501         0.0000         0.0000     44829.4473        -222406.5210       163.0772   -267235.9682   -222066.8384       163.0772          -3261.2174     -2569.2622    921491.4634     -3261.2174     -2569.2622

ENERGY:     272     21021.5585     18896.0662      5692.8269       184.9335        -335921.4611     22015.0580         0.0000         0.0000     45607.7076        -222503.3105       165.9083   -268111.0181   -222081.1567       165.9083          -2551.9683     -2501.8804    921491.4634     -2551.9683     -2501.8804

ENERGY:     273     20123.2137     18932.9081      5697.5118       183.8526        -334925.7009     21985.5296         0.0000         0.0000     45502.7161        -222499.9690       165.5264   -268002.6851   -222069.0453       165.5264          -1837.1975     -2434.6759    921491.4634     -1837.1975     -2434.6759

ENERGY:     274     20074.7416     19121.4862      5701.6806       183.0070        -333931.6253     21965.2976         0.0000         0.0000     44478.5176        -222406.8946       161.8006   -266885.4123   -222066.8023       161.8006          -1366.5213     -2384.6634    921491.4634     -1366.5213     -2384.6634

ENERGY:     275     20005.4316     19374.0680      5703.3425       182.5376        -333318.5598     21960.8299         0.0000         0.0000     43741.9684        -222350.3819       159.1213   -266092.3503   -222065.7687       159.1213          -1269.7931     -2374.8868    921491.4634     -1269.7931     -2374.8868

ENERGY:     276     19401.8501     19594.7507      5701.2547       182.4904        -333292.1279     21971.0409         0.0000         0.0000     44028.5273        -222412.2138       160.1637   -266440.7411   -222072.9393       160.1637          -1580.1300     -2417.6041    921491.4634     -1580.1300     -2417.6041

ENERGY:     277     19149.2972     19724.7159      5695.5210       182.9396        -333864.3451     21997.2386         0.0000         0.0000     44632.8112        -222481.8215       162.3619   -267114.6327   -222061.0986       162.3619          -2311.7545     -2498.0545    921491.4634     -2311.7545     -2498.0545

ENERGY:     278     20199.4576     19713.7759      5686.9122       183.6585        -334821.1000     22041.3358         0.0000         0.0000     44532.2540        -222463.7059       161.9961   -266995.9600   -222063.4129       161.9961          -3254.8157     -2593.7697    921491.4634     -3254.8157     -2593.7697

ENERGY:     279     21984.3648     19593.9431      5677.5176       184.5187        -335888.5798     22096.4198         0.0000         0.0000     43975.0881        -222376.7277       159.9693   -266351.8158   -222065.2021       159.9693          -4044.3213     -2682.8390    921491.4634     -4044.3213     -2682.8390

TIMING: 280  CPU: 133.141, 0.470986/step  Wall: 133.141, 0.470986/step, 0.0287825 hours remaining, 3221.875000 MB of memory in use.
ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     280     22859.3229     19458.4366      5670.0026       185.3899        -336752.6629     22145.1353         0.0000         0.0000     44066.7339        -222367.6416       160.3027   -266434.3755   -222073.4244       160.3027          -4286.3893     -2748.0546    921491.4634     -4286.3893     -2748.0546

ENERGY:     281     22172.5959     19445.1183      5667.0588       186.2206        -337154.6800     22172.1191         0.0000         0.0000     45063.2423        -222448.3250       163.9277   -267511.5674   -222064.8516       163.9277          -3881.2950     -2782.5901    921491.4634     -3881.2950     -2782.5901

ENERGY:     282     20943.7899     19615.5379      5669.9796       186.8360        -336942.5032     22176.7654         0.0000         0.0000     45823.3370        -222526.2575       166.6927   -268349.5945   -222063.3313       166.6927          -2992.3271     -2779.3667    921491.4634     -2992.3271     -2779.3667

ENERGY:     283     20432.1061     19966.6615      5678.8137       187.1634        -336251.9199     22171.0648         0.0000         0.0000     45328.8521        -222487.2584       164.8939   -267816.1105   -222060.8457       164.8939          -2008.7736     -2748.2305    921491.4634     -2008.7736     -2748.2305

ENERGY:     284     20506.3998     20401.8822      5692.0830       187.1346        -335412.6299     22166.2909         0.0000         0.0000     44071.4482        -222387.3913       160.3198   -266458.8394   -222061.5538       160.3198          -1267.2791     -2712.3902    921491.4634     -1267.2791     -2712.3902

ENERGY:     285     20203.3287     20789.9629      5707.3565       186.7145        -334827.1965     22167.0165         0.0000         0.0000     43418.2632        -222354.5543       157.9437   -265772.8175   -222053.5965       157.9437          -1010.8438     -2700.0820    921491.4634     -1010.8438     -2700.0820

ENERGY:     286     19396.6309     20966.5623      5721.5031       185.8229        -334658.1148     22176.6862         0.0000         0.0000     43785.6883        -222425.2210       159.2803   -266210.9093   -222054.0580       159.2803          -1306.7502     -2717.2847    921491.4634     -1306.7502     -2717.2847

ENERGY:     287     19176.1190     20856.7824      5731.9346       184.4714        -334918.1479     22200.2909         0.0000         0.0000     44282.9439        -222485.6057       161.0892   -266768.5496   -222055.7251       161.0892          -2148.9613     -2753.3344    921491.4634     -2148.9613     -2753.3344

ENERGY:     288     20263.2087     20475.2852      5736.9557       182.7335        -335468.3146     22237.9036         0.0000         0.0000     44116.9905        -222455.2372       160.4855   -266572.2278   -222066.9050       160.4855          -3310.5878     -2790.1553    921491.4634     -3310.5878     -2790.1553

ENERGY:     289     21886.4833     19928.6980      5736.1905       180.7560        -336126.9120     22279.0689         0.0000         0.0000     43733.4514        -222382.2639       159.0903   -266115.7153   -222062.2721       159.0903          -4368.9813     -2809.8749    921491.4634     -4368.9813     -2809.8749

ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     290     22615.9843     19325.5266      5730.3279       178.6973        -336571.4571     22308.2174         0.0000         0.0000     44027.4236        -222385.2800       160.1597   -266412.7036   -222063.4681       160.1597          -4815.3285     -2796.0389    921491.4634     -4815.3285     -2796.0389

ENERGY:     291     22115.7701     18802.2910      5721.4122       176.7646        -336554.3555     22315.5629         0.0000         0.0000     44963.0867        -222459.4680       163.5634   -267422.5547   -222063.1772       163.5634          -4450.6672     -2738.1108    921491.4634     -4450.6672     -2738.1108

ENERGY:     292     21262.5909     18472.4016      5712.2431       175.1751        -335987.2697     22302.8783         0.0000         0.0000     45560.3455        -222501.6352       165.7360   -268061.9807   -222072.5159       165.7360          -3435.4156     -2639.3512    921491.4634     -3435.4156     -2639.3512

ENERGY:     293     20783.4661     18411.7342      5705.7252       174.1484        -335092.9703     22279.1181         0.0000         0.0000     45283.4161        -222455.3622       164.7286   -267738.7783   -222061.5452       164.7286          -2166.7336     -2517.2544    921491.4634     -2166.7336     -2517.2544

ENERGY:     294     20398.6128     18589.6436      5703.5791       173.8101        -334179.1784     22254.0798         0.0000         0.0000     44662.2338        -222397.2190       162.4689   -267059.4528   -222058.8848       162.4689          -1006.6042     -2405.5593    921491.4634     -1006.6042     -2405.5593

ENERGY:     295     19706.6742     18924.3583      5706.2255       174.2141        -333602.5012     22236.6568         0.0000         0.0000     44449.5913        -222404.7811       161.6954   -266854.3724   -222057.5858       161.6954           -311.5567     -2335.1538    921491.4634      -311.5567     -2335.1538

ENERGY:     296     19122.8991     19301.4533      5712.5929       175.3096        -333576.4723     22236.1188         0.0000         0.0000     44573.6029        -222454.4957       162.1465   -267028.0987   -222067.3936       162.1465           -347.2083     -2322.9739    921491.4634      -347.2083     -2322.9739

ENERGY:     297     19439.7489     19641.8018      5720.7182       176.9777        -334148.9751     22258.2524         0.0000         0.0000     44466.2678        -222445.2084       161.7561   -266911.4762   -222050.8185       161.7561          -1189.5387     -2359.0875    921491.4634     -1189.5387     -2359.0875

ENERGY:     298     20578.5046     19886.6665      5727.8935       178.9488        -335137.5236     22299.1410         0.0000         0.0000     44067.5344        -222398.8349       160.3056   -266466.3692   -222053.6273       160.3056          -2519.0813     -2427.9308    921491.4634     -2519.0813     -2427.9308

ENERGY:     299     21598.9655     20050.9661      5731.9440       180.9390        -336266.8201     22346.0657         0.0000         0.0000     43977.6322        -222380.3076       159.9785   -266357.9398   -222056.3726       159.9785          -3820.1263     -2506.2687    921491.4634     -3820.1263     -2506.2687

LDB: ============= START OF LOAD BALANCING ============== 145.18
LDB: Largest compute 200 load 0.521689 is 1.1% of average load 45.767155
LDB: Average compute 0.064145 is 0.1% of average load 45.767155
LDB: TIME 145.182 LOAD: AVG 45.7672 MAX 47.1757  PROXIES: TOTAL 112 MAXPE 28 MAXPATCH 1 None MEM: 3222.07 MB
LDB: TIME 145.183 LOAD: AVG 45.7672 MAX 47.1757  PROXIES: TOTAL 112 MAXPE 28 MAXPATCH 1 RefineTorusLB MEM: 3222.07 MB
LDB: TIME 145.198 LOAD: AVG 45.7672 MAX 46.2777  PROXIES: TOTAL 114 MAXPE 30 MAXPATCH 2 RefineTorusLB MEM: 3222.07 MB
LDB: ============== END OF LOAD BALANCING =============== 145.199
Info: useSync: 1 useProxySync: 0
LDB: =============== DONE WITH MIGRATION ================ 145.201
Info: Initial time: 4 CPUs 0.47143 s/step 5.45637 days/ns 3222.07 MB memory
TIMING: 300  CPU: 142.559, 0.470911/step  Wall: 142.559, 0.470911/step, 0.0261617 hours remaining, 3222.074219 MB of memory in use.
ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     300     21869.9881     20174.1889      5731.6695       182.6816        -337209.9030     22385.4779         0.0000         0.0000     44423.7998        -222442.0972       161.6016   -266865.8970   -222076.5868       161.6016          -4600.9408     -2563.6018    921491.4634     -4600.9408     -2563.6018

ENERGY:     301     21754.7697     20299.7852      5727.3852       184.0330        -337665.1000     22409.6626         0.0000         0.0000     44817.7468        -222471.7174       163.0346   -267289.4642   -222059.2468       163.0346          -4657.8463     -2584.2293    921491.4634     -4657.8463     -2584.2293

ENERGY:     302     21723.0647     20395.7907      5720.2599       184.8676        -337483.0152     22416.9292         0.0000         0.0000     44599.2672        -222442.8360       162.2399   -267042.1032   -222057.3399       162.2399          -3958.8648     -2554.2736    921491.4634     -3958.8648     -2554.2736

ENERGY:     303     21512.5328     20430.0800      5712.5286       185.2198        -336784.9550     22409.2049         0.0000         0.0000     44154.6911        -222380.6979       160.6226   -266535.3890   -222054.2088       160.6226          -2717.2718     -2487.9821    921491.4634     -2717.2718     -2487.9821

ENERGY:     304     20579.5056     20379.6043      5706.6112       185.2163        -335895.7344     22392.3087         0.0000         0.0000     44259.5533        -222392.9349       161.0041   -266652.4882   -222063.7236       161.0041          -1310.8210     -2411.5371    921491.4634     -1310.8210     -2411.5371

ENERGY:     305     19294.2488     20267.1925      5704.5649       185.0761        -335184.3676     22377.9875         0.0000         0.0000     44903.5552        -222451.7425       163.3468   -267355.2977   -222049.0628       163.3468           -285.4665     -2359.8439    921491.4634      -285.4665     -2359.8439

ENERGY:     306     18813.6233     20091.4461      5706.8792       184.8700        -334861.4713     22380.1170         0.0000         0.0000     45195.6070        -222488.9287       164.4092   -267684.5357   -222048.9452       164.4092            -34.4475     -2342.9900    921491.4634       -34.4475     -2342.9900

ENERGY:     307     19699.8290     19880.2870      5712.8835       184.6555        -334994.2779     22404.6079         0.0000         0.0000     44676.1363        -222435.8787       162.5195   -267112.0150   -222050.4562       162.5195           -686.7125     -2362.0196    921491.4634      -686.7125     -2362.0196

ENERGY:     308     21066.5788     19666.1168      5720.7564       184.4262        -335495.7175     22443.3090         0.0000         0.0000     44039.4394        -222375.0909       160.2034   -266414.5303   -222060.2280       160.2034          -1960.6041     -2406.6006    921491.4634     -1960.6041     -2406.6006

ENERGY:     309     21696.0233     19507.1879      5728.2464       184.2113        -336171.4694     22480.8021         0.0000         0.0000     44190.3408        -222384.6576       160.7523   -266574.9984   -222050.0293       160.7523          -3383.0054     -2467.8898    921491.4634     -3383.0054     -2467.8898

ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     310     21508.7273     19421.0238      5732.7586       183.9063        -336693.8607     22505.8457         0.0000         0.0000     44871.0067        -222470.5922       163.2284   -267341.5989   -222052.4937       163.2284          -4424.6313     -2515.2222    921491.4634     -4424.6313     -2515.2222

ENERGY:     311     21459.6722     19421.2607      5732.5580       183.4896        -336798.7863     22515.0560         0.0000         0.0000     44986.9608        -222499.7891       163.6502   -267486.7499   -222053.3067       163.6502          -4795.7694     -2523.0992    921491.4634     -4795.7694     -2523.0992

ENERGY:     312     21894.2737     19475.0867      5727.0398       182.9545        -336390.8675     22507.7149         0.0000         0.0000     44171.5549        -222432.2430       160.6840   -266603.7979   -222064.5092       160.6840          -4390.5734     -2479.7746    921491.4634     -4390.5734     -2479.7746

ENERGY:     313     21935.6983     19529.7470      5717.1323       182.3602        -335633.4774     22483.0130         0.0000         0.0000     43439.9890        -222345.5376       158.0227   -265785.5266   -222050.9853       158.0227          -3324.4414     -2406.1159    921491.4634     -3324.4414     -2406.1159

ENERGY:     314     20774.0372     19507.1855      5704.6248       181.6523        -334801.1004     22445.5164         0.0000         0.0000     43813.5137        -222374.5704       159.3815   -266188.0841   -222048.2690       159.3815          -1862.2383     -2326.9766    921491.4634     -1862.2383     -2326.9766

ENERGY:     315     19161.1203     19408.2595      5692.2116       180.8666        -334233.4702     22410.8358         0.0000         0.0000     44907.4429        -222472.7334       163.3609   -267380.1763   -222046.1396       163.3609           -549.3942     -2270.2360    921491.4634      -549.3942     -2270.2360

ENERGY:     316     18669.4292     19303.6207      5682.5271       180.0732        -334172.3643     22398.3989         0.0000         0.0000     45428.4348        -222509.8803       165.2562   -267938.3151   -222062.0707       165.2562             64.5861     -2251.8059    921491.4634        64.5861     -2251.8059

ENERGY:     317     19739.5966     19309.4452      5677.5265       179.4130        -334705.9336     22416.0669         0.0000         0.0000     44959.2154        -222424.6699       163.5493   -267383.8853   -222046.6266       163.5493           -296.1489     -2282.4173    921491.4634      -296.1489     -2282.4173

ENERGY:     318     21109.3875     19471.3043      5677.4840       178.9393        -335675.6974     22454.1809         0.0000         0.0000     44425.4199        -222358.9814       161.6075   -266784.4014   -222048.7802       161.6075          -1378.4200     -2356.1401    921491.4634     -1378.4200     -2356.1401

ENERGY:     319     21567.4384     19787.0343      5681.4413       178.7485        -336801.6066     22496.5474         0.0000         0.0000     44691.1808        -222399.2159       162.5742   -267090.3967   -222051.9247       162.5742          -2725.8797     -2457.2025    921491.4634     -2725.8797     -2457.2025

TIMING: 320  CPU: 151.769, 0.460486/step  Wall: 151.769, 0.460486/step, 0.0230243 hours remaining, 3222.074219 MB of memory in use.
ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     320     21393.3835     20196.2691      5687.3971       178.9168        -337738.1157     22532.5474         0.0000         0.0000     45250.4877        -222499.1142       164.6088   -267749.6018   -222076.2069       164.6088          -3895.6021     -2553.5001    921491.4634     -3895.6021     -2553.5001

ENERGY:     321     21615.1672     20628.0218      5693.0806       179.5146        -338181.7100     22557.3345         0.0000         0.0000     45018.7806        -222489.8108       163.7660   -267508.5914   -222064.2785       163.7660          -4609.2357     -2621.5362    921491.4634     -4609.2357     -2621.5362

ENERGY:     322     22179.0067     20957.0457      5696.1855       180.4970        -337965.9626     22565.0702         0.0000         0.0000     43989.5240        -222398.6335       160.0218   -266388.1574   -222063.6574       160.0218          -4596.8827     -2640.5012    921491.4634     -4596.8827     -2640.5012

ENERGY:     323     21976.7004     21085.8080      5695.4506       181.8003        -337194.0741     22550.8102         0.0000         0.0000     43361.4903        -222342.0143       157.7372   -265703.5046   -222061.4462       157.7372          -3808.3604     -2616.6943    921491.4634     -3808.3604     -2616.6943

ENERGY:     324     20558.5068     20952.0213      5690.8582       183.3007        -336170.3972     22520.5740         0.0000         0.0000     43857.2500        -222407.8863       159.5406   -266265.1363   -222068.7482       159.5406          -2506.6900     -2573.6931    921491.4634     -2506.6900     -2573.6931

ENERGY:     325     19096.1752     20584.7377      5683.7433       184.8442        -335297.0511     22494.0543         0.0000         0.0000     44763.3954        -222490.1010       162.8369   -267253.4964   -222060.9512       162.8369          -1264.0246     -2529.6546    921491.4634     -1264.0246     -2529.6546

ENERGY:     326     18959.6361     20052.8004      5675.9627       186.2078        -334820.0102     22490.4167         0.0000         0.0000     44971.8223        -222483.1642       163.5951   -267454.9865   -222059.6108       163.5951           -572.2143     -2503.0558    921491.4634      -572.2143     -2503.0558

ENERGY:     327     20020.7821     19506.2794      5669.7116       187.2139        -334851.2528     22513.0144         0.0000         0.0000     44550.7425        -222403.5089       162.0634   -266954.2514   -222059.8760       162.0634           -657.4993     -2506.5014    921491.4634      -657.4993     -2506.5014

ENERGY:     328     20934.1978     19092.0092      5666.7484       187.7399        -335303.4708     22549.7451         0.0000         0.0000     44493.2356        -222379.7948       161.8542   -266873.0303   -222061.7259       161.8542          -1393.2039     -2547.3518    921491.4634     -1393.2039     -2547.3518

ENERGY:     329     21066.6664     18910.0877      5668.0553       187.7546        -335996.4124     22586.9564         0.0000         0.0000     45124.3165        -222452.5755       164.1499   -267576.8920   -222059.3366       164.1499          -2499.2290     -2610.9952    921491.4634     -2499.2290     -2610.9952

ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     330     21142.6833     18933.5042      5673.1988       187.2569        -336566.3114     22617.7578         0.0000         0.0000     45495.0146        -222516.8957       165.4984   -268011.9103   -222062.1150       165.4984          -3602.9589     -2673.3213    921491.4634     -3602.9589     -2673.3213

ENERGY:     331     21864.6854     19091.0591      5680.9136       186.3262        -336735.1747     22637.2713         0.0000         0.0000     44806.2164        -222468.7029       162.9927   -267274.9192   -222063.3972       162.9927          -4373.7647     -2707.8812    921491.4634     -4373.7647     -2707.8812

ENERGY:     332     22513.8605     19292.8540      5689.3391       185.0892        -336383.5017     22636.4042         0.0000         0.0000     43697.6287        -222368.3260       158.9600   -266065.9547   -222061.8460       158.9600          -4514.5070     -2704.7031    921491.4634     -4514.5070     -2704.7031

ENERGY:     333     21854.9974     19482.7896      5696.6505       183.7309        -335681.4579     22608.9728         0.0000         0.0000     43501.2420        -222353.0747       158.2456   -265854.3167   -222052.0751       158.2456          -3943.3087     -2666.2162    921491.4634     -3943.3087     -2666.2162

ENERGY:     334     20023.4849     19603.2613      5701.0454       182.3864        -334880.5298     22564.8640         0.0000         0.0000     44357.3054        -222448.1824       161.3597   -266805.4878   -222049.6959       161.3597          -2855.3039     -2607.1877    921491.4634     -2855.3039     -2607.1877

ENERGY:     335     18726.9583     19647.0447      5701.6423       181.1975        -334325.9453     22528.7343         0.0000         0.0000     45026.6267        -222513.7413       163.7945   -267540.3680   -222047.5431       163.7945          -1753.1271     -2542.6965    921491.4634     -1753.1271     -2542.6965

ENERGY:     336     19127.9134     19639.0994      5698.6022       180.2744        -334271.7853     22519.6995         0.0000         0.0000     44649.6651        -222456.5314       162.4232   -267106.1965   -222055.6199       162.4232          -1093.5007     -2488.8703    921491.4634     -1093.5007     -2488.8703

ENERGY:     337     20420.1634     19649.7062      5693.3319       179.7347        -334824.3557     22536.4220         0.0000         0.0000     43995.6000        -222349.3974       160.0439   -266344.9974   -222040.1023       160.0439          -1064.7185     -2460.5860    921491.4634     -1064.7185     -2460.5860

ENERGY:     338     21007.5746     19722.4643      5687.5590       179.5437        -335808.8619     22564.1942         0.0000         0.0000     44285.9175        -222361.6086       161.1000   -266647.5261   -222041.5956       161.1000          -1500.9500     -2462.8576    921491.4634     -1500.9500     -2462.8576

ENERGY:     339     20742.6010     19892.4866      5683.2969       179.6501        -336924.5159     22593.0215         0.0000         0.0000     45359.3481        -222474.1118       165.0048   -267833.4599   -222043.8628       165.0048          -2199.9376     -2485.1216    921491.4634     -2199.9376     -2485.1216

TIMING: 340  CPU: 160.97, 0.460048/step  Wall: 160.97, 0.460048/step, 0.0204466 hours remaining, 3222.074219 MB of memory in use.
ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     340     20898.6067     20139.5374      5681.9995       179.9655        -337821.3680     22621.7133         0.0000         0.0000     45758.5731        -222540.9724       166.4571   -268299.5456   -222070.3952       166.4571          -2966.9709     -2503.9486    921491.4634     -2966.9709     -2503.9486

ENERGY:     341     22051.8626     20407.8964      5684.3134       180.4786        -338209.1664     22646.3196         0.0000         0.0000     44797.5822        -222440.7137       162.9613   -267238.2959   -222054.5347       162.9613          -3585.3813     -2498.5443    921491.4634     -3585.3813     -2498.5443

ENERGY:     342     22895.9213     20582.1013      5689.2419       181.0293        -337942.4472     22653.2568         0.0000         0.0000     43612.4991        -222328.3975       158.6503   -265940.8966   -222054.3602       158.6503          -3711.7546     -2460.9856    921491.4634     -3711.7546     -2460.9856

ENERGY:     343     21993.5595     20596.8907      5695.1198       181.5548        -337132.3416     22633.1270         0.0000         0.0000     43686.5576        -222345.5322       158.9197   -266032.0898   -222053.2448       158.9197          -3217.8263     -2399.3477    921491.4634     -3217.8263     -2399.3477

ENERGY:     344     19898.5079     20447.2068      5699.9573       182.0106        -336095.2673     22596.5925         0.0000         0.0000     44790.9365        -222480.0557       162.9371   -267270.9922   -222071.3576       162.9371          -2338.1160     -2329.7493    921491.4634     -2338.1160     -2329.7493

ENERGY:     345     18694.7358     20199.0882      5702.3270       182.4513        -335224.1271     22568.7533         0.0000         0.0000     45351.4661        -222525.3054       164.9762   -267876.7714   -222058.0553       164.9762          -1576.2391     -2261.7960    921491.4634     -1576.2391     -2261.7960

ENERGY:     346     19350.9889     19892.9543      5701.0894       182.7368        -334783.0717     22565.1333         0.0000         0.0000     44652.5019        -222437.6671       162.4335   -267090.1690   -222056.8254       162.4335          -1239.3023     -2211.7781    921491.4634     -1239.3023     -2211.7781

ENERGY:     347     20669.8295     19583.9410      5696.3949       182.8447        -334881.4380     22581.1978         0.0000         0.0000     43831.1327        -222336.0973       159.4456   -266167.2301   -222056.9472       159.4456          -1358.8147     -2194.9212    921491.4634     -1358.8147     -2194.9212

ENERGY:     348     21062.2471     19315.9903      5689.3479       182.7918        -335425.6664     22604.2197         0.0000         0.0000     44195.9875        -222375.0820       160.7729   -266571.0696   -222064.0948       160.7729          -1766.2768     -2218.9158    921491.4634     -1766.2768     -2218.9158

ENERGY:     349     20718.9515     19143.3230      5681.9007       182.6959        -336197.3777     22630.4371         0.0000         0.0000     45349.6294        -222490.4401       164.9695   -267840.0695   -222056.3110       164.9695          -2336.6408     -2270.6250    921491.4634     -2336.6408     -2270.6250

ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     350     21009.3450     19066.8674      5675.7227       182.5405        -336836.8350     22661.9751         0.0000         0.0000     45710.0736        -222530.3106       166.2807   -268240.3842   -222058.0877       166.2807          -2896.5509     -2326.8868    921491.4634     -2896.5509     -2326.8868

ENERGY:     351     22235.3179     19085.8713      5672.3993       182.3761        -337072.3441     22693.2953         0.0000         0.0000     44770.4136        -222432.6705       162.8625   -267203.0841   -222058.6356       162.8625          -3254.0185     -2369.0508    921491.4634     -3254.0185     -2369.0508

ENERGY:     352     22912.9248     19180.1281      5672.7329       182.2243        -336794.7849     22708.6916         0.0000         0.0000     43795.3993        -222342.6840       159.3156   -266138.0833   -222059.3896       159.3156          -3190.0136     -2394.0290    921491.4634     -3190.0136     -2394.0290

ENERGY:     353     21825.9774     19344.0936      5676.6445       182.1014        -336147.6543     22699.4229         0.0000         0.0000     44043.1857        -222376.2289       160.2170   -266419.4146   -222047.6760       160.2170          -2709.1541     -2407.4664    921491.4634     -2709.1541     -2407.4664

ENERGY:     354     19814.0380     19544.5090      5682.7360       181.9868        -335375.1817     22676.8662         0.0000         0.0000     44983.0759        -222491.9697       163.6361   -267475.0455   -222046.2240       163.6361          -2040.9899     -2415.4742    921491.4634     -2040.9899     -2415.4742

ENERGY:     355     18879.8417     19773.7508      5689.2466       181.9196        -334823.9951     22664.4417         0.0000         0.0000     45120.2680        -222514.5268       164.1351   -267634.7948   -222044.8380       164.1351          -1600.3170     -2424.6827    921491.4634     -1600.3170     -2424.6827

ENERGY:     356     19622.4371     20015.8109      5694.4280       181.9402        -334758.7689     22674.4075         0.0000         0.0000     44153.0887        -222416.6565       160.6168   -266569.7452   -222053.0962       160.6168          -1622.0265     -2446.8266    921491.4634     -1622.0265     -2446.8266

ENERGY:     357     20687.2712     20255.1055      5697.1707       182.0215        -335288.0644     22700.2945         0.0000         0.0000     43438.0179        -222328.1830       158.0156   -265766.2009   -222042.2330       158.0156          -2061.3609     -2486.6663    921491.4634     -2061.3609     -2486.6663

ENERGY:     358     20785.4066     20424.8430      5696.9832       182.1295        -336225.9477     22730.2415         0.0000         0.0000     44019.5823        -222386.7616       160.1311   -266406.3439   -222043.9945       160.1311          -2636.8583     -2541.3593    921491.4634     -2636.8583     -2541.3593

ENERGY:     359     20493.6441     20484.4985      5694.4424       182.1894        -337270.5927     22762.0664         0.0000         0.0000     45152.8979        -222500.8540       164.2538   -267653.7518   -222046.1001       164.2538          -3161.2178     -2593.4282    921491.4634     -3161.2178     -2593.4282

TIMING: 360  CPU: 170.166, 0.459803/step  Wall: 170.166, 0.459803/step, 0.0178812 hours remaining, 3222.074219 MB of memory in use.
ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     360     21112.5811     20418.0335      5690.9152       182.1442        -338077.5502     22797.1674         0.0000         0.0000     45362.4569        -222514.2520       165.0162   -267876.7089   -222065.3873       165.0162          -3505.9502     -2622.8571    921491.4634     -3505.9502     -2622.8571

ENERGY:     361     22462.8273     20259.6927      5688.3191       181.9496        -338397.1519     22827.2217         0.0000         0.0000     44580.8522        -222396.2893       162.1729   -266977.1415   -222052.4536       162.1729          -3542.5440     -2618.5018    921491.4634     -3542.5440     -2618.5018

ENERGY:     362     22808.6000     20031.2790      5688.3204       181.6678        -338079.7606     22835.7523         0.0000         0.0000     44200.9553        -222333.1858       160.7909   -266534.1410   -222051.2753       160.7909          -3087.0694     -2583.1905    921491.4634     -3087.0694     -2583.1905

ENERGY:     363     21303.6020     19794.1188      5692.1162       181.3427        -337235.0083     22818.0649         0.0000         0.0000     45033.6627        -222412.1011       163.8201   -267445.7637   -222049.5296       163.8201          -2242.6817     -2529.7064    921491.4634     -2242.6817     -2529.7064

ENERGY:     364     19323.8975     19612.6014      5699.8913       181.0103        -336175.1992     22790.5191         0.0000         0.0000     46034.3489        -222532.9308       167.4603   -268567.2796   -222068.5913       167.4603          -1420.0424     -2476.3756    921491.4634     -1420.0424     -2476.3756

ENERGY:     365     18830.5840     19548.3420      5710.7559       180.6857        -335316.0963     22775.7828         0.0000         0.0000     45760.0888        -222509.8572       166.4626   -268269.9460   -222057.4397       166.4626          -1100.2606     -2433.4822    921491.4634     -1100.2606     -2433.4822

ENERGY:     366     19854.2638     19578.5648      5722.5903       180.3919        -334923.1923     22780.3500         0.0000         0.0000     44422.2471        -222384.7844       161.5959   -266807.0315   -222057.2772       161.5959          -1392.6926     -2417.6862    921491.4634     -1392.6926     -2417.6862

ENERGY:     367     20741.0597     19662.8834      5732.9484       180.1165        -335098.3152     22794.3492         0.0000         0.0000     43662.6184        -222324.3395       158.8326   -265986.9579   -222058.3708       158.8326          -2104.1274     -2437.9267    921491.4634     -2104.1274     -2437.9267

ENERGY:     368     20561.5938     19748.2120      5739.6691       179.8275        -335728.0871     22808.6650         0.0000         0.0000     44272.8406        -222417.2791       161.0524   -266690.1197   -222068.2910       161.0524          -2928.4887     -2487.3070    921491.4634     -2928.4887     -2487.3070

ENERGY:     369     20346.9677     19812.6206      5741.6370       179.5048        -336580.3305     22825.3357         0.0000         0.0000     45155.6308        -222518.6338       164.2638   -267674.2647   -222061.0999       164.2638          -3666.9891     -2542.4574    921491.4634     -3666.9891     -2542.4574

ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     370     21302.3704     19815.7283      5738.6028       179.1429        -337296.0551     22846.3048         0.0000         0.0000     44920.4945        -222493.4114       163.4084   -267413.9059   -222062.2624       163.4084          -4081.4435     -2576.8190    921491.4634     -4081.4435     -2576.8190

ENERGY:     371     22799.2770     19758.4808      5731.5881       178.8004        -337606.4367     22861.3509         0.0000         0.0000     43904.8963        -222372.0432       159.7139   -266276.9395   -222061.9336       159.7139          -3956.1478     -2578.2817    921491.4634     -3956.1478     -2578.2817

ENERGY:     372     22964.3596     19665.2850      5722.4284       178.5955        -337391.7866     22854.0835         0.0000         0.0000     43672.6557        -222334.3789       158.8691   -266007.0346   -222060.3193       158.8691          -3189.3379     -2552.6172    921491.4634     -3189.3379     -2552.6172

ENERGY:     373     21253.1597     19603.3416      5713.4759       178.7080        -336784.3110     22822.4880         0.0000         0.0000     44782.9952        -222430.1426       162.9082   -267213.1378   -222050.3111       162.9082          -2037.0648     -2511.6656    921491.4634     -2037.0648     -2511.6656

ENERGY:     374     19285.9365     19613.0720      5706.5680       179.1985        -336019.1231     22785.5047         0.0000         0.0000     45912.3282        -222536.5153       167.0164   -268448.8434   -222048.2687       167.0164           -983.4305     -2469.0310    921491.4634      -983.4305     -2469.0310

ENERGY:     375     18893.7028     19735.2394      5703.0316       180.0533        -335443.7684     22766.6832         0.0000         0.0000     45660.9723        -222504.0858       166.1021   -268165.0581   -222047.0941       166.1021           -539.4861     -2439.8661    921491.4634      -539.4861     -2439.8661

ENERGY:     376     19884.0273     19962.1764      5703.2011       181.1433        -335321.8629     22772.8699         0.0000         0.0000     44434.3278        -222384.1172       161.6399   -266818.4450   -222050.5526       161.6399           -874.6224     -2439.6903    921491.4634      -874.6224     -2439.6903

ENERGY:     377     20646.4609     20251.1593      5706.5522       182.3248        -335763.5799     22794.3772         0.0000         0.0000     43848.2756        -222334.4299       159.5080   -266182.7055   -222041.4009       159.5080          -1819.5859     -2472.4986    921491.4634     -1819.5859     -2472.4986

ENERGY:     378     20473.8100     20495.6594      5711.4639       183.2952        -336584.2276     22821.5835         0.0000         0.0000     44474.7538        -222423.6617       161.7869   -266898.4156   -222044.3964       161.7869          -2972.9874     -2523.3499    921491.4634     -2972.9874     -2523.3499

ENERGY:     379     20419.4576     20623.8791      5716.2160       183.8420        -337495.6093     22854.5151         0.0000         0.0000     45185.6417        -222512.0579       164.3729   -267697.6996   -222047.0125       164.3729          -3997.4172     -2563.3073    921491.4634     -3997.4172     -2563.3073

TIMING: 380  CPU: 179.355, 0.459457/step  Wall: 179.355, 0.459457/step, 0.0153152 hours remaining, 3222.074219 MB of memory in use.
ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     380     21458.1129     20605.4119      5719.3306       183.8284        -338176.3451     22892.6528         0.0000         0.0000     44833.7906        -222483.2179       163.0930   -267317.0085   -222063.6478       163.0930          -4580.2701     -2564.2101    921491.4634     -4580.2701     -2564.2101

ENERGY:     381     22824.3125     20467.0310      5720.1164       183.2929        -338395.2410     22923.6568         0.0000         0.0000     43906.3009        -222370.5306       159.7191   -266276.8315   -222053.0344       159.7191          -4470.7194     -2514.6121    921491.4634     -4470.7194     -2514.6121

ENERGY:     382     22844.1903     20220.4985      5718.3197       182.2157        -338010.6532     22930.5472         0.0000         0.0000     43766.5302        -222348.3517       159.2106   -266114.8819   -222051.0361       159.2106          -3524.7148     -2418.5488    921491.4634     -3524.7148     -2418.5488

ENERGY:     383     21263.6993     19910.9245      5714.6670       180.7420        -337128.0227     22911.2844         0.0000         0.0000     44707.9446        -222438.7609       162.6352   -267146.7055   -222048.1878       162.6352          -2023.0802     -2294.0132    921491.4634     -2023.0802     -2294.0132

ENERGY:     384     19625.4114     19596.0353      5710.5349       179.0647        -336052.0487     22884.2533         0.0000         0.0000     45539.1835        -222517.5656       165.6590   -268056.7491   -222062.0924       165.6590           -569.2380     -2166.9358    921491.4634      -569.2380     -2166.9358

ENERGY:     385     19327.8181     19356.8911      5707.7752       177.4354        -335210.6402     22871.6143         0.0000         0.0000     45299.7174        -222469.3887       164.7879   -267769.1061   -222051.0991       164.7879            215.3513     -2064.3637    921491.4634       215.3513     -2064.3637

ENERGY:     386     19981.2273     19220.9464      5707.6638       175.9384        -334865.1818     22880.7957         0.0000         0.0000     44519.8589        -222378.7514       161.9510   -266898.6102   -222051.0435       161.9510            122.6667     -2011.2429    921491.4634       122.6667     -2011.2429

ENERGY:     387     20367.2861     19202.4844      5710.9354       174.6759        -335109.8726     22905.2743         0.0000         0.0000     44377.1818        -222372.0347       161.4320   -266749.2165   -222053.0048       161.4320           -738.9587     -2019.1689    921491.4634      -738.9587     -2019.1689

ENERGY:     388     20282.3987     19280.0167      5717.2934       173.7038        -335824.1518     22938.2900         0.0000         0.0000     44972.7763        -222459.6729       163.5986   -267432.4492   -222067.4816       163.5986          -2063.8555     -2076.2821    921491.4634     -2063.8555     -2076.2821

ENERGY:     389     20685.9712     19431.2563      5725.6291       173.0778        -336772.2802     22978.5919         0.0000         0.0000     45279.3795        -222498.3744       164.7139   -267777.7539   -222059.2963       164.7139          -3501.7339     -2158.1992    921491.4634     -3501.7339     -2158.1992

ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     390     21929.5049     19598.7447      5733.9032       172.7580        -337596.2511     23021.3362         0.0000         0.0000     44698.9840        -222441.0200       162.6026   -267140.0040   -222061.4793       162.6026          -4540.4922     -2229.7774    921491.4634     -4540.4922     -2229.7774

ENERGY:     391     22937.3141     19764.3494      5740.3107       172.7562        -338017.7275     23051.7300         0.0000         0.0000     43987.0074        -222364.2596       160.0126   -266351.2670   -222061.6919       160.0126          -4746.5205     -2270.9348    921491.4634     -4746.5205     -2270.9348

ENERGY:     392     22488.0357     19924.0527      5743.6080       173.0775        -337898.4684     23055.0073         0.0000         0.0000     44125.3370        -222389.3501       160.5158   -266514.6872   -222067.3165       160.5158          -3965.0285     -2276.9602    921491.4634     -3965.0285     -2276.9602

ENERGY:     393     20924.3595     20087.8866      5743.5041       173.6901        -337346.1126     23032.5727         0.0000         0.0000     44913.3820        -222470.7175       163.3825   -267384.0995   -222058.1706       163.3825          -2525.7426     -2257.0110    921491.4634     -2525.7426     -2257.0110

ENERGY:     394     19713.0845     20210.4902      5740.1181       174.4904        -336587.4366     23002.1144         0.0000         0.0000     45247.1174        -222500.0216       164.5966   -267747.1390   -222054.8625       164.5966           -988.4119     -2227.7233    921491.4634      -988.4119     -2227.7233

ENERGY:     395     19644.4019     20265.5068      5734.3763       175.3161        -335972.1482     22982.1021         0.0000         0.0000     44739.8938        -222430.5512       162.7514   -267170.4450   -222052.2370       162.7514             57.9320     -2215.1747    921491.4634        57.9320     -2215.1747

ENERGY:     396     20000.9211     20248.4507      5727.6303       175.9620        -335765.9668     22978.8839         0.0000         0.0000     44270.3051        -222363.8137       161.0432   -266634.1188   -222050.8944       161.0432            285.8964     -2246.0847    921491.4634       285.8964     -2246.0847

ENERGY:     397     19906.7785     20200.7711      5721.4919       176.2273        -336102.8174     22990.0376         0.0000         0.0000     44712.8674        -222394.6436       162.6531   -267107.5110   -222042.6594       162.6531           -376.0863     -2327.2101    921491.4634      -376.0863     -2327.2101

ENERGY:     398     19692.8116     20133.3593      5716.9814       176.0456        -336812.3377     23014.0586         0.0000         0.0000     45592.7321        -222486.3491       165.8538   -268079.0812   -222045.7217       165.8538          -1710.2236     -2443.6964    921491.4634     -1710.2236     -2443.6964

ENERGY:     399     20395.5107     20061.2892      5714.6367       175.4775        -337634.0282     23050.4588         0.0000         0.0000     45731.2027        -222505.4526       166.3575   -268236.6553   -222049.1598       166.3575          -3349.4390     -2564.3618    921491.4634     -3349.4390     -2564.3618

LDB: ============= START OF LOAD BALANCING ============== 191.191
LDB: Largest compute 230 load 0.526079 is 1.1% of average load 45.749366
LDB: Average compute 0.064102 is 0.1% of average load 45.749366
LDB: TIME 191.193 LOAD: AVG 45.7494 MAX 45.9908  PROXIES: TOTAL 112 MAXPE 28 MAXPATCH 1 None MEM: 3222.07 MB
LDB: TIME 191.194 LOAD: AVG 45.7494 MAX 45.9908  PROXIES: TOTAL 114 MAXPE 30 MAXPATCH 2 RefineTorusLB MEM: 3222.07 MB
LDB: TIME 191.194 LOAD: AVG 45.7494 MAX 45.9908  PROXIES: TOTAL 114 MAXPE 30 MAXPATCH 2 RefineTorusLB MEM: 3222.07 MB
LDB: ============== END OF LOAD BALANCING =============== 191.194
Info: useSync: 1 useProxySync: 0
LDB: =============== DONE WITH MIGRATION ================ 191.195
Info: Benchmark time: 4 CPUs 0.459841 s/step 5.32223 days/ns 3222.07 MB memory
TIMING: 400  CPU: 188.547, 0.459615/step  Wall: 188.547, 0.459615/step, 0.0127671 hours remaining, 3222.074219 MB of memory in use.
ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     400     21983.9555     19981.4883      5714.2278       174.7230        -338264.6728     23090.3529         0.0000         0.0000     44890.2684        -222429.6570       163.2985   -267319.9253   -222060.6830       163.2985          -4748.6075     -2656.9998    921491.4634     -4748.6075     -2656.9998

ENERGY:     401     23053.7070     19909.1478      5715.0562       174.0724        -338477.1023     23114.9568         0.0000         0.0000     44157.6678        -222352.4942       160.6335   -266510.1621   -222050.1989       160.6335          -5384.8813     -2700.1793    921491.4634     -5384.8813     -2700.1793

ENERGY:     402     22444.0479     19835.9109      5715.8942       173.8391        -338107.6288     23109.6380         0.0000         0.0000     44436.8097        -222391.4889       161.6489   -266828.2986   -222049.2225       161.6489          -4939.3793     -2681.7024    921491.4634     -4939.3793     -2681.7024

ENERGY:     403     20784.9695     19778.4829      5715.7218       174.2695        -337239.9785     23077.8404         0.0000         0.0000     45225.5961        -222483.0983       164.5183   -267708.6944   -222046.6853       164.5183          -3613.5977     -2605.7427    921491.4634     -3613.5977     -2605.7427

ENERGY:     404     19687.5953     19735.4029      5713.8114       175.5084        -336169.1139     23038.2902         0.0000         0.0000     45313.8392        -222504.6665       164.8393   -267818.5057   -222060.2367       164.8393          -1967.0746     -2494.0437    921491.4634     -1967.0746     -2494.0437

ENERGY:     405     19798.8802     19696.7725      5710.0281       177.6162        -335317.9347     23008.3950         0.0000         0.0000     44511.4435        -222414.7993       161.9204   -266926.2428   -222047.5585       161.9204           -627.4749     -2380.7862    921491.4634      -627.4749     -2380.7862

ENERGY:     406     20210.3505     19614.0443      5704.4965       180.4779        -334953.8236     22994.4765         0.0000         0.0000     43902.7663        -222347.2117       159.7062   -266249.9780   -222046.2400       159.7062             66.0352     -2300.4794    921491.4634        66.0352     -2300.4794

ENERGY:     407     20044.4889     19493.9063      5698.1032       183.8794        -335181.5231     22996.8163         0.0000         0.0000     44376.0635        -222388.2655       161.4279   -266764.3290   -222047.0766       161.4279            -41.3219     -2272.9968    921491.4634       -41.3219     -2272.9968

ENERGY:     408     19735.8471     19387.6642      5692.2152       187.5226        -335902.8218     23017.8175         0.0000         0.0000     45394.4122        -222487.3430       165.1324   -267881.7551   -222063.5309       165.1324           -920.8281     -2294.1555    921491.4634      -920.8281     -2294.1555

ENERGY:     409     20350.1187     19376.4605      5688.4775       191.1593        -336896.6845     23057.9924         0.0000         0.0000     45733.6060        -222498.8701       166.3663   -268232.4761   -222051.6702       166.3663          -2367.4918     -2346.9324    921491.4634     -2367.4918     -2346.9324

ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     410     21850.5209     19470.1801      5687.6650       194.4179        -337813.1843     23106.2030         0.0000         0.0000     45077.0717        -222427.1258       163.9780   -267504.1975   -222054.6425       163.9780          -3838.6209     -2402.0239    921491.4634     -3838.6209     -2402.0239

ENERGY:     411     22931.7999     19651.0975      5689.8741       197.0388        -338354.2242     23140.9047         0.0000         0.0000     44380.5349        -222362.9743       161.4442   -266743.5092   -222056.2112       161.4442          -4745.1588     -2436.8800    921491.4634     -4745.1588     -2436.8800

ENERGY:     412     22535.8950     19878.8220      5694.3234       198.8205        -338356.4971     23146.2937         0.0000         0.0000     44499.5085        -222402.8339       161.8770   -266902.3424   -222068.4595       161.8770          -4717.2137     -2436.3027    921491.4634     -4717.2137     -2436.3027

ENERGY:     413     21130.1418     20138.5248      5699.9334       199.7191        -337872.5316     23125.1117         0.0000         0.0000     45113.2143        -222465.8865       164.1095   -267579.1008   -222055.3449       164.1095          -3850.6269     -2398.9548    921491.4634     -3850.6269     -2398.9548

ENERGY:     414     19987.3856     20381.5506      5705.1135       199.5118        -337122.7795     23094.4558         0.0000         0.0000     45271.6528        -222483.1093       164.6858   -267754.7621   -222052.1620       164.6858          -2501.3242     -2333.9463    921491.4634     -2501.3242     -2333.9463

ENERGY:     415     19745.2666     20572.1259      5708.7452       198.1487        -336456.1971     23071.1992         0.0000         0.0000     44733.2275        -222427.4841       162.7272   -267160.7116   -222049.0342       162.7272          -1174.6453     -2266.5615    921491.4634     -1174.6453     -2266.5615

ENERGY:     416     19942.3169     20661.9896      5710.0857       195.6953        -336157.5860     23063.1715         0.0000         0.0000     44200.2852        -222384.0418       160.7885   -266584.3270   -222052.9641       160.7885           -282.7614     -2224.6896    921491.4634      -282.7614     -2224.6896

ENERGY:     417     20031.3750     20631.3209      5709.0494       192.4696        -336373.1074     23072.1098         0.0000         0.0000     44338.4621        -222398.3206       161.2911   -266736.7827   -222044.6990       161.2911           -112.4554     -2227.1699    921491.4634      -112.4554     -2227.1699

ENERGY:     418     20154.6648     20457.0909      5705.5847       188.6536        -336970.7866     23098.6725         0.0000         0.0000     44915.1425        -222450.9775       163.3889   -267366.1199   -222046.7089       163.3889           -671.8546     -2269.9921    921491.4634      -671.8546     -2269.9921

ENERGY:     419     20790.7630     20185.5524      5700.4811       184.6054        -337717.8754     23139.8022         0.0000         0.0000     45250.3103        -222466.3610       164.6082   -267716.6713   -222049.5947       164.6082          -1783.9421     -2336.6464    921491.4634     -1783.9421     -2336.6464

TIMING: 420  CPU: 197.709, 0.458089/step  Wall: 197.709, 0.458089/step, 0.0101798 hours remaining, 3222.074219 MB of memory in use.
ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     420     21812.8757     19887.3912      5695.0415       180.6770        -338321.5508     23183.0572         0.0000         0.0000     45121.9780        -222440.5302       164.1414   -267562.5081   -222061.1145       164.1414          -3051.6029     -2402.9274    921491.4634     -3051.6029     -2402.9274

ENERGY:     421     22491.6103     19639.6138      5690.9238       177.2518        -338550.3530     23210.1382         0.0000         0.0000     44931.8963        -222408.9189       163.4499   -267340.8152   -222052.6015       163.4499          -4041.3725     -2452.8637    921491.4634     -4041.3725     -2452.8637

ENERGY:     422     22275.7613     19449.5351      5688.9976       174.4058        -338225.0309     23208.5473         0.0000         0.0000     45004.7084        -222423.0754       163.7148   -267427.7838   -222052.8446       163.7148          -4363.1152     -2465.6374    921491.4634     -4363.1152     -2465.6374

ENERGY:     423     21418.8985     19324.4275      5689.6736       172.2145        -337416.8951     23180.6037         0.0000         0.0000     45183.9713        -222447.1060       164.3669   -267631.0773   -222051.5229       164.3669          -3955.8308     -2434.9307    921491.4634     -3955.8308     -2434.9307

ENERGY:     424     20531.3309     19270.7817      5692.6543       170.6563        -336406.2757     23140.4642         0.0000         0.0000     45151.0458        -222449.3426       164.2471   -267600.3884   -222060.4122       164.2471          -3030.1609     -2370.2033    921491.4634     -3030.1609     -2370.2033

ENERGY:     425     19942.3360     19314.5608      5697.3263       169.6876        -335607.5199     23103.7916         0.0000         0.0000     44956.0483        -222423.7692       163.5377   -267379.8176   -222050.7958       163.5377          -1980.9654     -2297.0090    921491.4634     -1980.9654     -2297.0090

ENERGY:     426     19603.3346     19432.3068      5702.4947       169.0990        -335270.6868     23080.2888         0.0000         0.0000     44862.7388        -222420.4241       163.1983   -267283.1629   -222049.1084       163.1983          -1125.8052     -2237.7215    921491.4634     -1125.8052     -2237.7215

ENERGY:     427     19598.5316     19595.2896      5707.1504       168.7509        -335498.4311     23074.5002         0.0000         0.0000     44915.2778        -222438.9305       163.3894   -267354.2083   -222048.7333       163.3894           -741.9010     -2207.6355    921491.4634      -741.9010     -2207.6355

ENERGY:     428     20140.4228     19760.4168      5710.4628       168.5259        -336199.9843     23087.7672         0.0000         0.0000     44884.2597        -222448.1291       163.2766   -267332.3888   -222058.0544       163.2766           -935.5733     -2206.9585    921491.4634      -935.5733     -2206.9585

ENERGY:     429     21147.3674     19912.0617      5712.1358       168.3557        -337181.5897     23116.4516         0.0000         0.0000     44706.5246        -222418.6929       162.6300   -267125.2175   -222045.4875       162.6300          -1630.8085     -2233.4562    921491.4634     -1630.8085     -2233.4562

ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     430     22013.9870     20024.3737      5712.1700       168.1897        -338096.9194     23149.4488         0.0000         0.0000     44626.3101        -222402.4401       162.3383   -267028.7502   -222047.3909       162.3383          -2472.2457     -2268.0465    921491.4634     -2472.2457     -2268.0465

ENERGY:     431     22204.1019     20111.4153      5711.2600       168.0704        -338644.7634     23172.3799         0.0000         0.0000     44858.4631        -222419.0727       163.1828   -267277.5357   -222048.7164       163.1828          -3116.2805     -2293.5592    921491.4634     -3116.2805     -2293.5592

ENERGY:     432     21768.3703     20188.6725      5710.3547       168.1086        -338651.2094     23176.0840         0.0000         0.0000     45177.9909        -222461.6284       164.3451   -267639.6193   -222065.9057       164.3451          -3350.2743     -2296.1499    921491.4634     -3350.2743     -2296.1499

ENERGY:     433     21200.9071     20275.9665      5710.3763       168.4633        -338164.0631     23162.2905         0.0000         0.0000     45192.9284        -222453.1310       164.3995   -267646.0594   -222052.5981       164.3995          -3187.3734     -2272.1278    921491.4634     -3187.3734     -2272.1278

ENERGY:     434     20730.3411     20338.1501      5711.6061       169.3247        -337394.2699     23140.7730         0.0000         0.0000     44883.0999        -222420.9751       163.2724   -267304.0749   -222051.1461       163.2724          -2694.3109     -2227.7887    921491.4634     -2694.3109     -2227.7887

ENERGY:     435     20235.2200     20362.4016      5714.0003       170.8455        -336680.6551     23123.4092         0.0000         0.0000     44675.9841        -222398.7943       162.5190   -267074.7785   -222049.5888       162.5190          -2061.3584     -2179.8953    921491.4634     -2061.3584     -2179.8953

ENERGY:     436     19670.9243     20349.9983      5717.2345       173.0864        -336303.8811     23119.9073         0.0000         0.0000     44847.0985        -222425.6318       163.1414   -267272.7302   -222059.6960       163.1414          -1520.6602     -2145.1620    921491.4634     -1520.6602     -2145.1620

ENERGY:     437     19434.5517     20329.5094      5720.9894       175.9827        -336411.9785     23136.3864         0.0000         0.0000     45159.2688        -222455.2902       164.2770   -267614.5589   -222050.7504       164.2770          -1319.1172     -2134.4851    921491.4634     -1319.1172     -2134.4851

ENERGY:     438     19935.1533     20278.6097      5724.6884       179.3849        -336899.4577     23173.5516         0.0000         0.0000     45148.1325        -222459.9374       164.2365   -267608.0699   -222051.5669       164.2365          -1493.0944     -2145.0884    921491.4634     -1493.0944     -2145.0884

ENERGY:     439     21052.7406     20184.4298      5727.7929       183.0561        -337561.7719     23224.7479         0.0000         0.0000     44760.8212        -222428.1833       162.8276   -267189.0046   -222052.7966       162.8276          -1936.1991     -2169.8750    921491.4634     -1936.1991     -2169.8750

TIMING: 440  CPU: 206.88, 0.458523/step  Wall: 206.88, 0.458523/step, 0.00764204 hours remaining, 3222.074219 MB of memory in use.
ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     440     22071.5683     20036.2374      5729.7527       186.7202        -338123.1802     23276.2483         0.0000         0.0000     44417.5459        -222405.1075       161.5788   -266822.6534   -222059.4769       161.5788          -2408.4611     -2197.9671    921491.4634     -2408.4611     -2197.9671

ENERGY:     441     22355.5486     19860.0411      5730.3488       190.1146        -338361.1711     23313.2042         0.0000         0.0000     44502.6963        -222409.2175       161.8886   -266911.9138   -222050.0856       161.8886          -2716.1027     -2221.5313    921491.4634     -2716.1027     -2221.5313

ENERGY:     442     21853.6118     19664.5351      5729.4854       192.9412        -338090.1528     23327.1566         0.0000         0.0000     44880.6319        -222441.7909       163.2634   -267322.4228   -222049.7751       163.2634          -2710.5575     -2229.0695    921491.4634     -2710.5575     -2229.0695

ENERGY:     443     21064.3315     19487.0723      5727.6164       194.9329        -337369.3145     23320.0156         0.0000         0.0000     45118.1107        -222457.2350       164.1273   -267575.3457   -222048.5992       164.1273          -2448.1648     -2220.3530    921491.4634     -2448.1648     -2220.3530

ENERGY:     444     20449.3362     19357.2689      5725.4095       195.8735        -336464.1920     23301.5274         0.0000         0.0000     44987.7178        -222447.0586       163.6530   -267434.7765   -222057.9796       163.6530          -2090.2101     -2206.4400    921491.4634     -2090.2101     -2206.4400

ENERGY:     445     20125.5607     19307.2516      5723.6513       195.6942        -335759.3911     23283.8137         0.0000         0.0000     44708.7156        -222414.7040       162.6380   -267123.4196   -222046.5427       162.6380          -1846.9627     -2201.6926    921491.4634     -1846.9627     -2201.6926

ENERGY:     446     19947.6805     19324.9004      5722.5430       194.3235        -335494.5706     23276.0449         0.0000         0.0000     44620.2946        -222408.7837       162.3164   -267029.0783   -222046.1619       162.3164          -1800.7519     -2216.7294    921491.4634     -1800.7519     -2216.7294

ENERGY:     447     19914.2849     19416.0208      5722.2107       191.8641        -335769.4398     23282.7456         0.0000         0.0000     44816.5088        -222425.8048       163.0301   -267242.3136   -222046.8341       163.0301          -1993.3114     -2253.0604    921491.4634     -1993.3114     -2253.0604

ENERGY:     448     20187.5921     19583.6799      5722.5764       188.5554        -336503.1797     23303.8902         0.0000         0.0000     45065.6675        -222451.2182       163.9365   -267516.8857   -222059.3477       163.9365          -2372.1878     -2303.7899    921491.4634     -2372.1878     -2303.7899

ENERGY:     449     20877.4059     19832.6986      5723.5712       184.8596        -337500.9068     23334.5920         0.0000         0.0000     45101.1679        -222446.6116       164.0657   -267547.7795   -222047.7096       164.0657          -2827.1081     -2356.1407    921491.4634     -2827.1081     -2356.1407

ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     450     21754.4853     20108.1300      5724.4776       181.0897        -338419.3246     23364.6240         0.0000         0.0000     44854.3097        -222432.2083       163.1677   -267286.5179   -222048.7857       163.1677          -3116.6757     -2394.3897    921491.4634     -3116.6757     -2394.3897

ENERGY:     451     22355.5902     20357.7256      5724.7144       177.6517        -338952.0905     23381.8004         0.0000         0.0000     44542.6986        -222411.9097       162.0341   -266954.6083   -222048.8242       162.0341          -3074.2533     -2405.7798    921491.4634     -3074.2533     -2405.7798

ENERGY:     452     22246.2015     20536.0135      5723.8953       174.8859        -338927.1534     23378.0940         0.0000         0.0000     44452.9197        -222415.1435       161.7075   -266868.0632   -222059.6366       161.7075          -2659.9605     -2384.7568    921491.4634     -2659.9605     -2384.7568

ENERGY:     453     21399.8725     20641.1312      5722.2878       173.1350        -338392.7931     23354.5904         0.0000         0.0000     44683.7035        -222418.0726       162.5470   -267101.7762   -222043.5367       162.5470          -2048.3339     -2342.4668    921491.4634     -2048.3339     -2342.4668

ENERGY:     454     20248.3380     20654.1375      5720.2217       172.3637        -337567.1412     23320.6898         0.0000         0.0000     45008.1468        -222443.2438       163.7273   -267451.3906   -222041.8387       163.7273          -1453.4579     -2293.1450    921491.4634     -1453.4579     -2293.1450

ENERGY:     455     19486.7907     20584.7121      5718.4844       172.5169        -336790.6451     23290.4020         0.0000         0.0000     45086.5790        -222451.1599       164.0126   -267537.7390   -222040.8566       164.0126          -1151.8825     -2255.8572    921491.4634     -1151.8825     -2255.8572

ENERGY:     456     19493.3722     20440.6802      5717.7556       173.4248        -336350.1075     23274.9628         0.0000         0.0000     44811.4727        -222438.4392       163.0118   -267249.9119   -222055.3483       163.0118          -1305.5006     -2245.5825    921491.4634     -1305.5006     -2245.5825

ENERGY:     457     20047.4929     20251.9436      5718.5580       174.9241        -336395.8164     23277.8271         0.0000         0.0000     44521.8706        -222403.1999       161.9583   -266925.0706   -222049.4130       161.9583          -1906.4167     -2263.5015    921491.4634     -1906.4167     -2263.5015

ENERGY:     458     20585.8434     20019.2725      5720.7061       176.6081        -336835.0957     23294.7169         0.0000         0.0000     44632.7891        -222405.1596       162.3618   -267037.9487   -222051.2819       162.3618          -2684.6989     -2301.0429    921491.4634     -2684.6989     -2301.0429

ENERGY:     459     20903.4945     19784.9692      5724.0021       178.1985        -337468.1640     23318.6979         0.0000         0.0000     45113.9369        -222444.8650       164.1121   -267558.8019   -222053.1408       164.1121          -3350.5833     -2341.5798    921491.4634     -3350.5833     -2341.5798

TIMING: 460  CPU: 216.055, 0.458771/step  Wall: 216.055, 0.458771/step, 0.00509745 hours remaining, 3222.074219 MB of memory in use.
ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     460     21262.6139     19597.9065      5728.0971       179.4910        -338014.3764     23341.7998         0.0000         0.0000     45423.8567        -222480.6114       165.2395   -267904.4681   -222064.6833       165.2395          -3669.8203     -2365.2414    921491.4634     -3669.8203     -2365.2414

ENERGY:     461     21862.8764     19507.1077      5732.5753       180.4333        -338251.6212     23355.3931         0.0000         0.0000     45154.6139        -222458.6217       164.2601   -267613.2355   -222058.0504       164.2601          -3556.1667     -2361.1801    921491.4634     -3556.1667     -2361.1801

ENERGY:     462     22264.2256     19487.8110      5736.4822       180.9531        -337988.7166     23351.1082         0.0000         0.0000     44559.9292        -222408.2072       162.0968   -266968.1364   -222056.7211       162.0968          -2954.8202     -2323.4252    921491.4634     -2954.8202     -2323.4252

ENERGY:     463     21821.1791     19513.9016      5738.9361       181.1160        -337284.1024     23326.9474         0.0000         0.0000     44313.4572        -222388.5650       161.2002   -266702.0222   -222054.6239       161.2002          -2012.4425     -2264.0779    921491.4634     -2012.4425     -2264.0779

ENERGY:     464     20535.2460     19559.9272      5739.2518       181.0096        -336389.3835     23291.1938         0.0000         0.0000     44654.0268        -222428.7283       162.4391   -267082.7551   -222058.5727       162.4391          -1050.9228     -2205.5270    921491.4634     -1050.9228     -2205.5270

ENERGY:     465     19322.7827     19631.8854      5737.2899       180.7155        -335701.1528     23259.7388         0.0000         0.0000     45094.5688        -222474.1717       164.0416   -267568.7406   -222052.9386       164.0416           -512.3348     -2174.4009    921491.4634      -512.3348     -2174.4009

ENERGY:     466     19088.4511     19708.3581      5733.2107       180.2808        -335443.7719     23245.0600         0.0000         0.0000     45020.7908        -222467.6204       163.7733   -267488.4112   -222052.9783       163.7733           -630.3315     -2182.6711    921491.4634      -630.3315     -2182.6711

ENERGY:     467     19841.8069     19783.1742      5727.6704       179.7757        -335721.0944     23249.4526         0.0000         0.0000     44523.6666        -222415.5480       161.9649   -266939.2146   -222054.3493       161.9649          -1393.6031     -2232.5925    921491.4634     -1393.6031     -2232.5925

ENERGY:     468     20761.8480     19845.4942      5721.5089       179.2779        -336451.5656     23265.8122         0.0000         0.0000     44291.6587        -222385.9658       161.1209   -266677.6244   -222056.3586       161.1209          -2508.6714     -2314.1340    921491.4634     -2508.6714     -2314.1340

ENERGY:     469     21236.3014     19910.2022      5715.6824       178.8504        -337458.3193     23284.3958         0.0000         0.0000     44720.3204        -222412.5667       162.6802   -267132.8871   -222046.0745       162.6802          -3596.7406     -2405.7973    921491.4634     -3596.7406     -2405.7973

ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     470     21411.1731     19972.8934      5710.9491       178.5947        -338383.2501     23297.0669         0.0000         0.0000     45346.4576        -222466.1151       164.9579   -267812.5727   -222047.6083       164.9579          -4259.6996     -2477.6832    921491.4634     -4259.6996     -2477.6832

ENERGY:     471     21732.8679     20054.6835      5707.9626       178.5890        -338913.2447     23297.5082         0.0000         0.0000     45471.3369        -222470.2965       165.4122   -267941.6334   -222047.5354       165.4122          -4290.5684     -2504.3176    921491.4634     -4290.5684     -2504.3176

ENERGY:     472     22081.2362     20161.5551      5707.0091       178.9047        -338870.6766     23279.4489         0.0000         0.0000     45028.5301        -222433.9927       163.8014   -267462.5227   -222059.5055       163.8014          -3659.7362     -2479.9185    921491.4634     -3659.7362     -2479.9185

ENERGY:     473     21866.1362     20289.3425      5707.9843       179.6165        -338307.7192     23240.7361         0.0000         0.0000     44634.5179        -222389.3856       162.3681   -267023.9036   -222043.8537       162.3681          -2556.3618     -2408.1659    921491.4634     -2556.3618     -2408.1659

ENERGY:     474     20842.9703     20372.0985      5710.2160       180.7466        -337438.4554     23189.2347         0.0000         0.0000     44733.2313        -222409.9579       162.7272   -267143.1892   -222041.2617       162.7272          -1295.5526     -2316.2730    921491.4634     -1295.5526     -2316.2730

ENERGY:     475     19674.2080     20371.7674      5712.9876       182.2512        -336604.2315     23142.3816         0.0000         0.0000     45070.2144        -222450.4214       163.9531   -267520.6357   -222039.4527       163.9531           -344.6451     -2232.2127    921491.4634      -344.6451     -2232.2127

ENERGY:     476     19235.7862     20282.0274      5715.7683       184.0125        -336100.0905     23115.8465         0.0000         0.0000     45106.0638        -222460.5858       164.0835   -267566.6495   -222053.6134       164.0835            -92.4050     -2183.0654    921491.4634       -92.4050     -2183.0654

ENERGY:     477     19704.7250     20145.9814      5718.4976       185.9230        -336101.8792     23114.2938         0.0000         0.0000     44812.3213        -222420.1371       163.0149   -267232.4584   -222044.8408       163.0149           -667.4947     -2171.8230    921491.4634      -667.4947     -2171.8230

ENERGY:     478     20493.4776     19974.7639      5721.0254       187.7262        -336537.4039     23131.2459         0.0000         0.0000     44627.0338        -222402.1311       162.3409   -267029.1649   -222047.4103       162.3409          -1807.1605     -2198.7957    921491.4634     -1807.1605     -2198.7957

ENERGY:     479     21125.3058     19793.3957      5723.3295       189.2099        -337215.5841     23156.6770         0.0000         0.0000     44802.1583        -222425.5079       162.9779   -267227.6662   -222050.5456       162.9779          -3089.8517     -2246.7919    921491.4634     -3089.8517     -2246.7919

TIMING: 480  CPU: 225.227, 0.458617/step  Wall: 225.227, 0.458617/step, 0.00254787 hours remaining, 3222.074219 MB of memory in use.
ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     480     21624.0328     19623.1965      5725.3111       190.1900        -337854.6789     23181.5117         0.0000         0.0000     45051.6819        -222458.7549       163.8856   -267510.4368   -222064.6208       163.8856          -4077.7328     -2291.4893    921491.4634     -4077.7328     -2291.4893

ENERGY:     481     22092.4855     19510.0434      5727.0952       190.6351        -338199.2484     23196.7958         0.0000         0.0000     45041.3373        -222440.8562       163.8480   -267482.1934   -222052.5264       163.8480          -4466.2395     -2305.6734    921491.4634     -4466.2395     -2305.6734

ENERGY:     482     22186.3467     19466.6794      5728.4964       190.3598        -338044.5421     23192.7473         0.0000         0.0000     44865.8526        -222414.0599       163.2096   -267279.9125   -222051.4111       163.2096          -4059.3099     -2278.0616    921491.4634     -4059.3099     -2278.0616

ENERGY:     483     21553.1412     19511.5745      5729.5660       189.3227        -337426.2187     23165.8739         0.0000         0.0000     44861.8976        -222414.8429       163.1953   -267276.7405   -222048.7671       163.1953          -2964.1723     -2216.4117    921491.4634     -2964.1723     -2216.4117

ENERGY:     484     20460.8924     19631.1939      5730.2465       187.5455        -336590.8880     23126.1350         0.0000         0.0000     45003.6038        -222451.2709       163.7107   -267454.8747   -222059.8734       163.7107          -1565.2423     -2143.1848    921491.4634     -1565.2423     -2143.1848

ENERGY:     485     19688.7720     19800.2991      5730.5256       185.2458        -335902.5861     23092.8469         0.0000         0.0000     44955.5730        -222449.3238       163.5360   -267404.8968   -222045.9598       163.5360           -422.1568     -2086.8734    921491.4634      -422.1568     -2086.8734

ENERGY:     486     19602.5426     19954.8176      5729.7198       182.4662        -335612.3563     23080.3806         0.0000         0.0000     44645.9121        -222416.5174       162.4096   -267062.4295   -222044.6753       162.4096             87.3182     -2070.0981    921491.4634        87.3182     -2070.0981

ENERGY:     487     19881.0925     20072.0212      5727.4348       179.4360        -335846.4477     23091.0542         0.0000         0.0000     44503.3498        -222392.0592       161.8910   -266895.4090   -222045.2399       161.8910           -192.2346     -2106.8839    921491.4634      -192.2346     -2106.8839

ENERGY:     488     20125.2098     20156.1361      5723.5441       176.4338        -336552.5452     23118.8615         0.0000         0.0000     44827.0562        -222425.3037       163.0685   -267252.3599   -222057.1935       163.0685          -1145.7534     -2194.6680    921491.4634     -1145.7534     -2194.6680

ENERGY:     489     20526.8872     20236.4609      5718.5749       173.8639        -337540.4656     23156.7308         0.0000         0.0000     45266.1009        -222461.8469       164.6656   -267727.9479   -222045.6082       164.6656          -2511.2405     -2316.7067    921491.4634     -2511.2405     -2316.7067

ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     490     21410.7492     20292.9022      5712.8912       171.8438        -338458.1363     23196.4875         0.0000         0.0000     45213.5634        -222459.6990       164.4745   -267673.2623   -222048.2204       164.4745          -3823.4039     -2437.4155    921491.4634     -3823.4039     -2437.4155

ENERGY:     491     22430.4642     20312.1361      5707.3795       170.5404        -338984.5795     23226.0935         0.0000         0.0000     44733.0094        -222404.9565       162.7264   -267137.9658   -222049.4634       162.7264          -4629.6935     -2524.6215    921491.4634     -4629.6935     -2524.6215

ENERGY:     492     22612.9548     20289.6812      5702.9945       170.0208        -338937.5817     23232.7203         0.0000         0.0000     44542.1955        -222387.0148       162.0323   -266929.2102   -222060.3857       162.0323          -4606.8525     -2557.4730    921491.4634     -4606.8525     -2557.4730

ENERGY:     493     21558.2188     20260.7376      5700.7779       170.3200        -338358.0633     23214.0534         0.0000         0.0000     45033.8233        -222420.1323       163.8207   -267453.9556   -222046.5897       163.8207          -3796.3820     -2540.0997    921491.4634     -3796.3820     -2540.0997

ENERGY:     494     20068.3366     20225.0264      5700.9806       171.2193        -337454.3833     23183.0792         0.0000         0.0000     45622.2477        -222483.4936       165.9612   -268105.7413   -222044.0864       165.9612          -2500.8993     -2482.1069    921491.4634     -2500.8993     -2482.1069

ENERGY:     495     19383.2463     20186.8304      5703.5926       172.5416        -336566.9882     23159.4621         0.0000         0.0000     45484.1230        -222477.1922       165.4587   -267961.3152   -222041.5560       165.4587          -1249.6837     -2407.3056    921491.4634     -1249.6837     -2407.3056

ENERGY:     496     19722.4833     20130.6475      5708.0350       174.0933        -335998.7151     23154.2632         0.0000         0.0000     44699.5269        -222409.6659       162.6046   -267109.1928   -222049.0669       162.6046           -478.8999     -2343.4752    921491.4634      -478.8999     -2343.4752

ENERGY:     497     20212.6665     20059.9178      5713.4613       175.7242        -335952.5037     23166.3541         0.0000         0.0000     44261.0287        -222363.3510       161.0095   -266624.3797   -222042.7500       161.0095           -421.0234     -2316.7930    921491.4634      -421.0234     -2316.7930

ENERGY:     498     20182.0162     19957.1217      5718.5597       177.2604        -336366.4927     23189.3581         0.0000         0.0000     44728.2533        -222413.9233       162.7091   -267142.1766   -222044.5219       162.7091           -993.4681     -2331.6474    921491.4634      -993.4681     -2331.6474

ENERGY:     499     20158.0677     19847.7309      5722.4090       178.6361        -337058.4817     23219.2400         0.0000         0.0000     45439.2641        -222493.1339       165.2956   -267932.3980   -222047.2062       165.2956          -2020.8689     -2376.3392    921491.4634     -2020.8689     -2376.3392

Info: Benchmark time: 4 CPUs 0.457776 s/step 5.29833 days/ns 3222.07 MB memory
TIMING: 500  CPU: 234.325, 0.454888/step  Wall: 234.325, 0.454888/step, 0 hours remaining, 3222.074219 MB of memory in use.
ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     500     20974.8937     19756.6584      5724.4523       179.8271        -337741.4185     23251.1005         0.0000         0.0000     45359.0774        -222495.4090       165.0039   -267854.4864   -222061.0909       165.0039          -3197.5168     -2425.4142    921491.4634     -3197.5168     -2425.4142

WRITING EXTENDED SYSTEM TO OUTPUT FILE AT STEP 500
WRITING COORDINATES TO OUTPUT FILE AT STEP 500
The last position output (seq=-2) takes 0.002 seconds, 3227.168 MB of memory in use
WRITING VELOCITIES TO OUTPUT FILE AT STEP 500
The last velocity output (seq=-2) takes 0.002 seconds, 3227.168 MB of memory in use
====================================================

WallClock: 237.852966  CPUTime: 237.852966  Memory: 3227.167969 MB
[Partition 0][Node 0] End of program
Application 287075 resources: utime ~940s, stime ~13s, Rss ~126424, inblocks ~66494, outblocks ~71264
[SSH] exit-status: 0
[NAMD-Run] $ /bin/sh -xe /tmp/hudson8449442687138538123.sh
+ scp [email protected]:/scratch/jenkins/applications/namd/2.10/cle5.2_gnu5.1.0/cputime /var/lib/jenkins/workspace/NAMD-Run
NCSA JYC System 
Access status: User Access UnRestricted.

Access by OTP or Two Factor Certificate Authority only.
Use myproxy-logon -s tfca.ncsa.illinois.edu -p 7512 for gsissh access.
gsissh or ssh -o PreferredAuthentications=keyboard-interactive for otp access.

+ scp [email protected]:/scratch/jenkins/applications/namd/2.10/cle5.2_gnu5.1.0/memory /var/lib/jenkins/workspace/NAMD-Run
NCSA JYC System 
Access status: User Access UnRestricted.

Access by OTP or Two Factor Certificate Authority only.
Use myproxy-logon -s tfca.ncsa.illinois.edu -p 7512 for gsissh access.
gsissh or ssh -o PreferredAuthentications=keyboard-interactive for otp access.

+ scp [email protected]:/scratch/jenkins/applications/namd/2.10/cle5.2_gnu5.1.0/wallclock /var/lib/jenkins/workspace/NAMD-Run
NCSA JYC System 
Access status: User Access UnRestricted.

Access by OTP or Two Factor Certificate Authority only.
Use myproxy-logon -s tfca.ncsa.illinois.edu -p 7512 for gsissh access.
gsissh or ssh -o PreferredAuthentications=keyboard-interactive for otp access.

Recording plot data
Saving plot series data from: /var/lib/jenkins/workspace/NAMD-Run/wallclock
Saving plot series data from: /var/lib/jenkins/workspace/NAMD-Run/cputime
Saving plot series data from: /var/lib/jenkins/workspace/NAMD-Run/memory
Finished: SUCCESS