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ENERGY:      83     17463.4115     17611.3784      5761.4800       185.4557        -334548.5449     23165.5264         0.0000         0.0000     47631.4997        -222729.7931       173.2703   -270361.2928   -222380.7999       173.2703          -2245.6201     -2209.9239    921491.4634     -2245.6201     -2209.9239

ENERGY:      84     15692.0180     17521.7594      5761.2958       180.7102        -333070.6344     23043.3534         0.0000         0.0000     48072.9173        -222798.5803       174.8761   -270871.4976   -222420.9193       174.8761          -1264.6407     -2119.1646    921491.4634     -1264.6407     -2119.1646

ENERGY:      85     19034.4748     18377.7082      5761.3316       176.5397        -332350.3364     22972.2187         0.0000         0.0000     43641.9415        -222386.1218       158.7574   -266028.0633   -222396.4598       158.7574          -1101.4911     -2031.8233    921491.4634     -1101.4911     -2031.8233

ENERGY:      86     22361.2996     19720.3241      5758.5583       173.6091        -332514.8438     22921.5212         0.0000         0.0000     39480.2342        -222099.2974       143.6182   -261579.5316   -222396.4730       143.6182          -1408.4308     -1992.0456    921491.4634     -1408.4308     -1992.0456

ENERGY:      87     21898.5872     20858.8152      5750.7775       172.4431        -333299.4428     22859.7331         0.0000         0.0000     39513.3019        -222245.7848       143.7385   -261759.0866   -222398.3223       143.7385          -1739.2135     -2002.6067    921491.4634     -1739.2135     -2002.6067

ENERGY:      88     19807.2124     21236.1262      5737.2297       173.3188        -334313.4195     22793.0785         0.0000         0.0000     42007.3339        -222559.1200       152.8111   -264566.4539   -222408.9129       152.8111          -2036.3958     -2043.8955    921491.4634     -2036.3958     -2043.8955

ENERGY:      89     20138.2922     20745.5546      5719.3133       176.3160        -335202.8323     22743.6988         0.0000         0.0000     43113.7497        -222565.9076       156.8360   -265679.6574   -222389.0015       156.8360          -2409.8247     -2071.1686    921491.4634     -2409.8247     -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     22711.6049     19691.0676      5699.8921       181.1111        -335712.1132     22705.2746         0.0000         0.0000     42377.6758        -222345.4871       154.1583   -264723.1629   -222389.2094       154.1583          -2670.9833     -2080.5818    921491.4634     -2670.9833     -2080.5818

ENERGY:      91     23737.5989     18627.1145      5683.0577       187.2277        -335678.4159     22643.5818         0.0000         0.0000     42539.3829        -222260.4522       154.7466   -264799.8352   -222388.3581       154.7466          -2499.0954     -2078.8099    921491.4634     -2499.0954     -2078.8099

ENERGY:      92     21523.8221     18060.4537      5672.6738       194.0387        -335129.0786     22543.7115         0.0000         0.0000     44665.3079        -222469.0709       162.4801   -267134.3788   -222389.6059       162.4801          -1910.9684     -2078.9076    921491.4634     -1910.9684     -2078.9076

ENERGY:      93     18788.3598     18281.5995      5671.3716       200.9119        -334319.2925     22433.7892         0.0000         0.0000     46311.8833        -222631.3771       168.4699   -268943.2604   -222367.8861       168.4699          -1385.1718     -2068.2565    921491.4634     -1385.1718     -2068.2565

ENERGY:      94     18530.9328     19242.9915      5679.4418       207.1113        -333693.3062     22351.2077         0.0000         0.0000     45144.9171        -222536.7040       164.2248   -267681.6211   -222367.0865       164.2248          -1347.2600     -2063.4575    921491.4634     -1347.2600     -2063.4575

ENERGY:      95     20040.4585     20654.3437      5695.3527       212.0382        -333603.6977     22302.2586         0.0000         0.0000     42387.6997        -222311.5463       154.1948   -264699.2460   -222367.4634       154.1948          -1793.7082     -2083.6407    921491.4634     -1793.7082     -2083.6407

ENERGY:      96     20584.1063     22050.3789      5716.0483       215.1945        -334091.8990     22265.7316         0.0000         0.0000     40970.7076        -222289.7316       149.0402   -263260.4392   -222356.3660       149.0402          -2389.6990     -2142.8256    921491.4634     -2389.6990     -2142.8256

ENERGY:      97     19809.1308     22949.2011      5737.7476       216.2279        -334886.9639     22225.8322         0.0000         0.0000     41505.2398        -222443.5845       150.9847   -263948.8243   -222346.5815       150.9847          -2891.9374     -2214.1665    921491.4634     -2891.9374     -2214.1665

ENERGY:      98     19979.7556     22958.8353      5756.3117       214.8681        -335616.8430     22188.2114         0.0000         0.0000     41993.4227        -222525.4382       152.7605   -264518.8609   -222347.6398       152.7605          -3206.5490     -2272.3421    921491.4634     -3206.5490     -2272.3421

ENERGY:      99     22029.8952     22024.0795      5768.5777       211.0972        -336009.8229     22159.4701         0.0000         0.0000     41425.1769        -222391.5263       150.6934   -263816.7032   -222348.0704       150.6934          -3235.8098     -2296.7688    921491.4634     -3235.8098     -2296.7688

LDB: ============= START OF LOAD BALANCING ============== 54.1762
LDB: Largest compute 200 load 0.433736 is 1.2% of average load 36.774971
LDB: Average compute 0.051512 is 0.1% of average load 36.774971
LDB: Partitioning computes with target load 3.677497
LDB: Increased migratable compute count from 2736 to 2736
LDB: Largest unpartitionable compute is 0.055686
LDB: ============== END OF LOAD BALANCING =============== 54.1782
Info: useSync: 1 useProxySync: 0
LDB: =============== DONE WITH MIGRATION ================ 54.1791
Info: Initial time: 4 CPUs 0.473302 s/step 5.47803 days/ns 3221.5 MB memory
TIMING: 100  CPU: 48.3009, 0.472291/step  Wall: 48.3009, 0.472291/step, 0.0524768 hours remaining, 3221.496094 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     23587.3021     20475.3729      5773.0375       205.1509        -335896.4624     22125.7987         0.0000         0.0000     41455.8050        -222273.9952       150.8048   -263729.8002   -222326.1727       150.8048          -2788.3921     -2294.3880    921491.4634     -2788.3921     -2294.3880

ENERGY:     101     22287.3000     18933.8502      5770.3900       197.5201        -335238.2413     22065.3980         0.0000         0.0000     43590.2955        -222393.4876       158.5695   -265983.7831   -222319.4708       158.5695          -1880.2674     -2262.6846    921491.4634     -1880.2674     -2262.6846

ENERGY:     102     19420.3335     17951.6561      5762.8059       188.8891        -334088.2234     21980.7895         0.0000         0.0000     46153.7217        -222630.0275       167.8946   -268783.7493   -222317.3983       167.8946           -924.5795     -2215.2271    921491.4634      -924.5795     -2215.2271

ENERGY:     103     18429.6588     17794.2510      5753.5002       180.0834        -332765.4445     21898.9792         0.0000         0.0000     46061.5883        -222647.3836       167.5594   -268708.9719   -222315.0117       167.5594           -521.9323     -2162.1475    921491.4634      -521.9323     -2162.1475

ENERGY:     104     20135.5160     18313.1191      5745.4365       171.9705        -331716.6192     21838.6802         0.0000         0.0000     43114.8218        -222397.0750       156.8399   -265511.8968   -222300.0344       156.8399           -904.7451     -2132.5693    921491.4634      -904.7451     -2132.5693

ENERGY:     105     21674.8146     19112.5118      5740.5773       165.3638        -331353.5904     21791.8563         0.0000         0.0000     40663.3131        -222205.1535       147.9220   -262868.4666   -222297.2864       147.9220          -1781.0301     -2140.0925    921491.4634     -1781.0301     -2140.0925

ENERGY:     106     20688.3525     19760.1602      5739.0355       160.9482        -331684.6911     21743.4748         0.0000         0.0000     41270.8908        -222321.8291       150.1322   -263592.7199   -222299.8105       150.1322          -2687.8654     -2192.8737    921491.4634     -2687.8654     -2192.8737

ENERGY:     107     18828.1850     20041.3659      5739.7936       159.1631        -332486.5661     21693.8616         0.0000         0.0000     43452.4231        -222571.7737       158.0680   -266024.1969   -222302.3926       158.0680          -3435.4055     -2264.9714    921491.4634     -3435.4055     -2264.9714

ENERGY:     108     19374.7527     19955.6334      5740.9974       160.1493        -333435.9266     21654.4582         0.0000         0.0000     43952.1728        -222597.7628       159.8859   -266549.9357   -222305.0567       159.8859          -3989.5484     -2325.7046    921491.4634     -3989.5484     -2325.7046

ENERGY:     109     22394.0522     19651.8554      5740.7059       163.7566        -334323.6681     21623.9120         0.0000         0.0000     42380.9038        -222368.4823       154.1701   -264749.3861   -222289.2486       154.1701          -4162.2878     -2354.5142    921491.4634     -4162.2878     -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     24310.7314     19315.3191      5736.8740       169.5643        -334907.1604     21583.6716         0.0000         0.0000     41568.0398        -222222.9602       151.2131   -263791.0000   -222288.3781       151.2131          -3608.1964     -2356.1915    921491.4634     -3608.1964     -2356.1915

ENERGY:     111     22660.5937     19186.3867      5728.6091       176.9885        -335028.8264     21518.8536         0.0000         0.0000     43385.4035        -222371.9913       157.8242   -265757.3948   -222286.8999       157.8242          -2331.3778     -2338.2312    921491.4634     -2331.3778     -2338.2312

ENERGY:     112     19381.8200     19463.5170      5716.4074       185.3624        -334677.6374     21440.9489         0.0000         0.0000     45860.8185        -222628.7633       166.8291   -268489.5818   -222302.4568       166.8291           -894.2293     -2309.1963    921491.4634      -894.2293     -2309.1963

ENERGY:     113     18216.1581     20180.8084      5702.4491       194.0323        -334046.4824     21376.2231         0.0000         0.0000     45761.5816        -222615.2299       166.4681   -268376.8115   -222273.7400       166.4681            -55.6424     -2273.8625    921491.4634       -55.6424     -2273.8625

ENERGY:     114     19843.9971     21062.4095      5689.3793       202.2945        -333472.4287     21337.7637         0.0000         0.0000     42964.6871        -222371.8976       156.2937   -265336.5847   -222272.2452       156.2937           -128.5962     -2261.6571    921491.4634      -128.5962     -2261.6571

ENERGY:     115     21448.4484     21679.6563      5680.2429       209.5308        -333239.9678     21316.4507         0.0000         0.0000     40710.1056        -222195.5331       148.0922   -262905.6387   -222272.7006       148.0922           -905.3246     -2296.5621    921491.4634      -905.3246     -2296.5621

ENERGY:     116     20838.2581     21694.4197      5677.2615       215.2237        -333429.0367     21301.4963         0.0000         0.0000     41385.0931        -222317.2843       150.5476   -263702.3774   -222276.5258       150.5476          -2000.5238     -2380.1424    921491.4634     -2000.5238     -2380.1424

ENERGY:     117     19309.7302     21105.1713      5681.4214       219.0426        -333858.2254     21295.0741         0.0000         0.0000     43733.0002        -222514.7855       159.0886   -266247.7857   -222254.7026       159.0886          -3196.9893     -2479.5443    921491.4634     -3196.9893     -2479.5443

ENERGY:     118     19488.7485     20180.1712      5691.5867       220.7069        -334305.8418     21303.6951         0.0000         0.0000     44852.5144        -222568.4191       163.1611   -267420.9335   -222257.5958       163.1611          -4287.8519     -2560.8627    921491.4634     -4287.8519     -2560.8627

ENERGY:     119     21608.8170     19327.4369      5705.7183       220.1523        -334582.5768     21318.6507         0.0000         0.0000     43971.5397        -222430.2618       159.9564   -266401.8015   -222258.7220       159.9564          -4948.0953     -2603.4635    921491.4634     -4948.0953     -2603.4635

LDB: ============= START OF LOAD BALANCING ============== 63.6058
LDB: ============== END OF LOAD BALANCING =============== 63.6059
Info: useSync: 1 useProxySync: 0
LDB: =============== DONE WITH MIGRATION ================ 63.6063
TIMING: 120  CPU: 57.7276, 0.471335/step  Wall: 57.7276, 0.471335/step, 0.0497521 hours remaining, 3221.640625 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     23278.7484     18843.5009      5721.1111       217.5091        -334559.3220     21317.8986         0.0000         0.0000     42838.0029        -222342.5510       155.8329   -265180.5539   -222260.9693       155.8329          -4802.3840     -2609.8232    921491.4634     -4802.3840     -2609.8232

ENERGY:     121     22753.8287     18833.9840      5735.1154       213.1885        -334109.3886     21287.1663         0.0000         0.0000     42902.9081        -222383.1975       156.0690   -265286.1057   -222238.8455       156.0690          -3789.7330     -2573.0323    921491.4634     -3789.7330     -2573.0323

ENERGY:     122     20911.3204     19183.7910      5744.9150       207.6394        -333246.0908     21235.0875         0.0000         0.0000     43471.2678        -222492.0697       158.1365   -265963.3375   -222236.2048       158.1365          -2259.2350     -2503.9465    921491.4634     -2259.2350     -2503.9465

ENERGY:     123     19716.6565     19702.2261      5748.9495       201.5075        -332195.6662     21181.3172         0.0000         0.0000     43159.1486        -222485.8609       157.0011   -265645.0095   -222233.3015       157.0011           -827.7756     -2423.1751    921491.4634      -827.7756     -2423.1751

ENERGY:     124     19701.7329     20151.8501      5747.1965       195.4812        -331340.9822     21138.0467         0.0000         0.0000     42008.6529        -222398.0219       152.8159   -264406.6748   -222234.8510       152.8159              8.3517     -2371.2952    921491.4634         8.3517     -2371.2952

ENERGY:     125     19961.8488     20319.7042      5741.5018       190.2907        -331002.3873     21106.9631         0.0000         0.0000     41347.6159        -222334.4630       150.4113   -263682.0789   -222218.5353       150.4113             16.1241     -2370.5229    921491.4634        16.1241     -2370.5229

ENERGY:     126     19913.8780     20060.3739      5734.4100       186.3237        -331257.3386     21089.4917         0.0000         0.0000     41888.6055        -222384.2558       152.3792   -264272.8613   -222220.0406       152.3792           -757.3345     -2430.8872    921491.4634      -757.3345     -2430.8872

ENERGY:     127     20034.1247     19457.5518      5728.8730       183.8513        -331985.2681     21088.4979         0.0000         0.0000     43047.2721        -222445.0974       156.5941   -265492.3694   -222223.2519       156.5941          -2122.5054     -2533.3235    921491.4634     -2122.5054     -2533.3235

ENERGY:     128     20681.9269     18818.3078      5727.0308       182.9174        -332977.2827     21101.0436         0.0000         0.0000     44006.3125        -222459.7437       160.0829   -266466.0562   -222232.5707       160.0829          -3698.9567     -2655.1908    921491.4634     -3698.9567     -2655.1908

ENERGY:     129     21368.2887     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          -4993.9822     -2763.9222    921491.4634     -4993.9822     -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     21553.6088     18898.7761      5736.4508       185.0194        -334776.0137     21118.0422         0.0000         0.0000     44811.1497        -222472.9666       163.0106   -267284.1163   -222216.5364       163.0106          -5536.0557     -2842.3154    921491.4634     -5536.0557     -2842.3154

ENERGY:     131     21530.9957     19804.6628      5745.0872       187.0957        -335083.2644     21105.7069         0.0000         0.0000     44221.5103        -222488.2059       160.8657   -266709.7161   -222215.1804       160.8657          -5164.7865     -2872.9597    921491.4634     -5164.7865     -2872.9597

ENERGY:     132     21696.5183     20951.9798      5753.4447       189.2233        -334841.7370     21081.3851         0.0000         0.0000     42732.1267        -222437.0592       155.4477   -265169.1859   -222222.8148       155.4477          -4015.6411     -2856.5554    921491.4634     -4015.6411     -2856.5554

ENERGY:     133     21569.7009     21939.4306      5759.4053       191.1377        -334187.7140     21049.8506         0.0000         0.0000     41346.5716        -222331.6173       150.4075   -263678.1889   -222209.0244       150.4075          -2436.6192     -2806.2333    921491.4634     -2436.6192     -2806.2333

ENERGY:     134     20380.1717     22407.7422      5761.0449       192.4922        -333420.8525     21018.0949         0.0000         0.0000     41320.1609        -222341.1457       150.3114   -263661.3066   -222206.0449       150.3114           -846.9779     -2759.4267    921491.4634      -846.9779     -2759.4267

ENERGY:     135     18735.1491     22221.9401      5757.7067       193.2251        -332860.3441     20999.0422         0.0000         0.0000     42497.1276        -222456.1532       154.5929   -264953.2808   -222204.4872       154.5929            191.9085     -2745.1432    921491.4634       191.9085     -2745.1432

ENERGY:     136     18381.4538     21453.0792      5750.0867       193.4037        -332655.7487     21006.3295         0.0000         0.0000     43348.3540        -222523.0418       157.6894   -265871.3958   -222211.0694       157.6894            198.1851     -2776.3543    921491.4634       198.1851     -2776.3543

ENERGY:     137     19975.5715     20347.8314      5740.3098       193.2572        -332832.5918     21040.1067         0.0000         0.0000     43092.4469        -222443.0684       156.7585   -265535.5153   -222209.8938       156.7585           -927.2503     -2841.0685    921491.4634      -927.2503     -2841.0685

ENERGY:     138     21874.8525     19195.4802      5730.8549       192.8766        -333203.4344     21083.5324         0.0000         0.0000     42784.9639        -222340.8739       155.6399   -265125.8378   -222213.1816       155.6399          -2704.7056     -2927.3525    921491.4634     -2704.7056     -2927.3525

ENERGY:     139     22116.0297     18330.1125      5724.2506       192.4679        -333575.3363     21115.6333         0.0000         0.0000     43705.6789        -222391.1636       158.9892   -266096.8425   -222217.3489       158.9892          -4443.4109     -3015.1529    921491.4634     -4443.4109     -3015.1529

TIMING: 140  CPU: 67.1498, 0.47111/step  Wall: 67.1498, 0.47111/step, 0.047111 hours remaining, 3221.898438 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     20992.5978     17997.1577      5722.1741       192.2140        -333726.9442     21127.4061         0.0000         0.0000     45144.2513        -222551.1432       164.2224   -267695.3945   -222224.0361       164.2224          -5617.7629     -3080.3638    921491.4634     -5617.7629     -3080.3638

ENERGY:     141     20605.2149     18251.9195      5725.3083       192.2642        -333525.1323     21120.3060         0.0000         0.0000     45039.8864        -222590.2331       163.8427   -267630.1195   -222215.3920       163.8427          -6017.5039     -3087.0005    921491.4634     -6017.5039     -3087.0005

ENERGY:     142     21702.7400     18860.4297      5732.9228       192.6003        -332879.0278     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     22457.6178     19468.7635      5743.5741       193.1827        -331957.5929     21040.0377         0.0000         0.0000     40797.9948        -222256.4223       148.4119   -263054.4171   -222209.6223       148.4119          -4179.8276     -2928.5086    921491.4634     -4179.8276     -2928.5086

ENERGY:     144     21007.3337     19787.0056      5755.2166       193.9151        -331097.8393     20965.2215         0.0000         0.0000     41087.3102        -222301.8365       149.4643   -263389.1468   -222194.0941       149.4643          -2265.2407     -2825.3504    921491.4634     -2265.2407     -2825.3504

ENERGY:     145     18390.7598     19760.7601      5765.7577       194.6436        -330692.1919     20892.9233         0.0000         0.0000     43191.0818        -222496.2656       157.1173   -265687.3474   -222180.9593       157.1173           -495.5028     -2742.5239    921491.4634      -495.5028     -2742.5239

ENERGY:     146     17494.3904     19517.0963      5773.0763       195.1974        -330883.4473     20850.7305         0.0000         0.0000     44468.0626        -222584.8937       161.7626   -267052.9563   -222180.0853       161.7626            380.5832     -2698.3696    921491.4634       380.5832     -2698.3696

ENERGY:     147     19349.0815     19284.4051      5776.1299       195.3841        -331633.2791     20843.7953         0.0000         0.0000     43729.9298        -222454.5535       159.0775   -266184.4832   -222180.7856       159.0775             12.4495     -2697.6201    921491.4634        12.4495     -2697.6201

ENERGY:     148     21731.1609     19240.1451      5775.1361       195.0156        -332748.3460     20852.0478         0.0000         0.0000     42647.1434        -222307.6971       155.1386   -264954.8404   -222173.9041       155.1386          -1313.5163     -2742.2255    921491.4634     -1313.5163     -2742.2255

ENERGY:     149     22154.0982     19476.6232      5771.6403       193.9272        -333952.9656     20853.5364         0.0000         0.0000     43165.2620        -222337.8783       157.0234   -265503.1403   -222149.8011       157.0234          -2998.4813     -2814.2281    921491.4634     -2998.4813     -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     21015.8994     19956.3835      5767.3089       192.0924        -334899.3755     20845.5771         0.0000         0.0000     44606.5897        -222515.5244       162.2665   -267122.1141   -222153.2665       162.2665          -4472.9375     -2881.9211    921491.4634     -4472.9375     -2881.9211

ENERGY:     151     20656.1101     20586.9277      5763.7530       189.5631        -335303.4338     20835.7247         0.0000         0.0000     44710.6378        -222560.7175       162.6450   -267271.3553   -222155.1379       162.6450          -5407.8408     -2907.6331    921491.4634     -5407.8408     -2907.6331

ENERGY:     152     21757.0223     21203.4204      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     22396.4536     21618.6023      5761.5688       183.0547        -334307.6860     20787.1625         0.0000         0.0000     41296.2810        -222264.5631       150.2245   -263560.8441   -222152.0204       150.2245          -4765.4776     -2800.4121    921491.4634     -4765.4776     -2800.4121

ENERGY:     154     20952.1342     21640.3347      5761.9239       179.5647        -333344.9134     20735.3659         0.0000         0.0000     41746.1291        -222329.4608       151.8609   -264075.5899   -222148.7915       151.8609          -3178.1873     -2707.3606    921491.4634     -3178.1873     -2707.3606

ENERGY:     155     18734.5490     21249.5941      5761.4993       176.3183        -332564.0954     20691.4724         0.0000         0.0000     43448.4574        -222502.2051       158.0535   -265950.6625   -222145.9854       158.0535          -1408.3062     -2623.9032    921491.4634     -1408.3062     -2623.9032

ENERGY:     156     18312.4483     20599.9074      5758.8570       173.6449        -332218.9148     20684.3830         0.0000         0.0000     44137.5522        -222552.1221       160.5603   -266689.6743   -222166.8050       160.5603           -219.5095     -2571.5313    921491.4634      -219.5095     -2571.5313

ENERGY:     157     20043.0837     19943.2665      5753.0947       171.8900        -332363.0660     20715.7865         0.0000         0.0000     43325.6933        -222410.2513       157.6070   -265735.9447   -222155.5012       157.6070            -38.8543     -2554.7665    921491.4634       -38.8543     -2554.7665

ENERGY:     158     21695.0846     19425.3239      5743.5667       171.3409        -332829.8104     20761.5806         0.0000         0.0000     42713.6820        -222319.2318       155.3806   -265032.9138   -222157.3223       155.3806           -715.5936     -2586.7969    921491.4634      -715.5936     -2586.7969

ENERGY:     159     21695.6536     19084.6409      5730.9315       172.1899        -333376.4009     20800.7930         0.0000         0.0000     43483.6004        -222408.5916       158.1814   -265892.1920   -222160.0972       158.1814          -1882.1014     -2660.7875    921491.4634     -1882.1014     -2660.7875

TIMING: 160  CPU: 76.5585, 0.470435/step  Wall: 76.5585, 0.470435/step, 0.04443 hours remaining, 3222.195312 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     21093.2844     18859.3045      5717.0749       174.4916        -333735.9155     20833.5472         0.0000         0.0000     44515.8595        -222542.3533       161.9365   -267058.2128   -222175.6786       161.9365          -3202.8707     -2752.7604    921491.4634     -3202.8707     -2752.7604

ENERGY:     161     21561.6003     18685.5959      5704.9782       178.2042        -333710.7596     20865.7133         0.0000         0.0000     44220.7112        -222493.9567       160.8628   -266714.6679   -222160.9738       160.8628          -4385.1103     -2823.4851    921491.4634     -4385.1103     -2823.4851

ENERGY:     162     22512.8125     18508.1492      5697.2826       183.0024        -333202.6495     20887.8857         0.0000         0.0000     43070.6067        -222342.9104       156.6790   -265413.5171   -222161.4907       156.6790          -5004.1554     -2859.8870    921491.4634     -5004.1554     -2859.8870

ENERGY:     163     21937.9851     18346.8656      5696.1509       188.4544        -332368.8222     20884.6196         0.0000         0.0000     43005.6962        -222309.0505       156.4429   -265314.7466   -222160.7801       156.4429          -4776.8219     -2868.7270    921491.4634     -4776.8219     -2868.7270

ENERGY:     164     19652.8064     18261.0399      5702.5306       194.0206        -331567.4467     20861.9109         0.0000         0.0000     44426.5344        -222468.6039       161.6115   -266895.1383   -222170.9034       161.6115          -3836.1731     -2870.4448    921491.4634     -3836.1731     -2870.4448

ENERGY:     165     18074.0950     18343.8149      5716.1638       199.2019        -331183.0464     20849.6743         0.0000         0.0000     45425.8564        -222574.2401       165.2468   -268000.0965   -222153.1698       165.2468          -2737.5184     -2867.1446    921491.4634     -2737.5184     -2867.1446

ENERGY:     166     18979.7068     18650.1653      5734.9735       203.3281        -331407.1001     20870.8940         0.0000         0.0000     44483.6889        -222484.3435       161.8194   -266968.0325   -222151.2327       161.8194          -1964.3634     -2870.3839    921491.4634     -1964.3634     -2870.3839

ENERGY:     167     21026.8306     19216.2867      5755.9248       205.8794        -332212.1861     20917.6389         0.0000         0.0000     42775.8062        -222313.8196       155.6066   -265089.6258   -222150.5298       155.6066          -1671.2498     -2889.5868    921491.4634     -1671.2498     -2889.5868

ENERGY:     168     21619.4182     19999.6889      5775.3367       206.4584        -333382.4928     20963.4338         0.0000         0.0000     42492.3351        -222325.8217       154.5754   -264818.1568   -222149.7708       154.5754          -1735.9905     -2933.5976    921491.4634     -1735.9905     -2933.5976

ENERGY:     169     20648.4666     20870.4070      5789.9166       204.9287        -334596.5073     20994.5723         0.0000         0.0000     43600.1910        -222488.0252       158.6055   -266088.2162   -222133.5316       158.6055          -2095.8777     -2988.7947    921491.4634     -2095.8777     -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     20485.0015     21574.3802      5797.0542       201.1981        -335480.2505     21017.8094         0.0000         0.0000     43834.2688        -222570.5382       159.4570   -266404.8070   -222135.2421       159.4570          -2696.1968     -3030.4960    921491.4634     -2696.1968     -3030.4960

ENERGY:     171     22225.3642     21884.1728      5796.1347       195.5169        -335757.0018     21036.7488         0.0000         0.0000     42205.8539        -222413.2105       153.5333   -264619.0643   -222135.5892       153.5333          -3373.1626     -3035.3578    921491.4634     -3373.1626     -3035.3578

ENERGY:     172     23612.5241     21689.2906      5788.4217       188.3823        -335345.7510     21036.2040         0.0000         0.0000     40787.7257        -222243.2027       148.3745   -263030.9284   -222132.3043       148.3745          -3754.4379     -3004.4812    921491.4634     -3754.4379     -3004.4812

ENERGY:     173     22089.5490     21081.4672      5776.7002       180.5475        -334414.6778     21003.0505         0.0000         0.0000     41986.3986        -222296.9647       152.7350   -264283.3634   -222121.1462       152.7350          -3608.5984     -2944.3814    921491.4634     -3608.5984     -2944.3814

ENERGY:     174     18699.8470     20250.6918      5763.7521       172.7179        -333314.9342     20954.5022         0.0000         0.0000     44924.4953        -222548.9279       163.4230   -267473.4232   -222120.6680       163.4230          -3086.0085     -2871.4630    921491.4634     -3086.0085     -2871.4630

ENERGY:     175     17219.9373     19455.5736      5752.1494       165.6559        -332464.6996     20928.3118         0.0000         0.0000     46291.0145        -222652.0570       168.3940   -268943.0715   -222120.1887       168.3940          -2676.4052     -2794.4451    921491.4634     -2676.4052     -2794.4451

ENERGY:     176     19195.1037     18891.7630      5743.5896       160.0071        -332124.2128     20943.2096         0.0000         0.0000     44722.5120        -222468.0278       162.6882   -267190.5398   -222127.3369       162.6882          -2658.3219     -2727.5044    921491.4634     -2658.3219     -2727.5044

ENERGY:     177     21863.3195     18664.1735      5738.9484       156.2659        -332371.2412     20981.6519         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     21917.7900     18733.9559      5737.6245       154.5770        -332975.2976     21015.2133         0.0000         0.0000     43101.1545        -222314.9824       156.7902   -265416.1369   -222126.1321       156.7902          -2936.2257     -2665.7682    921491.4634     -2936.2257     -2665.7682

ENERGY:     179     20058.5721     19018.0839      5738.2698       154.9022        -333648.1819     21038.3004         0.0000         0.0000     45070.9164        -222569.1372       163.9556   -267640.0535   -222127.1793       163.9556          -2805.2709     -2668.3444    921491.4634     -2805.2709     -2668.3444

TIMING: 180  CPU: 85.9571, 0.469928/step  Wall: 85.9571, 0.469928/step, 0.0417713 hours remaining, 3222.195312 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     19770.2945     19384.7963      5738.8341       156.9935        -334084.3525     21065.2917         0.0000         0.0000     45324.2213        -222643.9211       164.8771   -267968.1425   -222142.6344       164.8771          -2684.8631     -2671.3561    921491.4634     -2684.8631     -2671.3561

ENERGY:     181     22122.8096     19693.8081      5737.3498       160.4696        -334134.1968     21097.1423         0.0000         0.0000     42906.0429        -222416.5745       156.0804   -265322.6174   -222134.4681       156.0804          -2655.0379     -2656.7563    921491.4634     -2655.0379     -2656.7563

ENERGY:     182     23922.3457     19800.0771      5732.0748       164.8150        -333691.2982     21109.5294         0.0000         0.0000     40770.0180        -222192.4383       148.3101   -262962.4563   -222132.7634       148.3101          -2461.5986     -2635.7203    921491.4634     -2461.5986     -2635.7203

ENERGY:     183     22149.3485     19677.1532      5722.7616       169.5349        -332921.8735     21084.4912         0.0000         0.0000     41834.8235        -222283.7607       152.1836   -264118.5841   -222131.2590       152.1836          -1990.8045     -2626.5157    921491.4634     -1990.8045     -2626.5157

ENERGY:     184     18376.8754     19424.9914      5710.5468       174.1844        -332181.9077     21042.4479         0.0000         0.0000     44880.5528        -222572.3089       163.2631   -267452.8617   -222144.6141       163.2631          -1576.6174     -2645.2274    921491.4634     -1576.6174     -2645.2274

ENERGY:     185     16957.7743     19234.6872      5697.7241       178.4155        -331895.6958     21023.9444         0.0000         0.0000     46149.4988        -222653.6516       167.8792   -268803.1504   -222128.1654       167.8792          -1752.9881     -2679.2077    921491.4634     -1752.9881     -2679.2077

ENERGY:     186     19266.0404     19234.9570      5686.4352       181.9571        -332240.0935     21043.7460         0.0000         0.0000     44391.5887        -222435.3689       161.4844   -266826.9577   -222129.2886       161.4844          -2596.4731     -2731.4263    921491.4634     -2596.4731     -2731.4263

ENERGY:     187     22073.2967     19471.4304      5678.7398       184.6336        -333156.1126     21076.9265         0.0000         0.0000     42449.0056        -222222.0799       154.4178   -264671.0856   -222130.9078       154.4178          -3641.8536     -2802.0866    921491.4634     -3641.8536     -2802.0866

ENERGY:     188     22101.1831     19886.6774      5676.0120       186.3502        -334382.7613     21093.9045         0.0000         0.0000     43113.1616        -222325.4726       156.8338   -265438.6342   -222135.3908       156.8338          -4316.2656     -2887.0591    921491.4634     -4316.2656     -2887.0591

ENERGY:     189     20394.2464     20391.8603      5678.8863       187.1154        -335558.5043     21096.5841         0.0000         0.0000     45245.6388        -222564.1731       164.5912   -267809.8119   -222116.4324       164.5912          -4451.6372     -2950.0786    921491.4634     -4451.6372     -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     20342.0728     20848.4450      5686.3597       187.0164        -336318.7435     21106.5488         0.0000         0.0000     45533.2634        -222615.0374       165.6375   -268148.3009   -222116.1590       165.6375          -4141.9213     -2962.8210    921491.4634     -4141.9213     -2962.8210

ENERGY:     191     22534.8507     21157.2828      5696.5257       186.2614        -336419.5253     21124.8645         0.0000         0.0000     43330.7336        -222389.0067       157.6253   -265719.7403   -222114.1140       157.6253          -3471.5978     -2915.5481    921491.4634     -3471.5978     -2915.5481

ENERGY:     192     23768.4830     21244.3749      5706.8010       185.1520        -335814.4793     21125.1404         0.0000         0.0000     41560.2538        -222224.2741       151.1848   -263784.5279   -222108.6418       151.1848          -2412.4655     -2830.7902    921491.4634     -2412.4655     -2830.7902

ENERGY:     193     21710.8593     21097.1074      5714.9848       184.0569        -334711.3258     21092.9042         0.0000         0.0000     42578.8349        -222332.5782       154.8901   -264911.4131   -222093.8903       154.8901          -1181.4693     -2735.1546    921491.4634     -1181.4693     -2735.1546

ENERGY:     194     18383.3647     20711.5283      5719.3482       183.2863        -333492.4630     21054.1040         0.0000         0.0000     44867.8137        -222573.0179       163.2168   -267440.8316   -222092.1688       163.2168           -314.8313     -2651.4482    921491.4634      -314.8313     -2651.4482

ENERGY:     195     17581.7009     20169.9816      5719.7968       183.0839        -332603.8307     21048.2209         0.0000         0.0000     45307.7485        -222593.2980       164.8171   -267901.0465   -222091.6061       164.8171           -398.0875     -2592.7756    921491.4634      -398.0875     -2592.7756

ENERGY:     196     19755.8661     19594.9320      5717.4229       183.5644        -332319.6949     21082.8579         0.0000         0.0000     43603.6155        -222381.4362       158.6180   -265985.0517   -222096.3128       158.6180          -1480.5938     -2574.8092    921491.4634     -1480.5938     -2574.8092

ENERGY:     197     21700.3669     19122.7580      5714.1451       184.7200        -332668.2730     21129.4588         0.0000         0.0000     42574.3654        -222242.4588       154.8738   -264816.8242   -222086.7181       154.8738          -3040.7437     -2596.5494    921491.4634     -3040.7437     -2596.5494

ENERGY:     198     21224.0061     18800.3005      5711.3574       186.3640        -333385.4998     21161.1533         0.0000         0.0000     43911.2863        -222391.0321       159.7372   -266302.3185   -222090.4392       159.7372          -4381.6810     -2646.7680    921491.4634     -4381.6810     -2646.7680

ENERGY:     199     20113.4049     18634.4039      5710.3429       188.2374        -334151.8587     21182.1777         0.0000         0.0000     45722.9588        -222600.3331       166.3276   -268323.2919   -222093.2751       166.3276          -5152.2288     -2691.5412    921491.4634     -5152.2288     -2691.5412

LDB: ============= START OF LOAD BALANCING ============== 101.235
LDB: Largest compute 200 load 0.428746 is 1.2% of average load 36.596044
LDB: Average compute 0.051257 is 0.1% of average load 36.596044
LDB: TIME 101.237 LOAD: AVG 36.596 MAX 37.6291  PROXIES: TOTAL 112 MAXPE 28 MAXPATCH 1 None MEM: 3222.54 MB
LDB: TIME 101.239 LOAD: AVG 36.596 MAX 37.4631  PROXIES: TOTAL 112 MAXPE 28 MAXPATCH 1 TorusLB MEM: 3222.54 MB
LDB: ============== END OF LOAD BALANCING =============== 101.241
Info: useSync: 1 useProxySync: 0
LDB: =============== DONE WITH MIGRATION ================ 101.244
Info: Initial time: 4 CPUs 0.470532 s/step 5.44597 days/ns 3223.77 MB memory
TIMING: 200  CPU: 95.3637, 0.470332/step  Wall: 95.3637, 0.470332/step, 0.0391944 hours remaining, 3223.769531 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     21073.6839     18595.6348      5711.8747       190.0258        -334670.2811     21209.9247         0.0000         0.0000     45319.1600        -222569.9772       164.8586   -267889.1373   -222114.5245       164.8586          -5241.8528     -2703.6813    921491.4634     -5241.8528     -2703.6813

ENERGY:     201     23380.1031     18674.3332      5716.2802       191.4188        -334751.7131     21239.1340         0.0000         0.0000     43222.4695        -222327.9743       157.2315   -265550.4438   -222100.1079       157.2315          -4546.2006     -2661.1900    921491.4634     -4546.2006     -2661.1900

ENERGY:     202     23622.8117     18850.8448      5722.5980       192.1474        -334305.3006     21243.2751         0.0000         0.0000     42432.5588        -222241.0648       154.3580   -264673.6236   -222096.8292       154.3580          -3005.0519     -2588.0013    921491.4634     -3005.0519     -2588.0013

ENERGY:     203     20743.8944     19130.0389      5729.2400       192.0764        -333501.9371     21215.8253         0.0000         0.0000     44059.6987        -222431.1635       160.2771   -266490.8622   -222093.6428       160.2771          -1046.8256     -2512.4435    921491.4634     -1046.8256     -2512.4435

ENERGY:     204     17862.6122     19486.9556      5734.1463       191.2124        -332722.2198     21188.8402         0.0000         0.0000     45629.4719        -222628.9812       165.9875   -268258.4531   -222116.7004       165.9875            452.9934     -2462.2930    921491.4634       452.9934     -2462.2930

ENERGY:     205     18189.0789     19868.9414      5735.7153       189.6741        -332398.2550     21197.9185         0.0000         0.0000     44690.7149        -222526.2119       162.5725   -267216.9268   -222099.8062       162.5725            731.8536     -2447.6354    921491.4634       731.8536     -2447.6354

ENERGY:     206     20668.8900     20170.9987      5732.9811       187.6404        -332716.3435     21241.8390         0.0000         0.0000     42439.0584        -222274.9358       154.3816   -264713.9943   -222100.3399       154.3816           -230.6568     -2488.2938    921491.4634      -230.6568     -2488.2938

ENERGY:     207     21693.8031     20338.2892      5726.5434       185.3060        -333603.9793     21289.9001         0.0000         0.0000     42143.6914        -222226.4461       153.3072   -264370.1375   -222103.0934       153.3072          -1896.3479     -2585.9684    921491.4634     -1896.3479     -2585.9684

ENERGY:     208     20293.2703     20371.8906      5718.1572       182.8654        -334789.2381     21322.2409         0.0000         0.0000     44428.6270        -222472.1867       161.6191   -266900.8137   -222122.6316       161.6191          -3669.0644     -2719.7952    921491.4634     -3669.0644     -2719.7952

ENERGY:     209     19428.8172     20325.0061      5710.3389       180.5135        -335910.2418     21349.5044         0.0000         0.0000     46273.6801        -222642.3817       168.3309   -268916.0618   -222106.7902       168.3309          -5197.7276     -2836.6306    921491.4634     -5197.7276     -2836.6306

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

ENERGY:     210     21385.1737     20194.2571      5705.3139       178.4614        -336615.7774     21385.1095         0.0000         0.0000     45251.4335        -222516.0283       164.6123   -267767.4618   -222108.2018       164.6123          -6091.3666     -2896.2628    921491.4634     -6091.3666     -2896.2628

ENERGY:     211     24099.1930     19985.8633      5704.9373       176.9105        -336667.8932     21415.1476         0.0000         0.0000     43031.7286        -222254.1130       156.5376   -265285.8416   -222106.8543       156.5376          -5900.2980     -2885.1011    921491.4634     -5900.2980     -2885.1011

ENERGY:     212     23739.2710     19730.8223      5710.0295       176.0352        -336013.6229     21412.5982         0.0000         0.0000     42995.1639        -222249.7027       156.4046   -265244.8666   -222104.2319       156.4046          -4424.1003     -2820.3210    921491.4634     -4424.1003     -2820.3210

ENERGY:     213     20150.2159     19524.5249      5720.1722       175.9508        -334874.6444     21380.5551         0.0000         0.0000     45418.7806        -222504.4447       165.2210   -267923.2254   -222097.3835       165.2210          -2174.3116     -2725.0841    921491.4634     -2174.3116     -2725.0841

ENERGY:     214     17315.5528     19421.7448      5733.3059       176.6827        -333645.3935     21358.4485         0.0000         0.0000     46958.4703        -222681.1885       170.8220   -269639.6588   -222093.7407       170.8220           -143.6683     -2626.0578    921491.4634      -143.6683     -2626.0578

ENERGY:     215     18210.5054     19441.9743      5746.5772       178.1492        -332787.3320     21379.5596         0.0000         0.0000     45302.6746        -222527.8917       164.7987   -267830.5663   -222091.0447       164.7987            784.0017     -2554.0368    921491.4634       784.0017     -2554.0368

ENERGY:     216     20973.4715     19522.5061      5756.9571       180.1770        -332560.1064     21436.4835         0.0000         0.0000     42442.1788        -222248.3323       154.3930   -264690.5111   -222073.6161       154.3930            420.9901     -2541.5430    921491.4634       420.9901     -2541.5430

ENERGY:     217     21778.3866     19581.4819      5762.2416       182.5517        -333010.6761     21497.2705         0.0000         0.0000     41983.6751        -222225.0687       152.7251   -264208.7438   -222064.4469       152.7251           -882.1700     -2598.7245    921491.4634      -882.1700     -2598.7245

ENERGY:     218     20165.9158     19540.0889      5761.2415       184.9927        -333856.1151     21546.6561         0.0000         0.0000     44178.6837        -222478.5365       160.7099   -266657.2202   -222068.8160       160.7099          -2628.0655     -2703.9748    921491.4634     -2628.0655     -2703.9748

ENERGY:     219     19429.8642     19413.3930      5754.3577       187.2447        -334778.0714     21596.8808         0.0000         0.0000     45751.9298        -222644.4012       166.4329   -268396.3310   -222073.1724       166.4329          -4457.7336     -2810.5239    921491.4634     -4457.7336     -2810.5239

TIMING: 220  CPU: 104.773, 0.470445/step  Wall: 104.773, 0.470445/step, 0.0365901 hours remaining, 3223.769531 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     21580.9147     19260.1134      5743.1672       189.1021        -335473.8433     21655.3184         0.0000         0.0000     44539.5740        -222505.6536       162.0227   -267045.2275   -222092.6290       162.0227          -5898.3514     -2876.6577    921491.4634     -5898.3514     -2876.6577

ENERGY:     221     24234.7392     19146.8277      5730.1601       190.4777        -335718.7275     21699.4244         0.0000         0.0000     42467.0190        -222250.0794       154.4833   -264717.0984   -222077.7836       154.4833          -6342.7099     -2884.3552    921491.4634     -6342.7099     -2884.3552

ENERGY:     222     23735.1223     19085.7306      5717.7679       191.2893        -335388.9913     21700.3077         0.0000         0.0000     42702.0391        -222256.7344       155.3383   -264958.7735   -222075.6639       155.3383          -5368.7279     -2838.7016    921491.4634     -5368.7279     -2838.7016

ENERGY:     223     20286.4334     19110.8425      5708.3528       191.5578        -334633.3912     21665.5242         0.0000         0.0000     45168.7533        -222501.9270       164.3115   -267670.6804   -222072.2458       164.3115          -3322.8075     -2753.9475    921491.4634     -3322.8075     -2753.9475

ENERGY:     224     17721.9816     19276.3017      5703.4615       191.3517        -333831.1557     21637.4893         0.0000         0.0000     46650.8782        -222649.6917       169.7031   -269300.5699   -222098.2847       169.7031          -1151.0967     -2650.6854    921491.4634     -1151.0967     -2650.6854

ENERGY:     225     18451.5607     19639.7349      5703.5482       190.8347        -333424.4647     21647.4588         0.0000         0.0000     45301.5806        -222489.7468       164.7947   -267791.3274   -222079.9379       164.7947            226.2576     -2563.9720    921491.4634       226.2576     -2563.9720

ENERGY:     226     20569.7730     20147.6376      5707.2430       190.0457        -333606.5695     21686.9380         0.0000         0.0000     43034.1678        -222270.7643       156.5465   -265304.9322   -222078.6804       156.5465            530.9034     -2526.3323    921491.4634       530.9034     -2526.3323

ENERGY:     227     21011.1675     20670.4534      5712.3895       189.0769        -334317.7222     21728.2283         0.0000         0.0000     42721.7945        -222284.6119       155.4101   -265006.4065   -222080.2098       155.4101           -104.6489     -2553.6074    921491.4634      -104.6489     -2553.6074

ENERGY:     228     19866.2929     21035.8346      5716.6482       188.0081        -335312.4268     21761.2923         0.0000         0.0000     44242.5385        -222501.8122       160.9422   -266744.3507   -222102.7891       160.9422          -1440.0183     -2625.9673    921491.4634     -1440.0183     -2625.9673

ENERGY:     229     19874.0815     21137.5589      5718.5477       187.0043        -336264.4469     21796.8120         0.0000         0.0000     44976.5836        -222573.8589       163.6124   -267550.4425   -222086.0488       163.6124          -3234.4610     -2710.7215    921491.4634     -3234.4610     -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     21999.2458     20926.2540      5717.1889       185.9786        -336838.6566     21834.6450         0.0000         0.0000     43751.0551        -222424.2892       159.1543   -266175.3443   -222088.6907       159.1543          -4902.3782     -2766.0557    921491.4634     -4902.3782     -2766.0557

ENERGY:     231     23806.6619     20470.3274      5713.0793       184.9073        -336794.0752     21849.7233         0.0000         0.0000     42506.4015        -222262.9745       154.6266   -264769.3760   -222089.4820       154.6266          -5730.6843     -2773.7615    921491.4634     -5730.6843     -2773.7615

ENERGY:     232     22812.6530     19886.6602      5707.7133       183.7520        -336072.1016     21820.0135         0.0000         0.0000     43315.5694        -222345.7402       157.5701   -265661.3095   -222098.2754       157.5701          -5301.5937     -2731.4986    921491.4634     -5301.5937     -2731.4986

ENERGY:     233     20035.6403     19318.2043      5703.4910       182.6157        -334889.2829     21760.7376         0.0000         0.0000     45350.0988        -222538.4953       164.9712   -267888.5941   -222089.6822       164.9712          -3899.2116     -2646.7386    921491.4634     -3899.2116     -2646.7386

ENERGY:     234     18553.6064     18856.0075      5702.3325       181.3395        -333642.4869     21712.9298         0.0000         0.0000     46049.0872        -222587.1839       167.5139   -268636.2712   -222086.3330       167.5139          -2187.7191     -2534.9736    921491.4634     -2187.7191     -2534.9736

ENERGY:     235     19419.0963     18603.4160      5705.8180       179.9133        -332789.1746     21702.6095         0.0000         0.0000     44750.4957        -222427.8257       162.7900   -267178.3215   -222083.1204       162.7900           -820.1734     -2429.4348    921491.4634      -820.1734     -2429.4348

ENERGY:     236     20566.0775     18629.1000      5714.2865       178.3391        -332585.8843     21721.5011         0.0000         0.0000     43477.4013        -222299.1787       158.1588   -265776.5801   -222073.0119       158.1588           -108.6481     -2371.7044    921491.4634      -108.6481     -2371.7044

ENERGY:     237     20196.0056     18940.2030      5726.8243       176.7459        -333068.3183     21749.0156         0.0000         0.0000     43898.3780        -222381.1459       159.6902   -266279.5239   -222063.3605       159.6902           -172.1587     -2373.2012    921491.4634      -172.1587     -2373.2012

ENERGY:     238     19419.4413     19404.0883      5740.6977       175.0128        -333964.3150     21778.9043         0.0000         0.0000     44901.2437        -222544.9270       163.3384   -267446.1707   -222065.9778       163.3384           -987.6014     -2425.5310    921491.4634      -987.6014     -2425.5310

ENERGY:     239     20428.8618     19846.5438      5752.8836       173.1946        -334966.8377     21816.7508         0.0000         0.0000     44416.4634        -222532.1397       161.5749   -266948.6031   -222068.9825       161.5749          -2385.1783     -2499.0796    921491.4634     -2385.1783     -2499.0796

TIMING: 240  CPU: 114.173, 0.469996/step  Wall: 114.173, 0.469996/step, 0.0339441 hours remaining, 3223.769531 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     22861.0422     20119.9134      5760.6909       171.4213        -335766.3625     21854.4252         0.0000         0.0000     42641.4776        -222357.3919       155.1180   -264998.8695   -222074.0953       155.1180          -3844.9087     -2568.3896    921491.4634     -3844.9087     -2568.3896

ENERGY:     241     23920.0054     20195.4872      5762.7124       169.9828        -336129.3252     21865.1031         0.0000         0.0000     41957.8936        -222258.1407       152.6313   -264216.0343   -222063.9158       152.6313          -4724.4493     -2616.3453    921491.4634     -4724.4493     -2616.3453

ENERGY:     242     22110.7716     20111.8208      5758.5348       169.0441        -335904.8195     21831.0567         0.0000         0.0000     43526.8720        -222396.7195       158.3388   -265923.5915   -222063.5736       158.3388          -4623.1689     -2633.0913    921491.4634     -4623.1689     -2633.0913

ENERGY:     243     19462.3619     19969.6446      5749.3614       168.8705        -335233.7066     21770.4747         0.0000         0.0000     45537.0690        -222575.9245       165.6513   -268112.9935   -222061.6674       165.6513          -3760.4504     -2614.6992    921491.4634     -3760.4504     -2614.6992

ENERGY:     244     18822.2463     19849.3935      5737.4544       169.6534        -334482.6007     21720.5675         0.0000         0.0000     45629.1662        -222554.1193       165.9864   -268183.2855   -222078.7770       165.9864          -2667.7296     -2573.2149    921491.4634     -2667.7296     -2573.2149

ENERGY:     245     20148.2366     19811.7601      5725.7784       171.4559        -334087.5944     21701.2469         0.0000         0.0000     44168.5248        -222360.5916       160.6730   -266529.1164   -222068.6364       160.6730          -1771.6899     -2533.5454    921491.4634     -1771.6899     -2533.5454

ENERGY:     246     20878.5479     19853.7026      5716.8932       174.1558        -334213.1204     21705.0850         0.0000         0.0000     43600.4183        -222284.3177       158.6063   -265884.7360   -222067.4294       158.6063          -1173.7928     -2523.3912    921491.4634     -1173.7928     -2523.3912

ENERGY:     247     19868.5286     19979.6442      5712.7400       177.5412        -334802.1842     21719.8454         0.0000         0.0000     44912.1912        -222431.6936       163.3782   -267343.8848   -222068.1393       163.3782           -982.9999     -2552.5930    921491.4634      -982.9999     -2552.5930

ENERGY:     248     19035.4926     20164.4298      5713.8450       181.3144        -335623.1357     21746.4310         0.0000         0.0000     46185.9362        -222595.6867       168.0117   -268781.6230   -222090.3129       168.0117          -1359.1247     -2608.3066    921491.4634     -1359.1247     -2608.3066

ENERGY:     249     20484.3307     20353.6195      5719.1623       185.0800        -336433.0071     21788.9033         0.0000         0.0000     45370.8152        -222531.0962       165.0466   -267901.9114   -222082.9714       165.0466          -2308.0288     -2671.2386    921491.4634     -2308.0288     -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     23155.2058     20422.5257      5726.1009       188.5682        -336907.4414     21832.9289         0.0000         0.0000     43252.1660        -222329.9460       157.3395   -265582.1119   -222084.2881       157.3395          -3365.2097     -2722.3880    921491.4634     -3365.2097     -2722.3880

ENERGY:     251     24002.1399     20302.5996      5731.6573       191.5295        -336816.8451     21849.8673         0.0000         0.0000     42475.2393        -222263.8123       154.5132   -264739.0516   -222084.8992       154.5132          -3958.0340     -2753.0724    921491.4634     -3958.0340     -2753.0724

ENERGY:     252     21994.9041     20013.1599      5733.2541       193.8023        -336093.2675     21826.9295         0.0000         0.0000     43905.3721        -222425.8455       159.7157   -266331.2176   -222091.3304       159.7157          -3843.4681     -2758.0338    921491.4634     -3843.4681     -2758.0338

ENERGY:     253     19499.8637     19667.1121      5729.5496       195.2411        -334977.1804     21784.0536         0.0000         0.0000     45520.0192        -222581.3411       165.5893   -268101.3603   -222082.7204       165.5893          -3300.1272     -2735.8131    921491.4634     -3300.1272     -2735.8131

ENERGY:     254     19073.0880     19348.2295      5720.5008       195.9622        -333839.8794     21752.6524         0.0000         0.0000     45220.9195        -222528.5271       164.5013   -267749.4465   -222080.4685       164.5013          -2707.1335     -2696.1700    921491.4634     -2707.1335     -2696.1700

ENERGY:     255     20324.2309     19109.4101      5707.6062       196.0620        -333099.9228     21746.1515         0.0000         0.0000     43667.4212        -222349.0409       158.8501   -266016.4621   -222078.3975       158.8501          -2282.5423     -2662.7813    921491.4634     -2282.5423     -2662.7813

ENERGY:     256     20899.4408     18950.9577      5693.4518       195.6570        -332975.5969     21757.6847         0.0000         0.0000     43181.1612        -222297.2438       157.0812   -265478.4050   -222071.2739       157.0812          -2042.2408     -2664.5198    921491.4634     -2042.2408     -2664.5198

ENERGY:     257     20029.5653     18878.1872      5681.1759       194.7976        -333481.0037     21780.2419         0.0000         0.0000     44488.5468        -222428.4890       161.8371   -266917.0359   -222060.1683       161.8371          -2035.5362     -2692.1442    921491.4634     -2035.5362     -2692.1442

ENERGY:     258     19453.5868     18882.0665      5673.2911       193.6684        -334373.1544     21817.5077         0.0000         0.0000     45796.2577        -222556.7762       166.5942   -268353.0339   -222062.0608       166.5942          -2331.2329     -2737.1920    921491.4634     -2331.2329     -2737.1920

ENERGY:     259     20717.7710     18984.1028      5671.3007       192.3773        -335369.5277     21871.0066         0.0000         0.0000     45431.1555        -222501.8138       165.2661   -267932.9693   -222063.7306       165.2661          -2890.3672     -2780.4961    921491.4634     -2890.3672     -2780.4961

TIMING: 260  CPU: 123.563, 0.469497/step  Wall: 123.563, 0.469498/step, 0.0312998 hours remaining, 3224.074219 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:     260     22744.9543     19188.2461      5675.1875       191.0393        -336169.7728     21924.7893         0.0000         0.0000     44083.4306        -222362.1255       160.3634   -266445.5562   -222069.6812       160.3634          -3407.4794     -2810.9878    921491.4634     -3407.4794     -2810.9878

ENERGY:     261     23215.5573     19485.4655      5683.6413       189.7700        -336523.9799     21953.3902         0.0000         0.0000     43676.0235        -222320.1322       158.8814   -265996.1557   -222052.8235       158.8814          -3555.3695     -2822.8648    921491.4634     -3555.3695     -2822.8648

ENERGY:     262     21606.2723     19814.6778      5694.0656       188.7122        -336291.7858     21947.6074         0.0000         0.0000     44601.6346        -222438.8159       162.2485   -267040.4505   -222052.4322       162.2485          -3214.7560     -2810.4637    921491.4634     -3214.7560     -2810.4637

ENERGY:     263     19781.1227     20140.5623      5703.8103       187.9445        -335614.9711     21924.4740         0.0000         0.0000     45349.7770        -222527.2803       164.9700   -267877.0573   -222051.1546       164.9700          -2647.8114     -2773.3903    921491.4634     -2647.8114     -2773.3903

ENERGY:     264     19385.2258     20436.4307      5710.6950       187.5052        -334855.9511     21907.7772         0.0000         0.0000     44751.4783        -222476.8389       162.7936   -267228.3172   -222069.1983       162.7936          -2191.1925     -2723.5293    921491.4634     -2191.1925     -2723.5293

ENERGY:     265     19946.8413     20681.9927      5713.6241       187.4392        -334395.6632     21906.0164         0.0000         0.0000     43607.6374        -222352.1121       158.6326   -265959.7495   -222054.3372       158.6326          -2038.0572     -2683.6034    921491.4634     -2038.0572     -2683.6034

ENERGY:     266     20048.7897     20788.8702      5712.1327       187.6137        -334399.4578     21914.4805         0.0000         0.0000     43399.3797        -222348.1912       157.8750   -265747.5709   -222054.3635       157.8750          -2130.7240     -2664.5956    921491.4634     -2130.7240     -2664.5956

ENERGY:     267     19648.0905     20691.2680      5707.0583       187.8501        -334831.4857     21930.8375         0.0000         0.0000     44220.2168        -222446.1646       160.8610   -266666.3814   -222055.6585       160.8610          -2435.4235     -2662.6783    921491.4634     -2435.4235     -2662.6783

ENERGY:     268     19962.9162     20375.7516      5700.1930       187.9286        -335513.7452     21959.1258         0.0000         0.0000     44823.5376        -222504.2924       163.0557   -267327.8300   -222075.9874       163.0557          -2903.2126     -2658.6181    921491.4634     -2903.2126     -2658.6181

ENERGY:     269     21396.7814     19927.1703      5694.0390       187.7639        -336221.0664     21997.2161         0.0000         0.0000     44586.5098        -222431.5858       162.1935   -267018.0956   -222066.1973       162.1935          -3401.4130     -2647.2950    921491.4634     -3401.4130     -2647.2950

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

ENERGY:     270     22620.1934     19450.9167      5690.3173       187.1618        -336650.6776     22028.8071         0.0000         0.0000     44308.0075        -222365.2738       161.1804   -266673.2813   -222067.0434       161.1804          -3583.3635     -2617.7583    921491.4634     -3583.3635     -2617.7583

ENERGY:     271     22345.5823     19078.8065      5690.0209       186.1610        -336571.7893     22035.2502         0.0000         0.0000     44829.4472        -222406.5211       163.0772   -267235.9684   -222066.8386       163.0772          -3261.2175     -2569.2622    921491.4634     -3261.2175     -2569.2622

ENERGY:     272     21021.5584     18896.0661      5692.8269       184.9335        -335921.4613     22015.0580         0.0000         0.0000     45607.7075        -222503.3109       165.9083   -268111.0184   -222081.1571       165.9083          -2551.9683     -2501.8804    921491.4634     -2551.9683     -2501.8804

ENERGY:     273     20123.2135     18932.9080      5697.5118       183.8526        -334925.7009     21985.5296         0.0000         0.0000     45502.7160        -222499.9694       165.5264   -268002.6854   -222069.0458       165.5264          -1837.1973     -2434.6759    921491.4634     -1837.1973     -2434.6759

ENERGY:     274     20074.7414     19121.4862      5701.6806       183.0070        -333931.6254     21965.2977         0.0000         0.0000     44478.5174        -222406.8951       161.8006   -266885.4125   -222066.8027       161.8006          -1366.5210     -2384.6633    921491.4634     -1366.5210     -2384.6633

ENERGY:     275     20005.4315     19374.0680      5703.3424       182.5376        -333318.5600     21960.8300         0.0000         0.0000     43741.9682        -222350.3823       159.1213   -266092.3505   -222065.7691       159.1213          -1269.7929     -2374.8868    921491.4634     -1269.7929     -2374.8868

ENERGY:     276     19401.8500     19594.7508      5701.2547       182.4904        -333292.1279     21971.0410         0.0000         0.0000     44028.5272        -222412.2139       160.1637   -266440.7411   -222072.9394       160.1637          -1580.1299     -2417.6040    921491.4634     -1580.1299     -2417.6040

ENERGY:     277     19149.2972     19724.7160      5695.5210       182.9396        -333864.3453     21997.2387         0.0000         0.0000     44632.8112        -222481.8216       162.3619   -267114.6328   -222061.0987       162.3619          -2311.7545     -2498.0545    921491.4634     -2311.7545     -2498.0545

ENERGY:     278     20199.4578     19713.7760      5686.9122       183.6585        -334821.1004     22041.3359         0.0000         0.0000     44532.2541        -222463.7060       161.9961   -266995.9601   -222063.4130       161.9961          -3254.8158     -2593.7696    921491.4634     -3254.8158     -2593.7696

ENERGY:     279     21984.3651     19593.9431      5677.5176       184.5187        -335888.5803     22096.4199         0.0000         0.0000     43975.0881        -222376.7278       159.9693   -266351.8159   -222065.2022       159.9693          -4044.3215     -2682.8389    921491.4634     -4044.3215     -2682.8389

TIMING: 280  CPU: 132.947, 0.469217/step  Wall: 132.947, 0.469217/step, 0.0286744 hours remaining, 3224.074219 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:     280     22859.3231     19458.4367      5670.0026       185.3899        -336752.6636     22145.1354         0.0000         0.0000     44066.7340        -222367.6419       160.3027   -266434.3759   -222073.4247       160.3027          -4286.3895     -2748.0546    921491.4634     -4286.3895     -2748.0546

ENERGY:     281     22172.5960     19445.1184      5667.0588       186.2206        -337154.6806     22172.1192         0.0000         0.0000     45063.2424        -222448.3253       163.9277   -267511.5677   -222064.8518       163.9277          -3881.2952     -2782.5902    921491.4634     -3881.2952     -2782.5902

ENERGY:     282     20943.7898     19615.5381      5669.9796       186.8360        -336942.5037     22176.7654         0.0000         0.0000     45823.3371        -222526.2577       166.6927   -268349.5948   -222063.3316       166.6927          -2992.3271     -2779.3668    921491.4634     -2992.3271     -2779.3668

ENERGY:     283     20432.1060     19966.6617      5678.8137       187.1634        -336251.9203     22171.0648         0.0000         0.0000     45328.8521        -222487.2587       164.8939   -267816.1107   -222060.8459       164.8939          -2008.7735     -2748.2306    921491.4634     -2008.7735     -2748.2306

ENERGY:     284     20506.3996     20401.8824      5692.0830       187.1346        -335412.6302     22166.2909         0.0000         0.0000     44071.4481        -222387.3915       160.3198   -266458.8396   -222061.5540       160.3198          -1267.2789     -2712.3902    921491.4634     -1267.2789     -2712.3902

ENERGY:     285     20203.3284     20789.9631      5707.3564       186.7145        -334827.1968     22167.0166         0.0000         0.0000     43418.2632        -222354.5545       157.9437   -265772.8177   -222053.5967       157.9437          -1010.8436     -2700.0820    921491.4634     -1010.8436     -2700.0820

ENERGY:     286     19396.6308     20966.5624      5721.5031       185.8230        -334658.1151     22176.6863         0.0000         0.0000     43785.6883        -222425.2213       159.2803   -266210.9095   -222054.0583       159.2803          -1306.7501     -2717.2847    921491.4634     -1306.7501     -2717.2847

ENERGY:     287     19176.1190     20856.7824      5731.9346       184.4714        -334918.1483     22200.2910         0.0000         0.0000     44282.9438        -222485.6059       161.0892   -266768.5497   -222055.7254       161.0892          -2148.9613     -2753.3344    921491.4634     -2148.9613     -2753.3344

ENERGY:     288     20263.2089     20475.2852      5736.9557       182.7335        -335468.3150     22237.9037         0.0000         0.0000     44116.9905        -222455.2374       160.4855   -266572.2279   -222066.9052       160.4855          -3310.5880     -2790.1553    921491.4634     -3310.5880     -2790.1553

ENERGY:     289     21886.4836     19928.6979      5736.1905       180.7560        -336126.9124     22279.0690         0.0000         0.0000     43733.4513        -222382.2640       159.0903   -266115.7154   -222062.2723       159.0903          -4368.9816     -2809.8749    921491.4634     -4368.9816     -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     22615.9845     19325.5266      5730.3279       178.6973        -336571.4575     22308.2175         0.0000         0.0000     44027.4236        -222385.2801       160.1597   -266412.7037   -222063.4682       160.1597          -4815.3288     -2796.0390    921491.4634     -4815.3288     -2796.0390

ENERGY:     291     22115.7703     18802.2908      5721.4122       176.7646        -336554.3557     22315.5630         0.0000         0.0000     44963.0866        -222459.4682       163.5634   -267422.5548   -222063.1773       163.5634          -4450.6674     -2738.1108    921491.4634     -4450.6674     -2738.1108

ENERGY:     292     21262.5910     18472.4015      5712.2431       175.1751        -335987.2697     22302.8784         0.0000         0.0000     45560.3454        -222501.6353       165.7360   -268061.9807   -222072.5160       165.7360          -3435.4155     -2639.3512    921491.4634     -3435.4155     -2639.3512

ENERGY:     293     20783.4660     18411.7341      5705.7252       174.1484        -335092.9702     22279.1181         0.0000         0.0000     45283.4160        -222455.3623       164.7286   -267738.7784   -222061.5453       164.7286          -2166.7335     -2517.2544    921491.4634     -2166.7335     -2517.2544

ENERGY:     294     20398.6126     18589.6435      5703.5791       173.8101        -334179.1782     22254.0799         0.0000         0.0000     44662.2338        -222397.2191       162.4689   -267059.4529   -222058.8849       162.4689          -1006.6040     -2405.5592    921491.4634     -1006.6040     -2405.5592

ENERGY:     295     19706.6740     18924.3582      5706.2255       174.2141        -333602.5011     22236.6568         0.0000         0.0000     44449.5912        -222404.7812       161.6954   -266854.3725   -222057.5859       161.6954           -311.5564     -2335.1538    921491.4634      -311.5564     -2335.1538

ENERGY:     296     19122.8990     19301.4532      5712.5929       175.3096        -333576.4724     22236.1189         0.0000         0.0000     44573.6029        -222454.4958       162.1465   -267028.0988   -222067.3938       162.1465           -347.2082     -2322.9740    921491.4634      -347.2082     -2322.9740

ENERGY:     297     19439.7490     19641.8018      5720.7182       176.9777        -334148.9753     22258.2524         0.0000         0.0000     44466.2678        -222445.2085       161.7561   -266911.4763   -222050.8186       161.7561          -1189.5387     -2359.0875    921491.4634     -1189.5387     -2359.0875

ENERGY:     298     20578.5048     19886.6666      5727.8935       178.9488        -335137.5240     22299.1410         0.0000         0.0000     44067.5344        -222398.8350       160.3056   -266466.3693   -222053.6274       160.3056          -2519.0814     -2427.9309    921491.4634     -2519.0814     -2427.9309

ENERGY:     299     21598.9658     20050.9662      5731.9440       180.9390        -336266.8206     22346.0657         0.0000         0.0000     43977.6322        -222380.3077       159.9785   -266357.9399   -222056.3727       159.9785          -3820.1266     -2506.2687    921491.4634     -3820.1266     -2506.2687

LDB: ============= START OF LOAD BALANCING ============== 148.225
LDB: Largest compute 200 load 0.521136 is 1.1% of average load 45.643134
LDB: Average compute 0.063927 is 0.1% of average load 45.643134
LDB: TIME 148.227 LOAD: AVG 45.6431 MAX 46.9808  PROXIES: TOTAL 112 MAXPE 28 MAXPATCH 1 None MEM: 3224.27 MB
LDB: TIME 148.228 LOAD: AVG 45.6431 MAX 46.9808  PROXIES: TOTAL 112 MAXPE 28 MAXPATCH 1 RefineTorusLB MEM: 3224.27 MB
LDB: TIME 148.244 LOAD: AVG 45.6431 MAX 46.1558  PROXIES: TOTAL 113 MAXPE 29 MAXPATCH 1 RefineTorusLB MEM: 3224.27 MB
LDB: ============== END OF LOAD BALANCING =============== 148.245
Info: useSync: 1 useProxySync: 0
LDB: =============== DONE WITH MIGRATION ================ 148.246
Info: Initial time: 4 CPUs 0.469462 s/step 5.43359 days/ns 3224.27 MB memory
TIMING: 300  CPU: 142.331, 0.469228/step  Wall: 142.331, 0.469228/step, 0.0260682 hours remaining, 3224.273438 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     21869.9884     20174.1891      5731.6695       182.6816        -337209.9033     22385.4779         0.0000         0.0000     44423.7997        -222442.0971       161.6016   -266865.8968   -222076.5867       161.6016          -4600.9411     -2563.6019    921491.4634     -4600.9411     -2563.6019

ENERGY:     301     21754.7699     20299.7854      5727.3852       184.0330        -337665.1002     22409.6626         0.0000         0.0000     44817.7467        -222471.7173       163.0346   -267289.4640   -222059.2467       163.0346          -4657.8465     -2584.2293    921491.4634     -4657.8465     -2584.2293

ENERGY:     302     21723.0647     20395.7909      5720.2599       184.8676        -337483.0152     22416.9291         0.0000         0.0000     44599.2671        -222442.8359       162.2399   -267042.1029   -222057.3398       162.2399          -3958.8649     -2554.2736    921491.4634     -3958.8649     -2554.2736

ENERGY:     303     21512.5327     20430.0802      5712.5286       185.2198        -336784.9548     22409.2048         0.0000         0.0000     44154.6911        -222380.6977       160.6226   -266535.3888   -222054.2086       160.6226          -2717.2717     -2487.9822    921491.4634     -2717.2717     -2487.9822

ENERGY:     304     20579.5054     20379.6045      5706.6112       185.2163        -335895.7343     22392.3086         0.0000         0.0000     44259.5533        -222392.9350       161.0041   -266652.4883   -222063.7237       161.0041          -1310.8208     -2411.5371    921491.4634     -1310.8208     -2411.5371

ENERGY:     305     19294.2486     20267.1926      5704.5649       185.0761        -335184.3674     22377.9875         0.0000         0.0000     44903.5552        -222451.7426       163.3468   -267355.2978   -222049.0629       163.3468           -285.4663     -2359.8439    921491.4634      -285.4663     -2359.8439

ENERGY:     306     18813.6232     20091.4461      5706.8791       184.8700        -334861.4712     22380.1169         0.0000         0.0000     45195.6070        -222488.9288       164.4092   -267684.5358   -222048.9453       164.4092            -34.4474     -2342.9901    921491.4634       -34.4474     -2342.9901

ENERGY:     307     19699.8291     19880.2870      5712.8835       184.6555        -334994.2779     22404.6078         0.0000         0.0000     44676.1363        -222435.8788       162.5195   -267112.0151   -222050.4563       162.5195           -686.7125     -2362.0196    921491.4634      -686.7125     -2362.0196

ENERGY:     308     21066.5789     19666.1167      5720.7564       184.4262        -335495.7176     22443.3089         0.0000         0.0000     44039.4394        -222375.0910       160.2034   -266414.5304   -222060.2281       160.2034          -1960.6043     -2406.6006    921491.4634     -1960.6043     -2406.6006

ENERGY:     309     21696.0236     19507.1878      5728.2464       184.2113        -336171.4695     22480.8019         0.0000         0.0000     44190.3408        -222384.6577       160.7523   -266574.9985   -222050.0294       160.7523          -3383.0057     -2467.8899    921491.4634     -3383.0057     -2467.8899

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

ENERGY:     310     21508.7276     19421.0237      5732.7586       183.9063        -336693.8608     22505.8455         0.0000         0.0000     44871.0067        -222470.5923       163.2284   -267341.5990   -222052.4938       163.2284          -4424.6316     -2515.2223    921491.4634     -4424.6316     -2515.2223

ENERGY:     311     21459.6724     19421.2605      5732.5580       183.4896        -336798.7863     22515.0558         0.0000         0.0000     44986.9608        -222499.7892       163.6502   -267486.7499   -222053.3068       163.6502          -4795.7696     -2523.0993    921491.4634     -4795.7696     -2523.0993

ENERGY:     312     21894.2737     19475.0866      5727.0397       182.9545        -336390.8674     22507.7147         0.0000         0.0000     44171.5549        -222432.2431       160.6840   -266603.7980   -222064.5093       160.6840          -4390.5735     -2479.7747    921491.4634     -4390.5735     -2479.7747

ENERGY:     313     21935.6982     19529.7469      5717.1322       182.3602        -335633.4771     22483.0128         0.0000         0.0000     43439.9890        -222345.5377       158.0227   -265785.5267   -222050.9854       158.0227          -3324.4413     -2406.1160    921491.4634     -3324.4413     -2406.1160

ENERGY:     314     20774.0370     19507.1855      5704.6248       181.6523        -334801.1001     22445.5162         0.0000         0.0000     43813.5137        -222374.5705       159.3815   -266188.0843   -222048.2691       159.3815          -1862.2381     -2326.9766    921491.4634     -1862.2381     -2326.9766

ENERGY:     315     19161.1202     19408.2595      5692.2116       180.8666        -334233.4699     22410.8356         0.0000         0.0000     44907.4429        -222472.7336       163.3609   -267380.1764   -222046.1397       163.3609           -549.3940     -2270.2360    921491.4634      -549.3940     -2270.2360

ENERGY:     316     18669.4292     19303.6208      5682.5270       180.0732        -334172.3642     22398.3987         0.0000         0.0000     45428.4348        -222509.8804       165.2562   -267938.3152   -222062.0709       165.2562             64.5862     -2251.8059    921491.4634        64.5862     -2251.8059

ENERGY:     317     19739.5967     19309.4454      5677.5265       179.4130        -334705.9337     22416.0667         0.0000         0.0000     44959.2154        -222424.6701       163.5493   -267383.8854   -222046.6268       163.5493           -296.1489     -2282.4174    921491.4634      -296.1489     -2282.4174

ENERGY:     318     21109.3876     19471.3045      5677.4840       178.9393        -335675.6977     22454.1807         0.0000         0.0000     44425.4199        -222358.9816       161.6075   -266784.4015   -222048.7804       161.6075          -1378.4202     -2356.1402    921491.4634     -1378.4202     -2356.1402

ENERGY:     319     21567.4386     19787.0345      5681.4413       178.7485        -336801.6069     22496.5472         0.0000         0.0000     44691.1808        -222399.2161       162.5742   -267090.3969   -222051.9249       162.5742          -2725.8800     -2457.2026    921491.4634     -2725.8800     -2457.2026

TIMING: 320  CPU: 151.545, 0.460685/step  Wall: 151.545, 0.460685/step, 0.0230342 hours remaining, 3224.273438 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     21393.3837     20196.2692      5687.3971       178.9168        -337738.1161     22532.5473         0.0000         0.0000     45250.4877        -222499.1144       164.6088   -267749.6020   -222076.2070       164.6088          -3895.6024     -2553.5002    921491.4634     -3895.6024     -2553.5002

ENERGY:     321     21615.1674     20628.0219      5693.0806       179.5146        -338181.7104     22557.3343         0.0000         0.0000     45018.7806        -222489.8109       163.7660   -267508.5915   -222064.2787       163.7660          -4609.2360     -2621.5363    921491.4634     -4609.2360     -2621.5363

ENERGY:     322     22179.0068     20957.0458      5696.1855       180.4970        -337965.9628     22565.0701         0.0000         0.0000     43989.5240        -222398.6336       160.0218   -266388.1577   -222063.6576       160.0218          -4596.8829     -2640.5013    921491.4634     -4596.8829     -2640.5013

ENERGY:     323     21976.7003     21085.8080      5695.4506       181.8003        -337194.0742     22550.8101         0.0000         0.0000     43361.4904        -222342.0145       157.7372   -265703.5049   -222061.4464       157.7372          -3808.3604     -2616.6944    921491.4634     -3808.3604     -2616.6944

ENERGY:     324     20558.5066     20952.0214      5690.8582       183.3007        -336170.3971     22520.5739         0.0000         0.0000     43857.2501        -222407.8862       159.5406   -266265.1364   -222068.7481       159.5406          -2506.6898     -2573.6931    921491.4634     -2506.6898     -2573.6931

ENERGY:     325     19096.1751     20584.7377      5683.7433       184.8441        -335297.0509     22494.0542         0.0000         0.0000     44763.3955        -222490.1010       162.8369   -267253.4964   -222060.9512       162.8369          -1264.0244     -2529.6546    921491.4634     -1264.0244     -2529.6546

ENERGY:     326     18959.6361     20052.8004      5675.9627       186.2078        -334820.0101     22490.4167         0.0000         0.0000     44971.8223        -222483.1641       163.5951   -267454.9864   -222059.6108       163.5951           -572.2142     -2503.0558    921491.4634      -572.2142     -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           -657.4992     -2506.5014    921491.4634      -657.4992     -2506.5014

ENERGY:     328     20934.1980     19092.0091      5666.7484       187.7399        -335303.4708     22549.7451         0.0000         0.0000     44493.2356        -222379.7947       161.8542   -266873.0303   -222061.7258       161.8542          -1393.2039     -2547.3518    921491.4634     -1393.2039     -2547.3518

ENERGY:     329     21066.6666     18910.0875      5668.0553       187.7546        -335996.4125     22586.9564         0.0000         0.0000     45124.3166        -222452.5754       164.1499   -267576.8920   -222059.3365       164.1499          -2499.2291     -2610.9951    921491.4634     -2499.2291     -2610.9951

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

ENERGY:     330     21142.6835     18933.5041      5673.1988       187.2569        -336566.3115     22617.7578         0.0000         0.0000     45495.0147        -222516.8956       165.4984   -268011.9103   -222062.1149       165.4984          -3602.9590     -2673.3212    921491.4634     -3602.9590     -2673.3212

ENERGY:     331     21864.6856     19091.0590      5680.9136       186.3262        -336735.1748     22637.2714         0.0000         0.0000     44806.2164        -222468.7028       162.9927   -267274.9192   -222063.3971       162.9927          -4373.7648     -2707.8811    921491.4634     -4373.7648     -2707.8811

ENERGY:     332     22513.8606     19292.8539      5689.3391       185.0893        -336383.5017     22636.4043         0.0000         0.0000     43697.6287        -222368.3259       158.9600   -266065.9546   -222061.8458       158.9600          -4514.5070     -2704.7030    921491.4634     -4514.5070     -2704.7030

ENERGY:     333     21854.9974     19482.7896      5696.6505       183.7309        -335681.4578     22608.9729         0.0000         0.0000     43501.2420        -222353.0746       158.2456   -265854.3165   -222052.0750       158.2456          -3943.3085     -2666.2161    921491.4634     -3943.3085     -2666.2161

ENERGY:     334     20023.4848     19603.2614      5701.0454       182.3864        -334880.5297     22564.8641         0.0000         0.0000     44357.3053        -222448.1823       161.3597   -266805.4876   -222049.6958       161.3597          -2855.3037     -2607.1876    921491.4634     -2855.3037     -2607.1876

ENERGY:     335     18726.9582     19647.0449      5701.6423       181.1975        -334325.9452     22528.7344         0.0000         0.0000     45026.6266        -222513.7412       163.7945   -267540.3677   -222047.5429       163.7945          -1753.1267     -2542.6964    921491.4634     -1753.1267     -2542.6964

ENERGY:     336     19127.9134     19639.0995      5698.6022       180.2744        -334271.7855     22519.6997         0.0000         0.0000     44649.6649        -222456.5314       162.4232   -267106.1963   -222055.6200       162.4232          -1093.5005     -2488.8702    921491.4634     -1093.5005     -2488.8702

ENERGY:     337     20420.1634     19649.7064      5693.3319       179.7347        -334824.3559     22536.4222         0.0000         0.0000     43995.5998        -222349.3975       160.0439   -266344.9973   -222040.1024       160.0439          -1064.7184     -2460.5860    921491.4634     -1064.7184     -2460.5860

ENERGY:     338     21007.5747     19722.4644      5687.5590       179.5437        -335808.8622     22564.1944         0.0000         0.0000     44285.9173        -222361.6087       161.1000   -266647.5260   -222041.5957       161.1000          -1500.9500     -2462.8576    921491.4634     -1500.9500     -2462.8576

ENERGY:     339     20742.6011     19892.4866      5683.2969       179.6501        -336924.5162     22593.0217         0.0000         0.0000     45359.3480        -222474.1118       165.0048   -267833.4598   -222043.8628       165.0048          -2199.9377     -2485.1215    921491.4634     -2199.9377     -2485.1215

TIMING: 340  CPU: 160.752, 0.460333/step  Wall: 160.752, 0.460333/step, 0.0204592 hours remaining, 3224.273438 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     20898.6068     20139.5373      5681.9995       179.9655        -337821.3683     22621.7135         0.0000         0.0000     45758.5730        -222540.9725       166.4571   -268299.5455   -222070.3953       166.4571          -2966.9710     -2503.9485    921491.4634     -2966.9710     -2503.9485

ENERGY:     341     22051.8627     20407.8963      5684.3134       180.4786        -338209.1666     22646.3198         0.0000         0.0000     44797.5820        -222440.7137       162.9613   -267238.2958   -222054.5347       162.9613          -3585.3814     -2498.5443    921491.4634     -3585.3814     -2498.5443

ENERGY:     342     22895.9214     20582.1011      5689.2420       181.0293        -337942.4473     22653.2570         0.0000         0.0000     43612.4990        -222328.3975       158.6503   -265940.8965   -222054.3602       158.6503          -3711.7547     -2460.9856    921491.4634     -3711.7547     -2460.9856

ENERGY:     343     21993.5595     20596.8906      5695.1198       181.5548        -337132.3416     22633.1272         0.0000         0.0000     43686.5575        -222345.5322       158.9197   -266032.0897   -222053.2448       158.9197          -3217.8263     -2399.3476    921491.4634     -3217.8263     -2399.3476

ENERGY:     344     19898.5078     20447.2067      5699.9573       182.0106        -336095.2672     22596.5927         0.0000         0.0000     44790.9364        -222480.0557       162.9371   -267270.9920   -222071.3575       162.9371          -2338.1158     -2329.7492    921491.4634     -2338.1158     -2329.7492

ENERGY:     345     18694.7358     20199.0882      5702.3270       182.4513        -335224.1271     22568.7535         0.0000         0.0000     45351.4660        -222525.3053       164.9762   -267876.7712   -222058.0552       164.9762          -1576.2389     -2261.7960    921491.4634     -1576.2389     -2261.7960

ENERGY:     346     19350.9890     19892.9542      5701.0894       182.7368        -334783.0718     22565.1336         0.0000         0.0000     44652.5018        -222437.6670       162.4335   -267090.1688   -222056.8253       162.4335          -1239.3022     -2211.7781    921491.4634     -1239.3022     -2211.7781

ENERGY:     347     20669.8296     19583.9409      5696.3950       182.8447        -334881.4382     22581.1981         0.0000         0.0000     43831.1328        -222336.0973       159.4456   -266167.2300   -222056.9471       159.4456          -1358.8146     -2194.9212    921491.4634     -1358.8146     -2194.9212

ENERGY:     348     21062.2473     19315.9902      5689.3479       182.7918        -335425.6670     22604.2199         0.0000         0.0000     44195.9877        -222375.0822       160.7729   -266571.0699   -222064.0950       160.7729          -1766.2768     -2218.9158    921491.4634     -1766.2768     -2218.9158

ENERGY:     349     20718.9516     19143.3229      5681.9008       182.6959        -336197.3784     22630.4373         0.0000         0.0000     45349.6297        -222490.4402       164.9695   -267840.0699   -222056.3111       164.9695          -2336.6409     -2270.6250    921491.4634     -2336.6409     -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     21009.3452     19066.8674      5675.7227       182.5405        -336836.8357     22661.9753         0.0000         0.0000     45710.0738        -222530.3108       166.2807   -268240.3846   -222058.0878       166.2807          -2896.5511     -2326.8868    921491.4634     -2896.5511     -2326.8868

ENERGY:     351     22235.3180     19085.8713      5672.3994       182.3762        -337072.3448     22693.2955         0.0000         0.0000     44770.4138        -222432.6706       162.8625   -267203.0844   -222058.6357       162.8625          -3254.0187     -2369.0508    921491.4634     -3254.0187     -2369.0508

ENERGY:     352     22912.9249     19180.1281      5672.7330       182.2243        -336794.7855     22708.6918         0.0000         0.0000     43795.3994        -222342.6840       159.3156   -266138.0834   -222059.3896       159.3156          -3190.0136     -2394.0290    921491.4634     -3190.0136     -2394.0290

ENERGY:     353     21825.9774     19344.0937      5676.6445       182.1014        -336147.6548     22699.4230         0.0000         0.0000     44043.1858        -222376.2290       160.2170   -266419.4148   -222047.6761       160.2170          -2709.1540     -2407.4663    921491.4634     -2709.1540     -2407.4663

ENERGY:     354     19814.0380     19544.5092      5682.7361       181.9868        -335375.1822     22676.8664         0.0000         0.0000     44983.0759        -222491.9698       163.6361   -267475.0457   -222046.2241       163.6361          -2040.9897     -2415.4741    921491.4634     -2040.9897     -2415.4741

ENERGY:     355     18879.8417     19773.7509      5689.2466       181.9196        -334823.9956     22664.4418         0.0000         0.0000     45120.2680        -222514.5269       164.1351   -267634.7950   -222044.8381       164.1351          -1600.3168     -2424.6827    921491.4634     -1600.3168     -2424.6827

ENERGY:     356     19622.4372     20015.8110      5694.4280       181.9402        -334758.7692     22674.4076         0.0000         0.0000     44153.0887        -222416.6564       160.6168   -266569.7451   -222053.0960       160.6168          -1622.0263     -2446.8266    921491.4634     -1622.0263     -2446.8266

ENERGY:     357     20687.2713     20255.1056      5697.1708       182.0215        -335288.0647     22700.2945         0.0000         0.0000     43438.0180        -222328.1829       158.0156   -265766.2009   -222042.2329       158.0156          -2061.3608     -2486.6663    921491.4634     -2061.3608     -2486.6663

ENERGY:     358     20785.4067     20424.8430      5696.9833       182.1295        -336225.9480     22730.2415         0.0000         0.0000     44019.5825        -222386.7614       160.1311   -266406.3440   -222043.9944       160.1311          -2636.8583     -2541.3594    921491.4634     -2636.8583     -2541.3594

ENERGY:     359     20493.6442     20484.4986      5694.4425       182.1894        -337270.5930     22762.0664         0.0000         0.0000     45152.8981        -222500.8538       164.2538   -267653.7520   -222046.1000       164.2538          -3161.2179     -2593.4282    921491.4634     -3161.2179     -2593.4282

TIMING: 360  CPU: 169.949, 0.459877/step  Wall: 169.949, 0.459877/step, 0.0178841 hours remaining, 3224.273438 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     21112.5813     20418.0335      5690.9152       182.1442        -338077.5509     22797.1674         0.0000         0.0000     45362.4570        -222514.2523       165.0162   -267876.7094   -222065.3876       165.0162          -3505.9504     -2622.8572    921491.4634     -3505.9504     -2622.8572

ENERGY:     361     22462.8275     20259.6928      5688.3192       181.9496        -338397.1526     22827.2217         0.0000         0.0000     44580.8521        -222396.2897       162.1729   -266977.1418   -222052.4540       162.1729          -3542.5443     -2618.5019    921491.4634     -3542.5443     -2618.5019

ENERGY:     362     22808.6002     20031.2792      5688.3204       181.6679        -338079.7612     22835.7523         0.0000         0.0000     44200.9552        -222333.1861       160.7909   -266534.1413   -222051.2757       160.7909          -3087.0696     -2583.1906    921491.4634     -3087.0696     -2583.1906

ENERGY:     363     21303.6020     19794.1190      5692.1162       181.3427        -337235.0089     22818.0649         0.0000         0.0000     45033.6627        -222412.1014       163.8201   -267445.7642   -222049.5300       163.8201          -2242.6818     -2529.7064    921491.4634     -2242.6818     -2529.7064

ENERGY:     364     19323.8974     19612.6015      5699.8913       181.0103        -336175.1997     22790.5190         0.0000         0.0000     46034.3489        -222532.9312       167.4603   -268567.2801   -222068.5917       167.4603          -1420.0425     -2476.3758    921491.4634     -1420.0425     -2476.3758

ENERGY:     365     18830.5839     19548.3421      5710.7559       180.6857        -335316.0967     22775.7828         0.0000         0.0000     45760.0888        -222509.8576       166.4626   -268269.9464   -222057.4401       166.4626          -1100.2606     -2433.4824    921491.4634     -1100.2606     -2433.4824

ENERGY:     366     19854.2639     19578.5648      5722.5903       180.3919        -334923.1927     22780.3500         0.0000         0.0000     44422.2472        -222384.7847       161.5959   -266807.0319   -222057.2776       161.5959          -1392.6926     -2417.6864    921491.4634     -1392.6926     -2417.6864

ENERGY:     367     20741.0597     19662.8834      5732.9484       180.1165        -335098.3157     22794.3492         0.0000         0.0000     43662.6185        -222324.3399       158.8326   -265986.9585   -222058.3712       158.8326          -2104.1275     -2437.9269    921491.4634     -2104.1275     -2437.9269

ENERGY:     368     20561.5938     19748.2119      5739.6691       179.8275        -335728.0873     22808.6650         0.0000         0.0000     44272.8408        -222417.2791       161.0524   -266690.1199   -222068.2910       161.0524          -2928.4886     -2487.3070    921491.4634     -2928.4886     -2487.3070

ENERGY:     369     20346.9679     19812.6205      5741.6370       179.5048        -336580.3307     22825.3357         0.0000         0.0000     45155.6310        -222518.6338       164.2638   -267674.2648   -222061.0999       164.2638          -3666.9891     -2542.4573    921491.4634     -3666.9891     -2542.4573

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

ENERGY:     370     21302.3707     19815.7283      5738.6028       179.1429        -337296.0553     22846.3048         0.0000         0.0000     44920.4945        -222493.4114       163.4084   -267413.9058   -222062.2623       163.4084          -4081.4436     -2576.8189    921491.4634     -4081.4436     -2576.8189

ENERGY:     371     22799.2773     19758.4808      5731.5881       178.8004        -337606.4368     22861.3509         0.0000         0.0000     43904.8962        -222372.0431       159.7139   -266276.9393   -222061.9336       159.7139          -3956.1480     -2578.2817    921491.4634     -3956.1480     -2578.2817

ENERGY:     372     22964.3598     19665.2851      5722.4284       178.5955        -337391.7866     22854.0835         0.0000         0.0000     43672.6556        -222334.3788       158.8691   -266007.0343   -222060.3191       158.8691          -3189.3380     -2552.6171    921491.4634     -3189.3380     -2552.6171

ENERGY:     373     21253.1597     19603.3418      5713.4759       178.7080        -336784.3109     22822.4879         0.0000         0.0000     44782.9952        -222430.1424       162.9082   -267213.1375   -222050.3109       162.9082          -2037.0647     -2511.6655    921491.4634     -2037.0647     -2511.6655

ENERGY:     374     19285.9365     19613.0721      5706.5680       179.1985        -336019.1229     22785.5046         0.0000         0.0000     45912.3281        -222536.5151       167.0164   -268448.8431   -222048.2685       167.0164           -983.4303     -2469.0309    921491.4634      -983.4303     -2469.0309

ENERGY:     375     18893.7028     19735.2395      5703.0316       180.0533        -335443.7681     22766.6831         0.0000         0.0000     45660.9721        -222504.0856       166.1021   -268165.0577   -222047.0939       166.1021           -539.4858     -2439.8660    921491.4634      -539.4858     -2439.8660

ENERGY:     376     19884.0274     19962.1764      5703.2010       181.1433        -335321.8631     22772.8699         0.0000         0.0000     44434.3276        -222384.1175       161.6399   -266818.4451   -222050.5528       161.6399           -874.6221     -2439.6903    921491.4634      -874.6221     -2439.6903

ENERGY:     377     20646.4609     20251.1594      5706.5522       182.3248        -335763.5802     22794.3772         0.0000         0.0000     43848.2755        -222334.4302       159.5080   -266182.7057   -222041.4012       159.5080          -1819.5857     -2472.4986    921491.4634     -1819.5857     -2472.4986

ENERGY:     378     20473.8100     20495.6595      5711.4639       183.2952        -336584.2280     22821.5835         0.0000         0.0000     44474.7538        -222423.6620       161.7869   -266898.4158   -222044.3967       161.7869          -2972.9874     -2523.3499    921491.4634     -2972.9874     -2523.3499

ENERGY:     379     20419.4577     20623.8793      5716.2160       183.8420        -337495.6098     22854.5151         0.0000         0.0000     45185.6415        -222512.0581       164.3729   -267697.6997   -222047.0128       164.3729          -3997.4173     -2563.3073    921491.4634     -3997.4173     -2563.3073

TIMING: 380  CPU: 179.142, 0.459623/step  Wall: 179.142, 0.459623/step, 0.0153208 hours remaining, 3224.273438 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     21458.1132     20605.4122      5719.3306       183.8284        -338176.3457     22892.6528         0.0000         0.0000     44833.7902        -222483.2183       163.0930   -267317.0085   -222063.6481       163.0930          -4580.2705     -2564.2103    921491.4634     -4580.2705     -2564.2103

ENERGY:     381     22824.3128     20467.0313      5720.1164       183.2929        -338395.2416     22923.6568         0.0000         0.0000     43906.3005        -222370.5310       159.7191   -266276.8315   -222053.0348       159.7191          -4470.7199     -2514.6123    921491.4634     -4470.7199     -2514.6123

ENERGY:     382     22844.1904     20220.4988      5718.3197       182.2157        -338010.6537     22930.5471         0.0000         0.0000     43766.5299        -222348.3521       159.2106   -266114.8820   -222051.0365       159.2106          -3524.7151     -2418.5490    921491.4634     -3524.7151     -2418.5490

ENERGY:     383     21263.6992     19910.9248      5714.6670       180.7420        -337128.0230     22911.2843         0.0000         0.0000     44707.9445        -222438.7613       162.6352   -267146.7058   -222048.1882       162.6352          -2023.0804     -2294.0134    921491.4634     -2023.0804     -2294.0134

ENERGY:     384     19625.4113     19596.0354      5710.5349       179.0647        -336052.0487     22884.2532         0.0000         0.0000     45539.1834        -222517.5658       165.6590   -268056.7492   -222062.0926       165.6590           -569.2379     -2166.9358    921491.4634      -569.2379     -2166.9358

ENERGY:     385     19327.8181     19356.8912      5707.7751       177.4354        -335210.6402     22871.6142         0.0000         0.0000     45299.7172        -222469.3889       164.7879   -267769.1061   -222051.0993       164.7879            215.3515     -2064.3637    921491.4634       215.3515     -2064.3637

ENERGY:     386     19981.2274     19220.9464      5707.6638       175.9384        -334865.1818     22880.7956         0.0000         0.0000     44519.8587        -222378.7516       161.9510   -266898.6103   -222051.0437       161.9510            122.6669     -2011.2429    921491.4634       122.6669     -2011.2429

ENERGY:     387     20367.2861     19202.4844      5710.9354       174.6759        -335109.8727     22905.2742         0.0000         0.0000     44377.1817        -222372.0349       161.4320   -266749.2167   -222053.0050       161.4320           -738.9586     -2019.1690    921491.4634      -738.9586     -2019.1690

ENERGY:     388     20282.3988     19280.0167      5717.2934       173.7038        -335824.1520     22938.2898         0.0000         0.0000     44972.7763        -222459.6732       163.5986   -267432.4494   -222067.4818       163.5986          -2063.8556     -2076.2822    921491.4634     -2063.8556     -2076.2822

ENERGY:     389     20685.9715     19431.2565      5725.6291       173.0778        -336772.2805     22978.5917         0.0000         0.0000     45279.3794        -222498.3746       164.7139   -267777.7540   -222059.2966       164.7139          -3501.7342     -2158.1993    921491.4634     -3501.7342     -2158.1993

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

ENERGY:     390     21929.5054     19598.7449      5733.9032       172.7580        -337596.2514     23021.3360         0.0000         0.0000     44698.9836        -222441.0203       162.6026   -267140.0039   -222061.4796       162.6026          -4540.4926     -2229.7775    921491.4634     -4540.4926     -2229.7775

ENERGY:     391     22937.3145     19764.3497      5740.3107       172.7562        -338017.7278     23051.7298         0.0000         0.0000     43987.0070        -222364.2598       160.0126   -266351.2669   -222061.6922       160.0126          -4746.5208     -2270.9349    921491.4634     -4746.5208     -2270.9349

ENERGY:     392     22488.0359     19924.0530      5743.6080       173.0775        -337898.4685     23055.0071         0.0000         0.0000     44125.3367        -222389.3503       160.5158   -266514.6870   -222067.3166       160.5158          -3965.0288     -2276.9603    921491.4634     -3965.0288     -2276.9603

ENERGY:     393     20924.3594     20087.8869      5743.5041       173.6901        -337346.1125     23032.5724         0.0000         0.0000     44913.3819        -222470.7176       163.3825   -267384.0995   -222058.1708       163.3825          -2525.7427     -2257.0110    921491.4634     -2525.7427     -2257.0110

ENERGY:     394     19713.0844     20210.4904      5740.1181       174.4904        -336587.4364     23002.1141         0.0000         0.0000     45247.1172        -222500.0217       164.5966   -267747.1389   -222054.8626       164.5966           -988.4118     -2227.7234    921491.4634      -988.4118     -2227.7234

ENERGY:     395     19644.4019     20265.5069      5734.3763       175.3161        -335972.1480     22982.1018         0.0000         0.0000     44739.8936        -222430.5513       162.7514   -267170.4449   -222052.2371       162.7514             57.9321     -2215.1748    921491.4634        57.9321     -2215.1748

ENERGY:     396     20000.9211     20248.4507      5727.6303       175.9620        -335765.9668     22978.8837         0.0000         0.0000     44270.3050        -222363.8140       161.0432   -266634.1190   -222050.8947       161.0432            285.8964     -2246.0849    921491.4634       285.8964     -2246.0849

ENERGY:     397     19906.7784     20200.7712      5721.4919       176.2273        -336102.8176     22990.0373         0.0000         0.0000     44712.8675        -222394.6439       162.6531   -267107.5114   -222042.6597       162.6531           -376.0863     -2327.2103    921491.4634      -376.0863     -2327.2103

ENERGY:     398     19692.8116     20133.3593      5716.9814       176.0456        -336812.3380     23014.0584         0.0000         0.0000     45592.7323        -222486.3494       165.8538   -268079.0817   -222045.7220       165.8538          -1710.2238     -2443.6966    921491.4634     -1710.2238     -2443.6966

ENERGY:     399     20395.5109     20061.2893      5714.6367       175.4775        -337634.0287     23050.4586         0.0000         0.0000     45731.2028        -222505.4529       166.3575   -268236.6557   -222049.1601       166.3575          -3349.4394     -2564.3620    921491.4634     -3349.4394     -2564.3620

LDB: ============= START OF LOAD BALANCING ============== 194.252
LDB: Largest compute 230 load 0.525464 is 1.2% of average load 45.606069
LDB: Average compute 0.063853 is 0.1% of average load 45.606069
LDB: TIME 194.253 LOAD: AVG 45.6061 MAX 46.0052  PROXIES: TOTAL 112 MAXPE 28 MAXPATCH 1 None MEM: 3224.27 MB
LDB: TIME 194.254 LOAD: AVG 45.6061 MAX 46.0052  PROXIES: TOTAL 113 MAXPE 29 MAXPATCH 1 RefineTorusLB MEM: 3224.27 MB
LDB: TIME 194.254 LOAD: AVG 45.6061 MAX 46.0052  PROXIES: TOTAL 113 MAXPE 29 MAXPATCH 1 RefineTorusLB MEM: 3224.27 MB
LDB: ============== END OF LOAD BALANCING =============== 194.255
Info: useSync: 1 useProxySync: 0
LDB: =============== DONE WITH MIGRATION ================ 194.255
Info: Benchmark time: 4 CPUs 0.46003 s/step 5.32442 days/ns 3224.27 MB memory
TIMING: 400  CPU: 188.338, 0.459829/step  Wall: 188.338, 0.459829/step, 0.012773 hours remaining, 3224.273438 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     21983.9559     19981.4883      5714.2278       174.7230        -338264.6730     23090.3528         0.0000         0.0000     44890.2683        -222429.6569       163.2985   -267319.9252   -222060.6829       163.2985          -4748.6079     -2656.9998    921491.4634     -4748.6079     -2656.9998

ENERGY:     401     23053.7074     19909.1479      5715.0562       174.0724        -338477.1026     23114.9567         0.0000         0.0000     44157.6679        -222352.4941       160.6335   -266510.1620   -222050.1988       160.6335          -5384.8816     -2700.1794    921491.4634     -5384.8816     -2700.1794

ENERGY:     402     22444.0480     19835.9109      5715.8942       173.8391        -338107.6290     23109.6379         0.0000         0.0000     44436.8100        -222391.4888       161.6489   -266828.2988   -222049.2224       161.6489          -4939.3795     -2681.7025    921491.4634     -4939.3795     -2681.7025

ENERGY:     403     20784.9695     19778.4828      5715.7218       174.2695        -337239.9787     23077.8403         0.0000         0.0000     45225.5966        -222483.0982       164.5183   -267708.6948   -222046.6852       164.5183          -3613.5978     -2605.7428    921491.4634     -3613.5978     -2605.7428

ENERGY:     404     19687.5954     19735.4028      5713.8114       175.5084        -336169.1144     23038.2901         0.0000         0.0000     45313.8396        -222504.6667       164.8393   -267818.5063   -222060.2369       164.8393          -1967.0745     -2494.0438    921491.4634     -1967.0745     -2494.0438

ENERGY:     405     19798.8803     19696.7724      5710.0281       177.6162        -335317.9352     23008.3949         0.0000         0.0000     44511.4438        -222414.7995       161.9204   -266926.2433   -222047.5587       161.9204           -627.4747     -2380.7862    921491.4634      -627.4747     -2380.7862

ENERGY:     406     20210.3506     19614.0443      5704.4965       180.4779        -334953.8242     22994.4765         0.0000         0.0000     43902.7666        -222347.2118       159.7062   -266249.9785   -222046.2402       159.7062             66.0354     -2300.4795    921491.4634        66.0354     -2300.4795

ENERGY:     407     20044.4889     19493.9064      5698.1032       183.8794        -335181.5237     22996.8164         0.0000         0.0000     44376.0638        -222388.2657       161.4279   -266764.3295   -222047.0768       161.4279            -41.3219     -2272.9969    921491.4634       -41.3219     -2272.9969

ENERGY:     408     19735.8471     19387.6645      5692.2152       187.5226        -335902.8224     23017.8176         0.0000         0.0000     45394.4123        -222487.3430       165.1324   -267881.7553   -222063.5310       165.1324           -920.8282     -2294.1556    921491.4634      -920.8282     -2294.1556

ENERGY:     409     20350.1190     19376.4608      5688.4775       191.1593        -336896.6852     23057.9926         0.0000         0.0000     45733.6059        -222498.8702       166.3663   -268232.4760   -222051.6703       166.3663          -2367.4920     -2346.9325    921491.4634     -2367.4920     -2346.9325

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

ENERGY:     410     21850.5213     19470.1804      5687.6650       194.4179        -337813.1850     23106.2033         0.0000         0.0000     45077.0714        -222427.1259       163.9780   -267504.1973   -222054.6426       163.9780          -3838.6212     -2402.0239    921491.4634     -3838.6212     -2402.0239

ENERGY:     411     22931.8002     19651.0978      5689.8741       197.0388        -338354.2249     23140.9050         0.0000         0.0000     44380.5347        -222362.9744       161.4442   -266743.5091   -222056.2113       161.4442          -4745.1590     -2436.8800    921491.4634     -4745.1590     -2436.8800

ENERGY:     412     22535.8951     19878.8222      5694.3233       198.8205        -338356.4977     23146.2940         0.0000         0.0000     44499.5086        -222402.8341       161.8770   -266902.3426   -222068.4596       161.8770          -4717.2137     -2436.3027    921491.4634     -4717.2137     -2436.3027

ENERGY:     413     21130.1417     20138.5249      5699.9334       199.7191        -337872.5322     23125.1121         0.0000         0.0000     45113.2143        -222465.8867       164.1095   -267579.1010   -222055.3451       164.1095          -3850.6267     -2398.9548    921491.4634     -3850.6267     -2398.9548

ENERGY:     414     19987.3857     20381.5507      5705.1135       199.5118        -337122.7802     23094.4562         0.0000         0.0000     45271.6528        -222483.1095       164.6858   -267754.7623   -222052.1621       164.6858          -2501.3240     -2333.9463    921491.4634     -2501.3240     -2333.9463

ENERGY:     415     19745.2667     20572.1259      5708.7452       198.1487        -336456.1978     23071.1996         0.0000         0.0000     44733.2274        -222427.4842       162.7272   -267160.7116   -222049.0344       162.7272          -1174.6451     -2266.5614    921491.4634     -1174.6451     -2266.5614

ENERGY:     416     19942.3170     20661.9896      5710.0857       195.6953        -336157.5868     23063.1720         0.0000         0.0000     44200.2851        -222384.0419       160.7885   -266584.3271   -222052.9642       160.7885           -282.7612     -2224.6896    921491.4634      -282.7612     -2224.6896

ENERGY:     417     20031.3750     20631.3210      5709.0494       192.4696        -336373.1082     23072.1104         0.0000         0.0000     44338.4621        -222398.3208       161.2911   -266736.7829   -222044.6992       161.2911           -112.4552     -2227.1698    921491.4634      -112.4552     -2227.1698

ENERGY:     418     20154.6649     20457.0910      5705.5847       188.6536        -336970.7876     23098.6732         0.0000         0.0000     44915.1425        -222450.9777       163.3889   -267366.1201   -222046.7091       163.3889           -671.8546     -2269.9920    921491.4634      -671.8546     -2269.9920

ENERGY:     419     20790.7633     20185.5525      5700.4810       184.6054        -337717.8765     23139.8029         0.0000         0.0000     45250.3103        -222466.3612       164.6082   -267716.6714   -222049.5949       164.6082          -1783.9421     -2336.6463    921491.4634     -1783.9421     -2336.6463

TIMING: 420  CPU: 197.502, 0.458205/step  Wall: 197.502, 0.458205/step, 0.0101823 hours remaining, 3224.273438 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     21812.8761     19887.3912      5695.0415       180.6770        -338321.5520     23183.0580         0.0000         0.0000     45121.9780        -222440.5303       164.1414   -267562.5082   -222061.1146       164.1414          -3051.6029     -2402.9273    921491.4634     -3051.6029     -2402.9273

ENERGY:     421     22491.6106     19639.6137      5690.9238       177.2518        -338550.3543     23210.1390         0.0000         0.0000     44931.8965        -222408.9190       163.4499   -267340.8155   -222052.6016       163.4499          -4041.3724     -2452.8635    921491.4634     -4041.3724     -2452.8635

ENERGY:     422     22275.7614     19449.5350      5688.9976       174.4058        -338225.0324     23208.5481         0.0000         0.0000     45004.7089        -222423.0755       163.7148   -267427.7844   -222052.8447       163.7148          -4363.1150     -2465.6372    921491.4634     -4363.1150     -2465.6372

ENERGY:     423     21418.8986     19324.4274      5689.6736       172.2145        -337416.8967     23180.6046         0.0000         0.0000     45183.9718        -222447.1061       164.3669   -267631.0779   -222051.5230       164.3669          -3955.8305     -2434.9305    921491.4634     -3955.8305     -2434.9305

ENERGY:     424     20531.3312     19270.7818      5692.6542       170.6563        -336406.2774     23140.4652         0.0000         0.0000     45151.0461        -222449.3426       164.2471   -267600.3888   -222060.4123       164.2471          -3030.1605     -2370.2030    921491.4634     -3030.1605     -2370.2030

ENERGY:     425     19942.3363     19314.5611      5697.3263       169.6876        -335607.5217     23103.7926         0.0000         0.0000     44956.0485        -222423.7693       163.5377   -267379.8178   -222050.7959       163.5377          -1980.9651     -2297.0087    921491.4634     -1980.9651     -2297.0087

ENERGY:     426     19603.3348     19432.3073      5702.4947       169.0990        -335270.6887     23080.2898         0.0000         0.0000     44862.7389        -222420.4242       163.1983   -267283.1631   -222049.1085       163.1983          -1125.8049     -2237.7212    921491.4634     -1125.8049     -2237.7212

ENERGY:     427     19598.5317     19595.2902      5707.1504       168.7509        -335498.4330     23074.5013         0.0000         0.0000     44915.2779        -222438.9306       163.3894   -267354.2085   -222048.7334       163.3894           -741.9007     -2207.6352    921491.4634      -741.9007     -2207.6352

ENERGY:     428     20140.4230     19760.4174      5710.4628       168.5259        -336199.9866     23087.7683         0.0000         0.0000     44884.2597        -222448.1295       163.2766   -267332.3892   -222058.0547       163.2766           -935.5731     -2206.9582    921491.4634      -935.5731     -2206.9582

ENERGY:     429     21147.3678     19912.0622      5712.1358       168.3557        -337181.5919     23116.4527         0.0000         0.0000     44706.5245        -222418.6932       162.6300   -267125.2177   -222045.4879       162.6300          -1630.8084     -2233.4560    921491.4634     -1630.8084     -2233.4560

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

ENERGY:     430     22013.9873     20024.3740      5712.1700       168.1897        -338096.9214     23149.4499         0.0000         0.0000     44626.3101        -222402.4404       162.3383   -267028.7506   -222047.3913       162.3383          -2472.2454     -2268.0463    921491.4634     -2472.2454     -2268.0463

ENERGY:     431     22204.1021     20111.4154      5711.2600       168.0704        -338644.7652     23172.3810         0.0000         0.0000     44858.4633        -222419.0730       163.1828   -267277.5363   -222048.7167       163.1828          -3116.2803     -2293.5590    921491.4634     -3116.2803     -2293.5590

ENERGY:     432     21768.3703     20188.6725      5710.3547       168.1086        -338651.2109     23176.0851         0.0000         0.0000     45177.9912        -222461.6285       164.3451   -267639.6198   -222065.9058       164.3451          -3350.2739     -2296.1496    921491.4634     -3350.2739     -2296.1496

ENERGY:     433     21200.9073     20275.9663      5710.3763       168.4633        -338164.0644     23162.2915         0.0000         0.0000     45192.9285        -222453.1311       164.3995   -267646.0596   -222052.5982       164.3995          -3187.3731     -2272.1275    921491.4634     -3187.3731     -2272.1275

ENERGY:     434     20730.3414     20338.1499      5711.6061       169.3247        -337394.2710     23140.7740         0.0000         0.0000     44883.0998        -222420.9751       163.2724   -267304.0750   -222051.1462       163.2724          -2694.3107     -2227.7884    921491.4634     -2694.3107     -2227.7884

ENERGY:     435     20235.2202     20362.4015      5714.0003       170.8455        -336680.6561     23123.4102         0.0000         0.0000     44675.9840        -222398.7944       162.5190   -267074.7784   -222049.5889       162.5190          -2061.3582     -2179.8951    921491.4634     -2061.3582     -2179.8951

ENERGY:     436     19670.9243     20349.9982      5717.2345       173.0864        -336303.8816     23119.9083         0.0000         0.0000     44847.0985        -222425.6315       163.1414   -267272.7300   -222059.6957       163.1414          -1520.6598     -2145.1616    921491.4634     -1520.6598     -2145.1616

ENERGY:     437     19434.5517     20329.5093      5720.9893       175.9827        -336411.9789     23136.3872         0.0000         0.0000     45159.2688        -222455.2899       164.2770   -267614.5587   -222050.7501       164.2770          -1319.1169     -2134.4847    921491.4634     -1319.1169     -2134.4847

ENERGY:     438     19935.1534     20278.6097      5724.6884       179.3848        -336899.4581     23173.5523         0.0000         0.0000     45148.1324        -222459.9371       164.2365   -267608.0695   -222051.5666       164.2365          -1493.0942     -2145.0880    921491.4634     -1493.0942     -2145.0880

ENERGY:     439     21052.7408     20184.4297      5727.7929       183.0561        -337561.7723     23224.7486         0.0000         0.0000     44760.8211        -222428.1830       162.8276   -267189.0042   -222052.7963       162.8276          -1936.1988     -2169.8746    921491.4634     -1936.1988     -2169.8746

TIMING: 440  CPU: 206.667, 0.458226/step  Wall: 206.667, 0.458226/step, 0.00763711 hours remaining, 3224.273438 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     22071.5684     20036.2373      5729.7527       186.7201        -338123.1812     23276.2489         0.0000         0.0000     44417.5461        -222405.1077       161.5788   -266822.6538   -222059.4771       161.5788          -2408.4612     -2197.9671    921491.4634     -2408.4612     -2197.9671

ENERGY:     441     22355.5486     19860.0410      5730.3488       190.1145        -338361.1721     23313.2048         0.0000         0.0000     44502.6967        -222409.2177       161.8886   -266911.9144   -222050.0858       161.8886          -2716.1026     -2221.5314    921491.4634     -2716.1026     -2221.5314

ENERGY:     442     21853.6118     19664.5350      5729.4854       192.9411        -338090.1540     23327.1571         0.0000         0.0000     44880.6323        -222441.7912       163.2634   -267322.4235   -222049.7753       163.2634          -2710.5575     -2229.0696    921491.4634     -2710.5575     -2229.0696

ENERGY:     443     21064.3318     19487.0724      5727.6164       194.9329        -337369.3158     23320.0161         0.0000         0.0000     45118.1109        -222457.2352       164.1273   -267575.3462   -222048.5994       164.1273          -2448.1648     -2220.3531    921491.4634     -2448.1648     -2220.3531

ENERGY:     444     20449.3366     19357.2692      5725.4095       195.8735        -336464.1932     23301.5279         0.0000         0.0000     44987.7179        -222447.0587       163.6530   -267434.7766   -222057.9797       163.6530          -2090.2100     -2206.4399    921491.4634     -2090.2100     -2206.4399

ENERGY:     445     20125.5610     19307.2520      5723.6513       195.6942        -335759.3924     23283.8142         0.0000         0.0000     44708.7157        -222414.7041       162.6380   -267123.4197   -222046.5427       162.6380          -1846.9628     -2201.6926    921491.4634     -1846.9628     -2201.6926

ENERGY:     446     19947.6806     19324.9008      5722.5430       194.3235        -335494.5718     23276.0454         0.0000         0.0000     44620.2947        -222408.7838       162.3164   -267029.0785   -222046.1620       162.3164          -1800.7519     -2216.7294    921491.4634     -1800.7519     -2216.7294

ENERGY:     447     19914.2850     19416.0212      5722.2107       191.8641        -335769.4409     23282.7461         0.0000         0.0000     44816.5089        -222425.8049       163.0301   -267242.3138   -222046.8342       163.0301          -1993.3113     -2253.0603    921491.4634     -1993.3113     -2253.0603

ENERGY:     448     20187.5923     19583.6802      5722.5764       188.5554        -336503.1807     23303.8906         0.0000         0.0000     45065.6674        -222451.2183       163.9365   -267516.8857   -222059.3479       163.9365          -2372.1878     -2303.7898    921491.4634     -2372.1878     -2303.7898

ENERGY:     449     20877.4061     19832.6988      5723.5712       184.8596        -337500.9077     23334.5925         0.0000         0.0000     45101.1677        -222446.6117       164.0657   -267547.7794   -222047.7097       164.0657          -2827.1080     -2356.1407    921491.4634     -2827.1080     -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     21754.4854     20108.1301      5724.4776       181.0898        -338419.3253     23364.6245         0.0000         0.0000     44854.3096        -222432.2084       163.1677   -267286.5181   -222048.7859       163.1677          -3116.6755     -2394.3896    921491.4634     -3116.6755     -2394.3896

ENERGY:     451     22355.5902     20357.7255      5724.7144       177.6517        -338952.0911     23381.8009         0.0000         0.0000     44542.6987        -222411.9098       162.0341   -266954.6085   -222048.8244       162.0341          -3074.2531     -2405.7797    921491.4634     -3074.2531     -2405.7797

ENERGY:     452     22246.2015     20536.0134      5723.8953       174.8859        -338927.1541     23378.0945         0.0000         0.0000     44452.9196        -222415.1438       161.7075   -266868.0635   -222059.6369       161.7075          -2659.9604     -2384.7567    921491.4634     -2659.9604     -2384.7567

ENERGY:     453     21399.8727     20641.1311      5722.2878       173.1350        -338392.7937     23354.5909         0.0000         0.0000     44683.7033        -222418.0729       162.5470   -267101.7762   -222043.5370       162.5470          -2048.3338     -2342.4667    921491.4634     -2048.3338     -2342.4667

ENERGY:     454     20248.3382     20654.1374      5720.2217       172.3637        -337567.1418     23320.6903         0.0000         0.0000     45008.1465        -222443.2440       163.7273   -267451.3906   -222041.8390       163.7273          -1453.4579     -2293.1449    921491.4634     -1453.4579     -2293.1449

ENERGY:     455     19486.7907     20584.7120      5718.4844       172.5169        -336790.6457     23290.4025         0.0000         0.0000     45086.5789        -222451.1602       164.0126   -267537.7391   -222040.8569       164.0126          -1151.8824     -2255.8571    921491.4634     -1151.8824     -2255.8571

ENERGY:     456     19493.3722     20440.6801      5717.7556       173.4248        -336350.1080     23274.9633         0.0000         0.0000     44811.4727        -222438.4393       163.0118   -267249.9120   -222055.3484       163.0118          -1305.5005     -2245.5823    921491.4634     -1305.5005     -2245.5823

ENERGY:     457     20047.4930     20251.9435      5718.5580       174.9241        -336395.8169     23277.8276         0.0000         0.0000     44521.8707        -222403.2000       161.9583   -266925.0707   -222049.4130       161.9583          -1906.4166     -2263.5013    921491.4634     -1906.4166     -2263.5013

ENERGY:     458     20585.8436     20019.2723      5720.7061       176.6081        -336835.0964     23294.7174         0.0000         0.0000     44632.7892        -222405.1597       162.3618   -267037.9489   -222051.2820       162.3618          -2684.6988     -2301.0427    921491.4634     -2684.6988     -2301.0427

ENERGY:     459     20903.4946     19784.9690      5724.0021       178.1985        -337468.1648     23318.6983         0.0000         0.0000     45113.9373        -222444.8650       164.1121   -267558.8023   -222053.1409       164.1121          -3350.5833     -2341.5797    921491.4634     -3350.5833     -2341.5797

TIMING: 460  CPU: 215.821, 0.457689/step  Wall: 215.821, 0.457689/step, 0.00508543 hours remaining, 3224.273438 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     21262.6140     19597.9064      5728.0971       179.4910        -338014.3773     23341.8001         0.0000         0.0000     45423.8572        -222480.6114       165.2395   -267904.4687   -222064.6834       165.2395          -3669.8202     -2365.2413    921491.4634     -3669.8202     -2365.2413

ENERGY:     461     21862.8764     19507.1077      5732.5753       180.4333        -338251.6222     23355.3934         0.0000         0.0000     45154.6145        -222458.6217       164.2601   -267613.2362   -222058.0505       164.2601          -3556.1666     -2361.1800    921491.4634     -3556.1666     -2361.1800

ENERGY:     462     22264.2258     19487.8111      5736.4822       180.9531        -337988.7177     23351.1084         0.0000         0.0000     44559.9298        -222408.2072       162.0968   -266968.1370   -222056.7212       162.0968          -2954.8201     -2323.4252    921491.4634     -2954.8201     -2323.4252

ENERGY:     463     21821.1794     19513.9019      5738.9361       181.1160        -337284.1035     23326.9475         0.0000         0.0000     44313.4577        -222388.5650       161.2002   -266702.0227   -222054.6240       161.2002          -2012.4425     -2264.0779    921491.4634     -2012.4425     -2264.0779

ENERGY:     464     20535.2462     19559.9276      5739.2518       181.0096        -336389.3850     23291.1939         0.0000         0.0000     44654.0274        -222428.7286       162.4391   -267082.7560   -222058.5730       162.4391          -1050.9229     -2205.5271    921491.4634     -1050.9229     -2205.5271

ENERGY:     465     19322.7828     19631.8858      5737.2899       180.7155        -335701.1544     23259.7388         0.0000         0.0000     45094.5695        -222474.1721       164.0416   -267568.7416   -222052.9389       164.0416           -512.3350     -2174.4011    921491.4634      -512.3350     -2174.4011

ENERGY:     466     19088.4512     19708.3585      5733.2107       180.2808        -335443.7735     23245.0600         0.0000         0.0000     45020.7915        -222467.6208       163.7733   -267488.4123   -222052.9787       163.7733           -630.3318     -2182.6713    921491.4634      -630.3318     -2182.6713

ENERGY:     467     19841.8072     19783.1746      5727.6704       179.7757        -335721.0960     23249.4525         0.0000         0.0000     44523.6672        -222415.5484       161.9649   -266939.2156   -222054.3496       161.9649          -1393.6033     -2232.5927    921491.4634     -1393.6033     -2232.5927

ENERGY:     468     20761.8484     19845.4946      5721.5089       179.2779        -336451.5672     23265.8121         0.0000         0.0000     44291.6592        -222385.9663       161.1209   -266677.6255   -222056.3591       161.1209          -2508.6718     -2314.1343    921491.4634     -2508.6718     -2314.1343

ENERGY:     469     21236.3017     19910.2024      5715.6824       178.8504        -337458.3207     23284.3956         0.0000         0.0000     44720.3210        -222412.5672       162.6802   -267132.8882   -222046.0750       162.6802          -3596.7409     -2405.7976    921491.4634     -3596.7409     -2405.7976

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     19972.8936      5710.9491       178.5947        -338383.2511     23297.0667         0.0000         0.0000     45346.4582        -222466.1157       164.9580   -267812.5738   -222047.6089       164.9580          -4259.6998     -2477.6835    921491.4634     -4259.6998     -2477.6835

ENERGY:     471     21732.8678     20054.6837      5707.9626       178.5890        -338913.2454     23297.5079         0.0000         0.0000     45471.3373        -222470.2971       165.4122   -267941.6344   -222047.5359       165.4122          -4290.5686     -2504.3179    921491.4634     -4290.5686     -2504.3179

ENERGY:     472     22081.2362     20161.5552      5707.0091       178.9047        -338870.6769     23279.4486         0.0000         0.0000     45028.5302        -222433.9930       163.8014   -267462.5231   -222059.5058       163.8014          -3659.7363     -2479.9187    921491.4634     -3659.7363     -2479.9187

ENERGY:     473     21866.1363     20289.3426      5707.9843       179.6165        -338307.7191     23240.7358         0.0000         0.0000     44634.5178        -222389.3859       162.3681   -267023.9037   -222043.8540       162.3681          -2556.3619     -2408.1660    921491.4634     -2556.3619     -2408.1660

ENERGY:     474     20842.9704     20372.0985      5710.2160       180.7466        -337438.4552     23189.2343         0.0000         0.0000     44733.2311        -222409.9582       162.7272   -267143.1893   -222041.2620       162.7272          -1295.5528     -2316.2731    921491.4634     -1295.5528     -2316.2731

ENERGY:     475     19674.2080     20371.7672      5712.9876       182.2512        -336604.2311     23142.3812         0.0000         0.0000     45070.2143        -222450.4217       163.9531   -267520.6360   -222039.4530       163.9531           -344.6452     -2232.2128    921491.4634      -344.6452     -2232.2128

ENERGY:     476     19235.7863     20282.0272      5715.7683       184.0125        -336100.0902     23115.8461         0.0000         0.0000     45106.0636        -222460.5862       164.0835   -267566.6498   -222053.6138       164.0835            -92.4053     -2183.0656    921491.4634       -92.4053     -2183.0656

ENERGY:     477     19704.7252     20145.9811      5718.4976       185.9230        -336101.8787     23114.2934         0.0000         0.0000     44812.3209        -222420.1375       163.0149   -267232.4584   -222044.8411       163.0149           -667.4950     -2171.8231    921491.4634      -667.4950     -2171.8231

ENERGY:     478     20493.4778     19974.7636      5721.0254       187.7262        -336537.4033     23131.2455         0.0000         0.0000     44627.0333        -222402.1315       162.3409   -267029.1648   -222047.4107       162.3409          -1807.1607     -2198.7959    921491.4634     -1807.1607     -2198.7959

ENERGY:     479     21125.3057     19793.3955      5723.3295       189.2098        -337215.5835     23156.6767         0.0000         0.0000     44802.1579        -222425.5083       162.9779   -267227.6662   -222050.5460       162.9779          -3089.8518     -2246.7920    921491.4634     -3089.8518     -2246.7920

TIMING: 480  CPU: 224.972, 0.457553/step  Wall: 224.972, 0.457553/step, 0.00254196 hours remaining, 3224.273438 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     21624.0325     19623.1964      5725.3111       190.1900        -337854.6781     23181.5114         0.0000         0.0000     45051.6817        -222458.7550       163.8856   -267510.4366   -222064.6209       163.8856          -4077.7326     -2291.4892    921491.4634     -4077.7326     -2291.4892

ENERGY:     481     22092.4852     19510.0434      5727.0952       190.6351        -338199.2477     23196.7955         0.0000         0.0000     45041.3369        -222440.8562       163.8480   -267482.1932   -222052.5265       163.8480          -4466.2393     -2305.6733    921491.4634     -4466.2393     -2305.6733

ENERGY:     482     22186.3467     19466.6797      5728.4964       190.3598        -338044.5415     23192.7470         0.0000         0.0000     44865.8520        -222414.0600       163.2096   -267279.9120   -222051.4112       163.2096          -4059.3098     -2278.0616    921491.4634     -4059.3098     -2278.0616

ENERGY:     483     21553.1413     19511.5749      5729.5660       189.3226        -337426.2184     23165.8736         0.0000         0.0000     44861.8970        -222414.8429       163.1953   -267276.7399   -222048.7672       163.1953          -2964.1723     -2216.4117    921491.4634     -2964.1723     -2216.4117

ENERGY:     484     20460.8925     19631.1943      5730.2465       187.5455        -336590.8879     23126.1347         0.0000         0.0000     45003.6034        -222451.2710       163.7107   -267454.8744   -222059.8735       163.7107          -1565.2424     -2143.1849    921491.4634     -1565.2424     -2143.1849

ENERGY:     485     19688.7720     19800.2996      5730.5256       185.2458        -335902.5864     23092.8467         0.0000         0.0000     44955.5729        -222449.3239       163.5360   -267404.8967   -222045.9599       163.5360           -422.1569     -2086.8734    921491.4634      -422.1569     -2086.8734

ENERGY:     486     19602.5427     19954.8181      5729.7198       182.4662        -335612.3567     23080.3804         0.0000         0.0000     44645.9121        -222416.5175       162.4096   -267062.4295   -222044.6753       162.4096             87.3181     -2070.0981    921491.4634        87.3181     -2070.0981

ENERGY:     487     19881.0927     20072.0217      5727.4348       179.4360        -335846.4483     23091.0542         0.0000         0.0000     44503.3498        -222392.0592       161.8910   -266895.4090   -222045.2400       161.8910           -192.2346     -2106.8839    921491.4634      -192.2346     -2106.8839

ENERGY:     488     20125.2100     20156.1365      5723.5441       176.4338        -336552.5459     23118.8614         0.0000         0.0000     44827.0562        -222425.3038       163.0685   -267252.3599   -222057.1935       163.0685          -1145.7535     -2194.6680    921491.4634     -1145.7535     -2194.6680

ENERGY:     489     20526.8872     20236.4612      5718.5749       173.8639        -337540.4662     23156.7309         0.0000         0.0000     45266.1011        -222461.8470       164.6656   -267727.9481   -222045.6082       164.6656          -2511.2404     -2316.7067    921491.4634     -2511.2404     -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     21410.7490     20292.9024      5712.8912       171.8438        -338458.1368     23196.4877         0.0000         0.0000     45213.5637        -222459.6990       164.4745   -267673.2627   -222048.2205       164.4745          -3823.4037     -2437.4155    921491.4634     -3823.4037     -2437.4155

ENERGY:     491     22430.4641     20312.1362      5707.3795       170.5404        -338984.5801     23226.0937         0.0000         0.0000     44733.0097        -222404.9565       162.7264   -267137.9662   -222049.4635       162.7264          -4629.6933     -2524.6215    921491.4634     -4629.6933     -2524.6215

ENERGY:     492     22612.9550     20289.6811      5702.9944       170.0208        -338937.5825     23232.7206         0.0000         0.0000     44542.1957        -222387.0150       162.0323   -266929.2107   -222060.3859       162.0323          -4606.8524     -2557.4730    921491.4634     -4606.8524     -2557.4730

ENERGY:     493     21558.2190     20260.7374      5700.7779       170.3201        -338358.0642     23214.0538         0.0000         0.0000     45033.8236        -222420.1325       163.8207   -267453.9561   -222046.5900       163.8207          -3796.3820     -2540.0996    921491.4634     -3796.3820     -2540.0996

ENERGY:     494     20068.3367     20225.0260      5700.9806       171.2193        -337454.3843     23183.0797         0.0000         0.0000     45622.2482        -222483.4939       165.9612   -268105.7421   -222044.0867       165.9612          -2500.8993     -2482.1068    921491.4634     -2500.8993     -2482.1068

ENERGY:     495     19383.2462     20186.8300      5703.5926       172.5416        -336566.9893     23159.4627         0.0000         0.0000     45484.1237        -222477.1925       165.4587   -267961.3162   -222041.5563       165.4587          -1249.6838     -2407.3055    921491.4634     -1249.6838     -2407.3055

ENERGY:     496     19722.4834     20130.6471      5708.0350       174.0933        -335998.7160     23154.2639         0.0000         0.0000     44699.5274        -222409.6657       162.6046   -267109.1932   -222049.0668       162.6046           -478.8998     -2343.4750    921491.4634      -478.8998     -2343.4750

ENERGY:     497     20212.6669     20059.9176      5713.4613       175.7242        -335952.5045     23166.3549         0.0000         0.0000     44261.0289        -222363.3508       161.0095   -266624.3797   -222042.7498       161.0095           -421.0232     -2316.7927    921491.4634      -421.0232     -2316.7927

ENERGY:     498     20182.0166     19957.1216      5718.5596       177.2604        -336366.4935     23189.3589         0.0000         0.0000     44728.2533        -222413.9231       162.7091   -267142.1764   -222044.5217       162.7091           -993.4678     -2331.6471    921491.4634      -993.4678     -2331.6471

ENERGY:     499     20158.0678     19847.7310      5722.4089       178.6361        -337058.4825     23219.2408         0.0000         0.0000     45439.2642        -222493.1337       165.2956   -267932.3979   -222047.2060       165.2956          -2020.8685     -2376.3389    921491.4634     -2020.8685     -2376.3389

Info: Benchmark time: 4 CPUs 0.457077 s/step 5.29025 days/ns 3224.27 MB memory
TIMING: 500  CPU: 234.046, 0.453721/step  Wall: 234.046, 0.453721/step, 0 hours remaining, 3224.273438 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     20974.8936     19756.6586      5724.4523       179.8271        -337741.4195     23251.1013         0.0000         0.0000     45359.0775        -222495.4091       165.0039   -267854.4866   -222061.0909       165.0039          -3197.5164     -2425.4141    921491.4634     -3197.5164     -2425.4141

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, 3229.367 MB of memory in use
WRITING VELOCITIES TO OUTPUT FILE AT STEP 500
The last velocity output (seq=-2) takes 0.002 seconds, 3229.367 MB of memory in use
====================================================

WallClock: 240.850464  CPUTime: 240.850464  Memory: 3229.367188 MB
[Partition 0][Node 0] End of program
Application 109759873 resources: utime ~947s, stime ~18s, Rss ~127032, inblocks ~67175, outblocks ~72238
Displaying status file:
verified
WALL=240.850464
CPU=240.850464
MEM=3229.367188

[SSH] completed
[SSH] exit-status: 0

[workspace] $ /bin/sh -xe /tmp/jenkins13397231667936217751.sh
+ rm -rf /var/lib/jenkins/jobs/NAMD-BW/workspace/cputime /var/lib/jenkins/jobs/NAMD-BW/workspace/memory /var/lib/jenkins/jobs/NAMD-BW/workspace/namd /var/lib/jenkins/jobs/NAMD-BW/workspace/wallclock
+ scp BW_REMOTE:/scratch/system/bwjenkins/tests/namd/2.10/cle5.2_gnu5.1.0/cputime /var/lib/jenkins/jobs/NAMD-BW/workspace
+ scp BW_REMOTE:/scratch/system/bwjenkins/tests/namd/2.10/cle5.2_gnu5.1.0/memory /var/lib/jenkins/jobs/NAMD-BW/workspace
+ scp BW_REMOTE:/scratch/system/bwjenkins/tests/namd/2.10/cle5.2_gnu5.1.0/wallclock /var/lib/jenkins/jobs/NAMD-BW/workspace
Recording plot data
Saving plot series data from: /var/lib/jenkins/jobs/NAMD-BW/workspace/wallclock
Saving plot series data from: /var/lib/jenkins/jobs/NAMD-BW/workspace/cputime
Saving plot series data from: /var/lib/jenkins/jobs/NAMD-BW/workspace/memory
Finished: SUCCESS