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ENERGY:      83     17463.4115     17611.3785      5761.4800       185.4557        -334548.5450     23165.5264         0.0000         0.0000     47631.4997        -222729.7932       173.2703   -270361.2929   -222380.8000       173.2703          -2245.6201     -2209.9239    921491.4634     -2245.6201     -2209.9239

ENERGY:      84     15692.0180     17521.7594      5761.2958       180.7102        -333070.6345     23043.3534         0.0000         0.0000     48072.9174        -222798.5802       174.8761   -270871.4976   -222420.9192       174.8761          -1264.6407     -2119.1646    921491.4634     -1264.6407     -2119.1646

ENERGY:      85     19034.4749     18377.7083      5761.3316       176.5397        -332350.3364     22972.2187         0.0000         0.0000     43641.9416        -222386.1217       158.7574   -266028.0633   -222396.4598       158.7574          -1101.4912     -2031.8233    921491.4634     -1101.4912     -2031.8233

ENERGY:      86     22361.2997     19720.3241      5758.5583       173.6091        -332514.8439     22921.5212         0.0000         0.0000     39480.2342        -222099.2973       143.6182   -261579.5315   -222396.4729       143.6182          -1408.4309     -1992.0456    921491.4634     -1408.4309     -1992.0456

ENERGY:      87     21898.5873     20858.8153      5750.7775       172.4431        -333299.4429     22859.7331         0.0000         0.0000     39513.3018        -222245.7847       143.7385   -261759.0865   -222398.3222       143.7385          -1739.2136     -2002.6067    921491.4634     -1739.2136     -2002.6067

ENERGY:      88     19807.2124     21236.1262      5737.2297       173.3188        -334313.4194     22793.0785         0.0000         0.0000     42007.3339        -222559.1200       152.8111   -264566.4538   -222408.9129       152.8111          -2036.3959     -2043.8955    921491.4634     -2036.3959     -2043.8955

ENERGY:      89     20138.2921     20745.5546      5719.3133       176.3160        -335202.8321     22743.6988         0.0000         0.0000     43113.7497        -222565.9076       156.8360   -265679.6573   -222389.0014       156.8360          -2409.8246     -2071.1686    921491.4634     -2409.8246     -2071.1686

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

ENERGY:      90     22711.6048     19691.0676      5699.8921       181.1111        -335712.1130     22705.2746         0.0000         0.0000     42377.6758        -222345.4871       154.1583   -264723.1628   -222389.2093       154.1583          -2670.9832     -2080.5818    921491.4634     -2670.9832     -2080.5818

ENERGY:      91     23737.5988     18627.1145      5683.0577       187.2277        -335678.4156     22643.5818         0.0000         0.0000     42539.3829        -222260.4522       154.7466   -264799.8351   -222388.3581       154.7466          -2499.0953     -2078.8098    921491.4634     -2499.0953     -2078.8098

ENERGY:      92     21523.8221     18060.4535      5672.6738       194.0387        -335129.0783     22543.7115         0.0000         0.0000     44665.3078        -222469.0709       162.4801   -267134.3787   -222389.6059       162.4801          -1910.9683     -2078.9075    921491.4634     -1910.9683     -2078.9075

ENERGY:      93     18788.3597     18281.5994      5671.3716       200.9119        -334319.2922     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     19242.9913      5679.4418       207.1113        -333693.3059     22351.2077         0.0000         0.0000     45144.9171        -222536.7040       164.2248   -267681.6210   -222367.0865       164.2248          -1347.2600     -2063.4575    921491.4634     -1347.2600     -2063.4575

ENERGY:      95     20040.4586     20654.3435      5695.3527       212.0382        -333603.6975     22302.2586         0.0000         0.0000     42387.6997        -222311.5463       154.1948   -264699.2459   -222367.4634       154.1948          -1793.7082     -2083.6407    921491.4634     -1793.7082     -2083.6407

ENERGY:      96     20584.1064     22050.3788      5716.0483       215.1945        -334091.8990     22265.7316         0.0000         0.0000     40970.7076        -222289.7317       149.0402   -263260.4393   -222356.3661       149.0402          -2389.6990     -2142.8256    921491.4634     -2389.6990     -2142.8256

ENERGY:      97     19809.1309     22949.2011      5737.7476       216.2279        -334886.9639     22225.8322         0.0000         0.0000     41505.2397        -222443.5845       150.9847   -263948.8242   -222346.5815       150.9847          -2891.9375     -2214.1665    921491.4634     -2891.9375     -2214.1665

ENERGY:      98     19979.7557     22958.8353      5756.3117       214.8681        -335616.8431     22188.2114         0.0000         0.0000     41993.4226        -222525.4382       152.7605   -264518.8609   -222347.6398       152.7605          -3206.5491     -2272.3421    921491.4634     -3206.5491     -2272.3421

ENERGY:      99     22029.8952     22024.0795      5768.5777       211.0972        -336009.8229     22159.4701         0.0000         0.0000     41425.1768        -222391.5264       150.6934   -263816.7032   -222348.0705       150.6934          -3235.8098     -2296.7688    921491.4634     -3235.8098     -2296.7688

LDB: ============= START OF LOAD BALANCING ============== 54.2148
LDB: Largest compute 200 load 0.431209 is 1.2% of average load 36.771945
LDB: Average compute 0.051514 is 0.1% of average load 36.771945
LDB: Partitioning computes with target load 3.677195
LDB: Increased migratable compute count from 2736 to 2736
LDB: Largest unpartitionable compute is 0.054994
LDB: ============== END OF LOAD BALANCING =============== 54.217
Info: useSync: 1 useProxySync: 0
LDB: =============== DONE WITH MIGRATION ================ 54.2179
Info: Initial time: 4 CPUs 0.473471 s/step 5.47999 days/ns 3221.52 MB memory
TIMING: 100  CPU: 48.3178, 0.472556/step  Wall: 48.3178, 0.472556/step, 0.0525062 hours remaining, 3221.519531 MB of memory in use.
ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     100     23587.3020     20475.3730      5773.0376       205.1509        -335896.4623     22125.7987         0.0000         0.0000     41455.8050        -222273.9951       150.8048   -263729.8001   -222326.1726       150.8048          -2788.3920     -2294.3880    921491.4634     -2788.3920     -2294.3880

ENERGY:     101     22287.2999     18933.8502      5770.3900       197.5201        -335238.2412     22065.3980         0.0000         0.0000     43590.2955        -222393.4875       158.5695   -265983.7830   -222319.4707       158.5695          -1880.2673     -2262.6846    921491.4634     -1880.2673     -2262.6846

ENERGY:     102     19420.3334     17951.6561      5762.8059       188.8891        -334088.2233     21980.7896         0.0000         0.0000     46153.7217        -222630.0275       167.8946   -268783.7492   -222317.3983       167.8946           -924.5794     -2215.2271    921491.4634      -924.5794     -2215.2271

ENERGY:     103     18429.6588     17794.2510      5753.5002       180.0834        -332765.4445     21898.9792         0.0000         0.0000     46061.5884        -222647.3835       167.5594   -268708.9719   -222315.0116       167.5594           -521.9322     -2162.1475    921491.4634      -521.9322     -2162.1475

ENERGY:     104     20135.5160     18313.1192      5745.4365       171.9705        -331716.6191     21838.6802         0.0000         0.0000     43114.8219        -222397.0748       156.8399   -265511.8967   -222300.0342       156.8399           -904.7451     -2132.5694    921491.4634      -904.7451     -2132.5694

ENERGY:     105     21674.8147     19112.5119      5740.5773       165.3638        -331353.5904     21791.8563         0.0000         0.0000     40663.3131        -222205.1533       147.9220   -262868.4664   -222297.2862       147.9220          -1781.0302     -2140.0925    921491.4634     -1781.0302     -2140.0925

ENERGY:     106     20688.3526     19760.1603      5739.0355       160.9482        -331684.6911     21743.4749         0.0000         0.0000     41270.8908        -222321.8289       150.1322   -263592.7197   -222299.8103       150.1322          -2687.8655     -2192.8737    921491.4634     -2687.8655     -2192.8737

ENERGY:     107     18828.1851     20041.3660      5739.7936       159.1631        -332486.5660     21693.8616         0.0000         0.0000     43452.4231        -222571.7736       158.0680   -266024.1966   -222302.3924       158.0680          -3435.4056     -2264.9714    921491.4634     -3435.4056     -2264.9714

ENERGY:     108     19374.7527     19955.6334      5740.9974       160.1493        -333435.9263     21654.4583         0.0000         0.0000     43952.1728        -222597.7624       159.8859   -266549.9352   -222305.0563       159.8859          -3989.5485     -2325.7046    921491.4634     -3989.5485     -2325.7046

ENERGY:     109     22394.0521     19651.8554      5740.7059       163.7566        -334323.6676     21623.9120         0.0000         0.0000     42380.9037        -222368.4819       154.1701   -264749.3856   -222289.2481       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     24310.7312     19315.3190      5736.8740       169.5643        -334907.1597     21583.6717         0.0000         0.0000     41568.0397        -222222.9598       151.2131   -263790.9995   -222288.3776       151.2131          -3608.1962     -2356.1915    921491.4634     -3608.1962     -2356.1915

ENERGY:     111     22660.5936     19186.3866      5728.6091       176.9885        -335028.8257     21518.8536         0.0000         0.0000     43385.4034        -222371.9909       157.8242   -265757.3943   -222286.8995       157.8242          -2331.3776     -2338.2311    921491.4634     -2331.3776     -2338.2311

ENERGY:     112     19381.8198     19463.5168      5716.4074       185.3624        -334677.6373     21440.9490         0.0000         0.0000     45860.8185        -222628.7636       166.8291   -268489.5820   -222302.4570       166.8291           -894.2292     -2309.1964    921491.4634      -894.2292     -2309.1964

ENERGY:     113     18216.1580     20180.8082      5702.4491       194.0323        -334046.4825     21376.2232         0.0000         0.0000     45761.5815        -222615.2302       166.4681   -268376.8117   -222273.7403       166.4681            -55.6424     -2273.8625    921491.4634       -55.6424     -2273.8625

ENERGY:     114     19843.9972     21062.4094      5689.3793       202.2945        -333472.4289     21337.7637         0.0000         0.0000     42964.6870        -222371.8979       156.2937   -265336.5849   -222272.2454       156.2937           -128.5963     -2261.6571    921491.4634      -128.5963     -2261.6571

ENERGY:     115     21448.4486     21679.6562      5680.2429       209.5308        -333239.9681     21316.4508         0.0000         0.0000     40710.1055        -222195.5334       148.0922   -262905.6389   -222272.7008       148.0922           -905.3248     -2296.5621    921491.4634      -905.3248     -2296.5621

ENERGY:     116     20838.2583     21694.4196      5677.2615       215.2237        -333429.0370     21301.4964         0.0000         0.0000     41385.0930        -222317.2845       150.5476   -263702.3775   -222276.5259       150.5476          -2000.5240     -2380.1424    921491.4634     -2000.5240     -2380.1424

ENERGY:     117     19309.7304     21105.1713      5681.4214       219.0426        -333858.2256     21295.0742         0.0000         0.0000     43733.0002        -222514.7856       159.0886   -266247.7858   -222254.7027       159.0886          -3196.9894     -2479.5443    921491.4634     -3196.9894     -2479.5443

ENERGY:     118     19488.7485     20180.1712      5691.5867       220.7069        -334305.8419     21303.6951         0.0000         0.0000     44852.5143        -222568.4192       163.1611   -267420.9335   -222257.5959       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        -222430.2619       159.9564   -266401.8016   -222258.7221       159.9564          -4948.0951     -2603.4635    921491.4634     -4948.0951     -2603.4635

LDB: ============= START OF LOAD BALANCING ============== 63.6505
LDB: ============== END OF LOAD BALANCING =============== 63.6506
Info: useSync: 1 useProxySync: 0
LDB: =============== DONE WITH MIGRATION ================ 63.6511
TIMING: 120  CPU: 57.7486, 0.471538/step  Wall: 57.7486, 0.471538/step, 0.0497734 hours remaining, 3221.652344 MB of memory in use.
ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     120     23278.7482     18843.5009      5721.1112       217.5091        -334559.3219     21317.8986         0.0000         0.0000     42838.0029        -222342.5511       155.8329   -265180.5540   -222260.9694       155.8329          -4802.3838     -2609.8232    921491.4634     -4802.3838     -2609.8232

ENERGY:     121     22753.8285     18833.9840      5735.1155       213.1885        -334109.3886     21287.1663         0.0000         0.0000     42902.9081        -222383.1977       156.0690   -265286.1058   -222238.8457       156.0690          -3789.7328     -2573.0323    921491.4634     -3789.7328     -2573.0323

ENERGY:     122     20911.3202     19183.7911      5744.9150       207.6394        -333246.0909     21235.0876         0.0000         0.0000     43471.2677        -222492.0699       158.1365   -265963.3376   -222236.2049       158.1365          -2259.2349     -2503.9465    921491.4634     -2259.2349     -2503.9465

ENERGY:     123     19716.6565     19702.2261      5748.9495       201.5075        -332195.6664     21181.3173         0.0000         0.0000     43159.1485        -222485.8611       157.0011   -265645.0096   -222233.3017       157.0011           -827.7756     -2423.1751    921491.4634      -827.7756     -2423.1751

ENERGY:     124     19701.7331     20151.8502      5747.1965       195.4812        -331340.9823     21138.0468         0.0000         0.0000     42008.6527        -222398.0219       152.8159   -264406.6746   -222234.8510       152.8159              8.3516     -2371.2952    921491.4634         8.3516     -2371.2952

ENERGY:     125     19961.8491     20319.7042      5741.5018       190.2907        -331002.3875     21106.9631         0.0000         0.0000     41347.6158        -222334.4629       150.4113   -263682.0787   -222218.5353       150.4113             16.1239     -2370.5229    921491.4634        16.1239     -2370.5229

ENERGY:     126     19913.8782     20060.3739      5734.4100       186.3237        -331257.3388     21089.4917         0.0000         0.0000     41888.6054        -222384.2557       152.3792   -264272.8612   -222220.0405       152.3792           -757.3347     -2430.8872    921491.4634      -757.3347     -2430.8872

ENERGY:     127     20034.1249     19457.5518      5728.8730       183.8512        -331985.2681     21088.4980         0.0000         0.0000     43047.2719        -222445.0974       156.5941   -265492.3693   -222223.2519       156.5941          -2122.5055     -2533.3235    921491.4634     -2122.5055     -2533.3235

ENERGY:     128     20681.9269     18818.3077      5727.0308       182.9174        -332977.2827     21101.0436         0.0000         0.0000     44006.3123        -222459.7439       160.0829   -266466.0562   -222232.5708       160.0829          -3698.9567     -2655.1908    921491.4634     -3698.9567     -2655.1908

ENERGY:     129     21368.2886     18554.7975      5729.8505       183.4688        -333997.8249     21115.0501         0.0000         0.0000     44607.0892        -222439.2803       162.2683   -267046.3695   -222215.2566       162.2683          -4993.9821     -2763.9222    921491.4634     -4993.9821     -2763.9222

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

ENERGY:     130     21553.6087     18898.7760      5736.4508       185.0194        -334776.0135     21118.0423         0.0000         0.0000     44811.1496        -222472.9668       163.0106   -267284.1164   -222216.5365       163.0106          -5536.0554     -2842.3154    921491.4634     -5536.0554     -2842.3154

ENERGY:     131     21530.9954     19804.6627      5745.0872       187.0957        -335083.2642     21105.7069         0.0000         0.0000     44221.5102        -222488.2060       160.8657   -266709.7162   -222215.1806       160.8657          -5164.7862     -2872.9597    921491.4634     -5164.7862     -2872.9597

ENERGY:     132     21696.5182     20951.9796      5753.4447       189.2233        -334841.7366     21081.3851         0.0000         0.0000     42732.1266        -222437.0592       155.4477   -265169.1857   -222222.8148       155.4477          -4015.6409     -2856.5553    921491.4634     -4015.6409     -2856.5553

ENERGY:     133     21569.7010     21939.4305      5759.4053       191.1377        -334187.7138     21049.8506         0.0000         0.0000     41346.5714        -222331.6173       150.4075   -263678.1887   -222209.0244       150.4075          -2436.6192     -2806.2333    921491.4634     -2436.6192     -2806.2333

ENERGY:     134     20380.1719     22407.7421      5761.0449       192.4922        -333420.8525     21018.0949         0.0000         0.0000     41320.1608        -222341.1457       150.3114   -263661.3065   -222206.0449       150.3114           -846.9781     -2759.4267    921491.4634      -846.9781     -2759.4267

ENERGY:     135     18735.1493     22221.9400      5757.7067       193.2251        -332860.3442     20999.0422         0.0000         0.0000     42497.1276        -222456.1532       154.5929   -264953.2808   -222204.4872       154.5929            191.9082     -2745.1432    921491.4634       191.9082     -2745.1432

ENERGY:     136     18381.4540     21453.0792      5750.0867       193.4037        -332655.7489     21006.3295         0.0000         0.0000     43348.3540        -222523.0419       157.6894   -265871.3959   -222211.0695       157.6894            198.1849     -2776.3543    921491.4634       198.1849     -2776.3543

ENERGY:     137     19975.5717     20347.8313      5740.3098       193.2572        -332832.5920     21040.1067         0.0000         0.0000     43092.4469        -222443.0684       156.7585   -265535.5153   -222209.8939       156.7585           -927.2504     -2841.0685    921491.4634      -927.2504     -2841.0685

ENERGY:     138     21874.8525     19195.4802      5730.8549       192.8766        -333203.4345     21083.5324         0.0000         0.0000     42784.9638        -222340.8740       155.6399   -265125.8378   -222213.1816       155.6399          -2704.7056     -2927.3525    921491.4634     -2704.7056     -2927.3525

ENERGY:     139     22116.0296     18330.1125      5724.2506       192.4679        -333575.3363     21115.6332         0.0000         0.0000     43705.6788        -222391.1637       158.9892   -266096.8425   -222217.3490       158.9892          -4443.4108     -3015.1529    921491.4634     -4443.4108     -3015.1529

TIMING: 140  CPU: 67.1736, 0.471251/step  Wall: 67.1736, 0.471251/step, 0.0471251 hours remaining, 3221.945312 MB of memory in use.
ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     140     20992.5976     17997.1578      5722.1741       192.2140        -333726.9442     21127.4061         0.0000         0.0000     45144.2512        -222551.1435       164.2224   -267695.3947   -222224.0363       164.2224          -5617.7626     -3080.3638    921491.4634     -5617.7626     -3080.3638

ENERGY:     141     20605.2146     18251.9196      5725.3083       192.2642        -333525.1323     21120.3060         0.0000         0.0000     45039.8863        -222590.2333       163.8427   -267630.1196   -222215.3922       163.8427          -6017.5037     -3087.0005    921491.4634     -6017.5037     -3087.0005

ENERGY:     142     21702.7398     18860.4298      5732.9228       192.6003        -332879.0279     21093.2714         0.0000         0.0000     42868.0673        -222428.9964       155.9422   -265297.0637   -222213.3922       155.9422          -5532.0374     -3029.5546    921491.4634     -5532.0374     -3029.5546

ENERGY:     143     22457.6179     19468.7636      5743.5741       193.1827        -331957.5931     21040.0377         0.0000         0.0000     40797.9946        -222256.4225       148.4119   -263054.4171   -222209.6225       148.4119          -4179.8276     -2928.5086    921491.4634     -4179.8276     -2928.5086

ENERGY:     144     21007.3340     19787.0057      5755.2166       193.9151        -331097.8395     20965.2215         0.0000         0.0000     41087.3101        -222301.8366       149.4643   -263389.1467   -222194.0942       149.4643          -2265.2408     -2825.3503    921491.4634     -2265.2408     -2825.3503

ENERGY:     145     18390.7600     19760.7601      5765.7577       194.6436        -330692.1921     20892.9233         0.0000         0.0000     43191.0817        -222496.2657       157.1173   -265687.3474   -222180.9593       157.1173           -495.5030     -2742.5238    921491.4634      -495.5030     -2742.5238

ENERGY:     146     17494.3906     19517.0962      5773.0763       195.1974        -330883.4474     20850.7304         0.0000         0.0000     44468.0626        -222584.8938       161.7626   -267052.9564   -222180.0853       161.7626            380.5831     -2698.3695    921491.4634       380.5831     -2698.3695

ENERGY:     147     19349.0816     19284.4050      5776.1299       195.3841        -331633.2791     20843.7952         0.0000         0.0000     43729.9297        -222454.5535       159.0775   -266184.4832   -222180.7857       159.0775             12.4494     -2697.6200    921491.4634        12.4494     -2697.6200

ENERGY:     148     21731.1610     19240.1449      5775.1362       195.0156        -332748.3460     20852.0477         0.0000         0.0000     42647.1433        -222307.6973       155.1386   -264954.8406   -222173.9043       155.1386          -1313.5163     -2742.2255    921491.4634     -1313.5163     -2742.2255

ENERGY:     149     22154.0982     19476.6230      5771.6403       193.9272        -333952.9655     20853.5364         0.0000         0.0000     43165.2619        -222337.8785       157.0234   -265503.1404   -222149.8013       157.0234          -2998.4812     -2814.2281    921491.4634     -2998.4812     -2814.2281

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

ENERGY:     150     21015.8992     19956.3834      5767.3089       192.0924        -334899.3753     20845.5771         0.0000         0.0000     44606.5897        -222515.5246       162.2665   -267122.1143   -222153.2668       162.2665          -4472.9373     -2881.9211    921491.4634     -4472.9373     -2881.9211

ENERGY:     151     20656.1099     20586.9275      5763.7530       189.5631        -335303.4336     20835.7247         0.0000         0.0000     44710.6378        -222560.7177       162.6450   -267271.3555   -222155.1381       162.6450          -5407.8405     -2907.6331    921491.4634     -5407.8405     -2907.6331

ENERGY:     152     21757.0222     21203.4202      5761.8055       186.4838        -335072.1087     20820.7501         0.0000         0.0000     42914.6704        -222427.9566       156.1118   -265342.6270   -222175.0517       156.1118          -5552.0271     -2878.0876    921491.4634     -5552.0271     -2878.0876

ENERGY:     153     22396.4536     21618.6022      5761.5688       183.0547        -334307.6860     20787.1624         0.0000         0.0000     41296.2809        -222264.5633       150.2245   -263560.8442   -222152.0206       150.2245          -4765.4776     -2800.4122    921491.4634     -4765.4776     -2800.4122

ENERGY:     154     20952.1344     21640.3347      5761.9239       179.5647        -333344.9136     20735.3659         0.0000         0.0000     41746.1290        -222329.4610       151.8609   -264075.5901   -222148.7917       151.8609          -3178.1875     -2707.3606    921491.4634     -3178.1875     -2707.3606

ENERGY:     155     18734.5492     21249.5940      5761.4993       176.3183        -332564.0957     20691.4723         0.0000         0.0000     43448.4573        -222502.2053       158.0535   -265950.6626   -222145.9856       158.0535          -1408.3065     -2623.9033    921491.4634     -1408.3065     -2623.9033

ENERGY:     156     18312.4484     20599.9074      5758.8570       173.6449        -332218.9148     20684.3829         0.0000         0.0000     44137.5522        -222552.1220       160.5603   -266689.6741   -222166.8049       160.5603           -219.5097     -2571.5313    921491.4634      -219.5097     -2571.5313

ENERGY:     157     20043.0838     19943.2666      5753.0946       171.8900        -332363.0660     20715.7865         0.0000         0.0000     43325.6933        -222410.2511       157.6070   -265735.9445   -222155.5010       157.6070            -38.8545     -2554.7666    921491.4634       -38.8545     -2554.7666

ENERGY:     158     21695.0847     19425.3240      5743.5667       171.3409        -332829.8102     20761.5805         0.0000         0.0000     42713.6819        -222319.2316       155.3806   -265032.9135   -222157.3221       155.3806           -715.5937     -2586.7970    921491.4634      -715.5937     -2586.7970

ENERGY:     159     21695.6536     19084.6410      5730.9315       172.1899        -333376.4006     20800.7929         0.0000         0.0000     43483.6003        -222408.5914       158.1814   -265892.1917   -222160.0970       158.1814          -1882.1013     -2660.7875    921491.4634     -1882.1013     -2660.7875

TIMING: 160  CPU: 76.5862, 0.470629/step  Wall: 76.5862, 0.470629/step, 0.0444483 hours remaining, 3222.230469 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     21093.2842     18859.3046      5717.0749       174.4915        -333735.9154     20833.5471         0.0000         0.0000     44515.8596        -222542.3534       161.9365   -267058.2129   -222175.6787       161.9365          -3202.8705     -2752.7604    921491.4634     -3202.8705     -2752.7604

ENERGY:     161     21561.6000     18685.5960      5704.9781       178.2042        -333710.7595     20865.7132         0.0000         0.0000     44220.7113        -222493.9567       160.8628   -266714.6680   -222160.9739       160.8628          -4385.1101     -2823.4851    921491.4634     -4385.1101     -2823.4851

ENERGY:     162     22512.8124     18508.1492      5697.2826       183.0024        -333202.6494     20887.8856         0.0000         0.0000     43070.6067        -222342.9105       156.6790   -265413.5172   -222161.4907       156.6790          -5004.1553     -2859.8871    921491.4634     -5004.1553     -2859.8871

ENERGY:     163     21937.9851     18346.8656      5696.1509       188.4544        -332368.8222     20884.6195         0.0000         0.0000     43005.6961        -222309.0505       156.4429   -265314.7466   -222160.7802       156.4429          -4776.8219     -2868.7270    921491.4634     -4776.8219     -2868.7270

ENERGY:     164     19652.8066     18261.0399      5702.5306       194.0206        -331567.4469     20861.9109         0.0000         0.0000     44426.5344        -222468.6040       161.6115   -266895.1384   -222170.9035       161.6115          -3836.1732     -2870.4449    921491.4634     -3836.1732     -2870.4449

ENERGY:     165     18074.0952     18343.8149      5716.1638       199.2019        -331183.0466     20849.6742         0.0000         0.0000     45425.8564        -222574.2402       165.2468   -268000.0966   -222153.1700       165.2468          -2737.5186     -2867.1447    921491.4634     -2737.5186     -2867.1447

ENERGY:     166     18979.7070     18650.1652      5734.9735       203.3281        -331407.1003     20870.8939         0.0000         0.0000     44483.6889        -222484.3437       161.8194   -266968.0326   -222151.2329       161.8194          -1964.3637     -2870.3839    921491.4634     -1964.3637     -2870.3839

ENERGY:     167     21026.8308     19216.2866      5755.9248       205.8794        -332212.1862     20917.6388         0.0000         0.0000     42775.8062        -222313.8197       155.6066   -265089.6259   -222150.5300       155.6066          -1671.2500     -2889.5868    921491.4634     -1671.2500     -2889.5868

ENERGY:     168     21619.4182     19999.6888      5775.3367       206.4584        -333382.4927     20963.4338         0.0000         0.0000     42492.3350        -222325.8219       154.5754   -264818.1568   -222149.7710       154.5754          -1735.9906     -2933.5977    921491.4634     -1735.9906     -2933.5977

ENERGY:     169     20648.4665     20870.4068      5789.9166       204.9287        -334596.5071     20994.5722         0.0000         0.0000     43600.1909        -222488.0254       158.6055   -266088.2162   -222133.5318       158.6055          -2095.8777     -2988.7948    921491.4634     -2095.8777     -2988.7948

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

ENERGY:     170     20485.0013     21574.3800      5797.0542       201.1981        -335480.2501     21017.8094         0.0000         0.0000     43834.2688        -222570.5384       159.4570   -266404.8072   -222135.2423       159.4570          -2696.1967     -3030.4961    921491.4634     -2696.1967     -3030.4961

ENERGY:     171     22225.3639     21884.1726      5796.1347       195.5169        -335757.0014     21036.7487         0.0000         0.0000     42205.8539        -222413.2107       153.5333   -264619.0645   -222135.5894       153.5333          -3373.1625     -3035.3578    921491.4634     -3373.1625     -3035.3578

ENERGY:     172     23612.5240     21689.2904      5788.4217       188.3823        -335345.7507     21036.2039         0.0000         0.0000     40787.7256        -222243.2029       148.3745   -263030.9285   -222132.3045       148.3745          -3754.4377     -3004.4813    921491.4634     -3754.4377     -3004.4813

ENERGY:     173     22089.5491     21081.4671      5776.7002       180.5475        -334414.6778     21003.0505         0.0000         0.0000     41986.3984        -222296.9649       152.7350   -264283.3634   -222121.1464       152.7350          -3608.5985     -2944.3814    921491.4634     -3608.5985     -2944.3814

ENERGY:     174     18699.8473     20250.6917      5763.7521       172.7179        -333314.9344     20954.5022         0.0000         0.0000     44924.4952        -222548.9281       163.4230   -267473.4232   -222120.6682       163.4230          -3086.0087     -2871.4631    921491.4634     -3086.0087     -2871.4631

ENERGY:     175     17219.9376     19455.5736      5752.1494       165.6559        -332464.6999     20928.3117         0.0000         0.0000     46291.0144        -222652.0572       168.3940   -268943.0716   -222120.1889       168.3940          -2676.4056     -2794.4451    921491.4634     -2676.4056     -2794.4451

ENERGY:     176     19195.1039     18891.7630      5743.5896       160.0071        -332124.2131     20943.2095         0.0000         0.0000     44722.5120        -222468.0279       162.6882   -267190.5399   -222127.3371       162.6882          -2658.3222     -2727.5044    921491.4634     -2658.3222     -2727.5044

ENERGY:     177     21863.3196     18664.1737      5738.9484       156.2659        -332371.2414     20981.6518         0.0000         0.0000     42714.2624        -222252.6196       155.3827   -264966.8820   -222125.5137       155.3827          -2870.6847     -2681.8089    921491.4634     -2870.6847     -2681.8089

ENERGY:     178     21917.7900     18733.9560      5737.6245       154.5770        -332975.2977     21015.2132         0.0000         0.0000     43101.1543        -222314.9825       156.7902   -265416.1369   -222126.1322       156.7902          -2936.2257     -2665.7683    921491.4634     -2936.2257     -2665.7683

ENERGY:     179     20058.5719     19018.0840      5738.2698       154.9022        -333648.1818     21038.3003         0.0000         0.0000     45070.9163        -222569.1373       163.9556   -267640.0536   -222127.1794       163.9556          -2805.2707     -2668.3444    921491.4634     -2805.2707     -2668.3444

TIMING: 180  CPU: 85.9912, 0.470249/step  Wall: 85.9912, 0.470249/step, 0.0417999 hours remaining, 3222.230469 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     19770.2941     19384.7964      5738.8341       156.9935        -334084.3523     21065.2916         0.0000         0.0000     45324.2213        -222643.9213       164.8771   -267968.1426   -222142.6346       164.8771          -2684.8628     -2671.3561    921491.4634     -2684.8628     -2671.3561

ENERGY:     181     22122.8092     19693.8082      5737.3498       160.4696        -334134.1965     21097.1422         0.0000         0.0000     42906.0428        -222416.5747       156.0804   -265322.6176   -222134.4683       156.0804          -2655.0376     -2656.7563    921491.4634     -2655.0376     -2656.7563

ENERGY:     182     23922.3455     19800.0771      5732.0748       164.8150        -333691.2981     21109.5293         0.0000         0.0000     40770.0178        -222192.4385       148.3101   -262962.4564   -222132.7636       148.3101          -2461.5984     -2635.7203    921491.4634     -2461.5984     -2635.7203

ENERGY:     183     22149.3486     19677.1532      5722.7616       169.5349        -332921.8735     21084.4911         0.0000         0.0000     41834.8233        -222283.7608       152.1836   -264118.5841   -222131.2591       152.1836          -1990.8045     -2626.5157    921491.4634     -1990.8045     -2626.5157

ENERGY:     184     18376.8756     19424.9913      5710.5469       174.1844        -332181.9081     21042.4479         0.0000         0.0000     44880.5526        -222572.3093       163.2631   -267452.8620   -222144.6145       163.2631          -1576.6177     -2645.2274    921491.4634     -1576.6177     -2645.2274

ENERGY:     185     16957.7745     19234.6871      5697.7241       178.4155        -331895.6963     21023.9443         0.0000         0.0000     46149.4987        -222653.6521       167.8792   -268803.1508   -222128.1659       167.8792          -1752.9885     -2679.2078    921491.4634     -1752.9885     -2679.2078

ENERGY:     186     19266.0407     19234.9569      5686.4352       181.9571        -332240.0939     21043.7459         0.0000         0.0000     44391.5887        -222435.3694       161.4844   -266826.9581   -222129.2890       161.4844          -2596.4735     -2731.4264    921491.4634     -2596.4735     -2731.4264

ENERGY:     187     22073.2969     19471.4302      5678.7398       184.6336        -333156.1128     21076.9264         0.0000         0.0000     42449.0055        -222222.0804       154.4178   -264671.0859   -222130.9082       154.4178          -3641.8538     -2802.0867    921491.4634     -3641.8538     -2802.0867

ENERGY:     188     22101.1831     19886.6772      5676.0120       186.3502        -334382.7610     21093.9044         0.0000         0.0000     43113.1614        -222325.4727       156.8338   -265438.6342   -222135.3909       156.8338          -4316.2656     -2887.0591    921491.4634     -4316.2656     -2887.0591

ENERGY:     189     20394.2462     20391.8601      5678.8863       187.1154        -335558.5039     21096.5840         0.0000         0.0000     45245.6387        -222564.1733       164.5912   -267809.8119   -222116.4325       164.5912          -4451.6370     -2950.0786    921491.4634     -4451.6370     -2950.0786

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

ENERGY:     190     20342.0725     20848.4448      5686.3597       187.0164        -336318.7431     21106.5487         0.0000         0.0000     45533.2633        -222615.0376       165.6375   -268148.3009   -222116.1592       165.6375          -4141.9210     -2962.8210    921491.4634     -4141.9210     -2962.8210

ENERGY:     191     22534.8504     21157.2827      5696.5257       186.2614        -336419.5249     21124.8644         0.0000         0.0000     43330.7335        -222389.0068       157.6253   -265719.7403   -222114.1142       157.6253          -3471.5975     -2915.5481    921491.4634     -3471.5975     -2915.5481

ENERGY:     192     23768.4829     21244.3749      5706.8010       185.1520        -335814.4791     21125.1403         0.0000         0.0000     41560.2536        -222224.2743       151.1848   -263784.5279   -222108.6420       151.1848          -2412.4654     -2830.7903    921491.4634     -2412.4654     -2830.7903

ENERGY:     193     21710.8594     21097.1074      5714.9848       184.0570        -334711.3259     21092.9042         0.0000         0.0000     42578.8347        -222332.5784       154.8901   -264911.4131   -222093.8905       154.8901          -1181.4694     -2735.1546    921491.4634     -1181.4694     -2735.1546

ENERGY:     194     18383.3649     20711.5284      5719.3482       183.2863        -333492.4633     21054.1039         0.0000         0.0000     44867.8135        -222573.0181       163.2168   -267440.8316   -222092.1690       163.2168           -314.8316     -2651.4482    921491.4634      -314.8316     -2651.4482

ENERGY:     195     17581.7011     20169.9818      5719.7968       183.0839        -332603.8311     21048.2208         0.0000         0.0000     45307.7484        -222593.2982       164.8171   -267901.0466   -222091.6063       164.8171           -398.0879     -2592.7756    921491.4634      -398.0879     -2592.7756

ENERGY:     196     19755.8663     19594.9322      5717.4229       183.5644        -332319.6954     21082.8578         0.0000         0.0000     43603.6154        -222381.4363       158.6180   -265985.0518   -222096.3129       158.6180          -1480.5942     -2574.8093    921491.4634     -1480.5942     -2574.8093

ENERGY:     197     21700.3671     19122.7582      5714.1451       184.7200        -332668.2734     21129.4587         0.0000         0.0000     42574.3654        -222242.4589       154.8738   -264816.8243   -222086.7182       154.8738          -3040.7439     -2596.5495    921491.4634     -3040.7439     -2596.5495

ENERGY:     198     21224.0061     18800.3007      5711.3574       186.3640        -333385.4999     21161.1533         0.0000         0.0000     43911.2863        -222391.0322       159.7372   -266302.3185   -222090.4394       159.7372          -4381.6810     -2646.7680    921491.4634     -4381.6810     -2646.7680

ENERGY:     199     20113.4048     18634.4040      5710.3429       188.2374        -334151.8587     21182.1776         0.0000         0.0000     45722.9588        -222600.3332       166.3276   -268323.2920   -222093.2753       166.3276          -5152.2286     -2691.5412    921491.4634     -5152.2286     -2691.5412

LDB: ============= START OF LOAD BALANCING ============== 101.296
LDB: Largest compute 200 load 0.426026 is 1.2% of average load 36.588303
LDB: Average compute 0.051250 is 0.1% of average load 36.588303
LDB: TIME 101.298 LOAD: AVG 36.5883 MAX 37.6446  PROXIES: TOTAL 112 MAXPE 28 MAXPATCH 1 None MEM: 3222.59 MB
LDB: TIME 101.3 LOAD: AVG 36.5883 MAX 37.5248  PROXIES: TOTAL 112 MAXPE 28 MAXPATCH 1 TorusLB MEM: 3222.59 MB
LDB: ============== END OF LOAD BALANCING =============== 101.302
Info: useSync: 1 useProxySync: 0
LDB: =============== DONE WITH MIGRATION ================ 101.305
Info: Initial time: 4 CPUs 0.470709 s/step 5.44803 days/ns 3223.65 MB memory
TIMING: 200  CPU: 95.3987, 0.470376/step  Wall: 95.3987, 0.470376/step, 0.039198 hours remaining, 3223.652344 MB of memory in use.
ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     200     21073.6836     18595.6349      5711.8747       190.0258        -334670.2810     21209.9247         0.0000         0.0000     45319.1600        -222569.9773       164.8586   -267889.1374   -222114.5246       164.8586          -5241.8525     -2703.6813    921491.4634     -5241.8525     -2703.6813

ENERGY:     201     23380.1028     18674.3332      5716.2802       191.4189        -334751.7129     21239.1340         0.0000         0.0000     43222.4695        -222327.9744       157.2315   -265550.4439   -222100.1080       157.2315          -4546.2003     -2661.1901    921491.4634     -4546.2003     -2661.1901

ENERGY:     202     23622.8115     18850.8448      5722.5980       192.1474        -334305.3003     21243.2751         0.0000         0.0000     42432.5587        -222241.0649       154.3580   -264673.6236   -222096.8292       154.3580          -3005.0517     -2588.0014    921491.4634     -3005.0517     -2588.0014

ENERGY:     203     20743.8944     19130.0388      5729.2400       192.0764        -333501.9370     21215.8253         0.0000         0.0000     44059.6985        -222431.1636       160.2771   -266490.8621   -222093.6428       160.2771          -1046.8257     -2512.4435    921491.4634     -1046.8257     -2512.4435

ENERGY:     204     17862.6124     19486.9554      5734.1463       191.2124        -332722.2196     21188.8402         0.0000         0.0000     45629.4718        -222628.9811       165.9875   -268258.4529   -222116.7003       165.9875            452.9933     -2462.2929    921491.4634       452.9933     -2462.2929

ENERGY:     205     18189.0791     19868.9412      5735.7153       189.6741        -332398.2549     21197.9185         0.0000         0.0000     44690.7148        -222526.2119       162.5725   -267216.9267   -222099.8062       162.5725            731.8534     -2447.6353    921491.4634       731.8534     -2447.6353

ENERGY:     206     20668.8902     20170.9984      5732.9811       187.6404        -332716.3433     21241.8390         0.0000         0.0000     42439.0584        -222274.9358       154.3816   -264713.9942   -222100.3399       154.3816           -230.6569     -2488.2937    921491.4634      -230.6569     -2488.2937

ENERGY:     207     21693.8033     20338.2889      5726.5434       185.3060        -333603.9791     21289.9000         0.0000         0.0000     42143.6913        -222226.4461       153.3072   -264370.1374   -222103.0934       153.3072          -1896.3479     -2585.9683    921491.4634     -1896.3479     -2585.9683

ENERGY:     208     20293.2704     20371.8903      5718.1572       182.8654        -334789.2378     21322.2409         0.0000         0.0000     44428.6269        -222472.1868       161.6191   -266900.8137   -222122.6317       161.6191          -3669.0644     -2719.7953    921491.4634     -3669.0644     -2719.7953

ENERGY:     209     19428.8171     20325.0059      5710.3389       180.5135        -335910.2414     21349.5043         0.0000         0.0000     46273.6800        -222642.3818       168.3309   -268916.0618   -222106.7903       168.3309          -5197.7275     -2836.6307    921491.4634     -5197.7275     -2836.6307

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

ENERGY:     210     21385.1734     20194.2569      5705.3139       178.4614        -336615.7769     21385.1095         0.0000         0.0000     45251.4334        -222516.0284       164.6123   -267767.4618   -222108.2019       164.6123          -6091.3663     -2896.2628    921491.4634     -6091.3663     -2896.2628

ENERGY:     211     24099.1927     19985.8633      5704.9373       176.9105        -336667.8928     21415.1476         0.0000         0.0000     43031.7285        -222254.1131       156.5376   -265285.8416   -222106.8544       156.5376          -5900.2977     -2885.1011    921491.4634     -5900.2977     -2885.1011

ENERGY:     212     23739.2708     19730.8224      5710.0295       176.0352        -336013.6227     21412.5982         0.0000         0.0000     42995.1637        -222249.7028       156.4046   -265244.8665   -222104.2320       156.4046          -4424.1001     -2820.3211    921491.4634     -4424.1001     -2820.3211

ENERGY:     213     20150.2159     19524.5251      5720.1722       175.9508        -334874.6443     21380.5551         0.0000         0.0000     45418.7804        -222504.4449       165.2210   -267923.2253   -222097.3837       165.2210          -2174.3116     -2725.0841    921491.4634     -2174.3116     -2725.0841

ENERGY:     214     17315.5528     19421.7450      5733.3059       176.6827        -333645.3936     21358.4485         0.0000         0.0000     46958.4701        -222681.1887       170.8220   -269639.6587   -222093.7409       170.8220           -143.6685     -2626.0578    921491.4634      -143.6685     -2626.0578

ENERGY:     215     18210.5055     19441.9745      5746.5772       178.1492        -332787.3323     21379.5595         0.0000         0.0000     45302.6744        -222527.8919       164.7987   -267830.5663   -222091.0449       164.7987            784.0014     -2554.0368    921491.4634       784.0014     -2554.0368

ENERGY:     216     20973.4717     19522.5063      5756.9571       180.1770        -332560.1062     21436.4835         0.0000         0.0000     42442.1786        -222248.3319       154.3930   -264690.5105   -222073.6157       154.3930            420.9900     -2541.5428    921491.4634       420.9900     -2541.5428

ENERGY:     217     21778.3868     19581.4821      5762.2416       182.5517        -333010.6758     21497.2705         0.0000         0.0000     41983.6748        -222225.0684       152.7251   -264208.7432   -222064.4466       152.7251           -882.1700     -2598.7244    921491.4634      -882.1700     -2598.7244

ENERGY:     218     20165.9158     19540.0891      5761.2415       184.9927        -333856.1146     21546.6560         0.0000         0.0000     44178.6834        -222478.5362       160.7099   -266657.2196   -222068.8156       160.7099          -2628.0653     -2703.9746    921491.4634     -2628.0653     -2703.9746

ENERGY:     219     19429.8640     19413.3931      5754.3577       187.2447        -334778.0707     21596.8808         0.0000         0.0000     45751.9296        -222644.4008       166.4329   -268396.3304   -222073.1721       166.4329          -4457.7333     -2810.5237    921491.4634     -4457.7333     -2810.5237

TIMING: 220  CPU: 104.812, 0.470666/step  Wall: 104.812, 0.470666/step, 0.0366073 hours remaining, 3223.652344 MB of memory in use.
ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     220     21580.9144     19260.1135      5743.1672       189.1021        -335473.8430     21655.3184         0.0000         0.0000     44539.5737        -222505.6538       162.0227   -267045.2275   -222092.6292       162.0227          -5898.3512     -2876.6577    921491.4634     -5898.3512     -2876.6577

ENERGY:     221     24234.7390     19146.8277      5730.1601       190.4777        -335718.7272     21699.4244         0.0000         0.0000     42467.0187        -222250.0796       154.4833   -264717.0983   -222077.7838       154.4833          -6342.7097     -2884.3552    921491.4634     -6342.7097     -2884.3552

ENERGY:     222     23735.1223     19085.7306      5717.7679       191.2893        -335388.9911     21700.3076         0.0000         0.0000     42702.0388        -222256.7346       155.3383   -264958.7734   -222075.6641       155.3383          -5368.7278     -2838.7017    921491.4634     -5368.7278     -2838.7017

ENERGY:     223     20286.4335     19110.8424      5708.3528       191.5578        -334633.3910     21665.5242         0.0000         0.0000     45168.7530        -222501.9272       164.3115   -267670.6803   -222072.2460       164.3115          -3322.8075     -2753.9475    921491.4634     -3322.8075     -2753.9475

ENERGY:     224     17721.9817     19276.3015      5703.4615       191.3517        -333831.1557     21637.4892         0.0000         0.0000     46650.8780        -222649.6920       169.7031   -269300.5700   -222098.2850       169.7031          -1151.0969     -2650.6854    921491.4634     -1151.0969     -2650.6854

ENERGY:     225     18451.5608     19639.7347      5703.5482       190.8347        -333424.4647     21647.4588         0.0000         0.0000     45301.5805        -222489.7472       164.7947   -267791.3276   -222079.9383       164.7947            226.2573     -2563.9720    921491.4634       226.2573     -2563.9720

ENERGY:     226     20569.7732     20147.6374      5707.2430       190.0457        -333606.5695     21686.9380         0.0000         0.0000     43034.1676        -222270.7646       156.5465   -265304.9323   -222078.6807       156.5465            530.9031     -2526.3324    921491.4634       530.9031     -2526.3324

ENERGY:     227     21011.1677     20670.4532      5712.3895       189.0770        -334317.7222     21728.2283         0.0000         0.0000     42721.7943        -222284.6122       155.4101   -265006.4065   -222080.2101       155.4101           -104.6491     -2553.6075    921491.4634      -104.6491     -2553.6075

ENERGY:     228     19866.2929     21035.8345      5716.6482       188.0081        -335312.4267     21761.2923         0.0000         0.0000     44242.5383        -222501.8125       160.9422   -266744.3508   -222102.7894       160.9422          -1440.0183     -2625.9673    921491.4634     -1440.0183     -2625.9673

ENERGY:     229     19874.0813     21137.5589      5718.5477       187.0043        -336264.4468     21796.8119         0.0000         0.0000     44976.5834        -222573.8592       163.6124   -267550.4426   -222086.0491       163.6124          -3234.4608     -2710.7215    921491.4634     -3234.4608     -2710.7215

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

ENERGY:     230     21999.2455     20926.2540      5717.1889       185.9786        -336838.6565     21834.6449         0.0000         0.0000     43751.0550        -222424.2895       159.1543   -266175.3445   -222088.6910       159.1543          -4902.3780     -2766.0557    921491.4634     -4902.3780     -2766.0557

ENERGY:     231     23806.6617     20470.3275      5713.0793       184.9073        -336794.0752     21849.7233         0.0000         0.0000     42506.4013        -222262.9748       154.6266   -264769.3761   -222089.4823       154.6266          -5730.6841     -2773.7615    921491.4634     -5730.6841     -2773.7615

ENERGY:     232     22812.6530     19886.6603      5707.7133       183.7520        -336072.1015     21820.0135         0.0000         0.0000     43315.5692        -222345.7403       157.5701   -265661.3095   -222098.2756       157.5701          -5301.5936     -2731.4986    921491.4634     -5301.5936     -2731.4986

ENERGY:     233     20035.6403     19318.2044      5703.4910       182.6157        -334889.2831     21760.7375         0.0000         0.0000     45350.0987        -222538.4954       164.9712   -267888.5941   -222089.6823       164.9712          -3899.2116     -2646.7387    921491.4634     -3899.2116     -2646.7387

ENERGY:     234     18553.6065     18856.0076      5702.3325       181.3395        -333642.4872     21712.9297         0.0000         0.0000     46049.0873        -222587.1841       167.5139   -268636.2713   -222086.3331       167.5139          -2187.7192     -2534.9737    921491.4634     -2187.7192     -2534.9737

ENERGY:     235     19419.0964     18603.4161      5705.8180       179.9133        -332789.1749     21702.6095         0.0000         0.0000     44750.4957        -222427.8258       162.7900   -267178.3216   -222083.1205       162.7900           -820.1736     -2429.4349    921491.4634      -820.1736     -2429.4349

ENERGY:     236     20566.0778     18629.1000      5714.2865       178.3391        -332585.8845     21721.5011         0.0000         0.0000     43477.4012        -222299.1788       158.1588   -265776.5800   -222073.0119       158.1588           -108.6483     -2371.7043    921491.4634      -108.6483     -2371.7043

ENERGY:     237     20196.0058     18940.2030      5726.8243       176.7459        -333068.3182     21749.0155         0.0000         0.0000     43898.3778        -222381.1460       159.6902   -266279.5238   -222063.3605       159.6902           -172.1588     -2373.2011    921491.4634      -172.1588     -2373.2011

ENERGY:     238     19419.4413     19404.0882      5740.6977       175.0128        -333964.3147     21778.9042         0.0000         0.0000     44901.2435        -222544.9270       163.3384   -267446.1706   -222065.9778       163.3384           -987.6014     -2425.5309    921491.4634      -987.6014     -2425.5309

ENERGY:     239     20428.8616     19846.5437      5752.8836       173.1946        -334966.8372     21816.7508         0.0000         0.0000     44416.4632        -222532.1398       161.5749   -266948.6030   -222068.9825       161.5749          -2385.1781     -2499.0795    921491.4634     -2385.1781     -2499.0795

TIMING: 240  CPU: 114.218, 0.470277/step  Wall: 114.218, 0.470277/step, 0.0339644 hours remaining, 3223.652344 MB of memory in use.
ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     240     22861.0420     20119.9132      5760.6909       171.4213        -335766.3620     21854.4252         0.0000         0.0000     42641.4774        -222357.3921       155.1180   -264998.8694   -222074.0954       155.1180          -3844.9084     -2568.3896    921491.4634     -3844.9084     -2568.3896

ENERGY:     241     23920.0052     20195.4870      5762.7124       169.9828        -336129.3246     21865.1031         0.0000         0.0000     41957.8933        -222258.1408       152.6313   -264216.0341   -222063.9160       152.6313          -4724.4491     -2616.3453    921491.4634     -4724.4491     -2616.3453

ENERGY:     242     22110.7715     20111.8206      5758.5348       169.0441        -335904.8190     21831.0566         0.0000         0.0000     43526.8717        -222396.7197       158.3388   -265923.5914   -222063.5737       158.3388          -4623.1687     -2633.0913    921491.4634     -4623.1687     -2633.0913

ENERGY:     243     19462.3619     19969.6442      5749.3614       168.8705        -335233.7062     21770.4747         0.0000         0.0000     45537.0688        -222575.9247       165.6513   -268112.9935   -222061.6675       165.6513          -3760.4504     -2614.6992    921491.4634     -3760.4504     -2614.6992

ENERGY:     244     18822.2463     19849.3932      5737.4544       169.6534        -334482.6006     21720.5675         0.0000         0.0000     45629.1661        -222554.1196       165.9864   -268183.2857   -222078.7773       165.9864          -2667.7297     -2573.2149    921491.4634     -2667.7297     -2573.2149

ENERGY:     245     20148.2368     19811.7598      5725.7785       171.4559        -334087.5944     21701.2469         0.0000         0.0000     44168.5246        -222360.5919       160.6730   -266529.1166   -222068.6368       160.6730          -1771.6901     -2533.5454    921491.4634     -1771.6901     -2533.5454

ENERGY:     246     20878.5482     19853.7024      5716.8932       174.1558        -334213.1205     21705.0849         0.0000         0.0000     43600.4180        -222284.3180       158.6063   -265884.7360   -222067.4298       158.6063          -1173.7930     -2523.3912    921491.4634     -1173.7930     -2523.3912

ENERGY:     247     19868.5288     19979.6441      5712.7400       177.5412        -334802.1842     21719.8453         0.0000         0.0000     44912.1910        -222431.6939       163.3782   -267343.8848   -222068.1396       163.3782           -983.0001     -2552.5930    921491.4634      -983.0001     -2552.5930

ENERGY:     248     19035.4925     20164.4298      5713.8450       181.3144        -335623.1354     21746.4309         0.0000         0.0000     46185.9360        -222595.6867       168.0117   -268781.6227   -222090.3129       168.0117          -1359.1247     -2608.3066    921491.4634     -1359.1247     -2608.3066

ENERGY:     249     20484.3305     20353.6196      5719.1623       185.0800        -336433.0068     21788.9032         0.0000         0.0000     45370.8151        -222531.0961       165.0466   -267901.9112   -222082.9713       165.0466          -2308.0287     -2671.2386    921491.4634     -2308.0287     -2671.2386

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

ENERGY:     250     23155.2056     20422.5259      5726.1009       188.5682        -336907.4410     21832.9287         0.0000         0.0000     43252.1658        -222329.9459       157.3395   -265582.1117   -222084.2880       157.3395          -3365.2095     -2722.3880    921491.4634     -3365.2095     -2722.3880

ENERGY:     251     24002.1398     20302.5998      5731.6573       191.5295        -336816.8449     21849.8671         0.0000         0.0000     42475.2391        -222263.8122       154.5132   -264739.0514   -222084.8991       154.5132          -3958.0339     -2753.0724    921491.4634     -3958.0339     -2753.0724

ENERGY:     252     21994.9041     20013.1600      5733.2541       193.8023        -336093.2677     21826.9294         0.0000         0.0000     43905.3720        -222425.8458       159.7157   -266331.2178   -222091.3307       159.7157          -3843.4681     -2758.0339    921491.4634     -3843.4681     -2758.0339

ENERGY:     253     19499.8636     19667.1123      5729.5496       195.2411        -334977.1807     21784.0535         0.0000         0.0000     45520.0193        -222581.3414       165.5893   -268101.3607   -222082.7207       165.5893          -3300.1272     -2735.8132    921491.4634     -3300.1272     -2735.8132

ENERGY:     254     19073.0880     19348.2296      5720.5008       195.9622        -333839.8798     21752.6522         0.0000         0.0000     45220.9196        -222528.5273       164.5013   -267749.4470   -222080.4688       164.5013          -2707.1336     -2696.1701    921491.4634     -2707.1336     -2696.1701

ENERGY:     255     20324.2311     19109.4101      5707.6062       196.0620        -333099.9233     21746.1513         0.0000         0.0000     43667.4213        -222349.0412       158.8501   -266016.4624   -222078.3977       158.8501          -2282.5425     -2662.7815    921491.4634     -2282.5425     -2662.7815

ENERGY:     256     20899.4411     18950.9577      5693.4518       195.6570        -332975.5973     21757.6846         0.0000         0.0000     43181.1612        -222297.2439       157.0812   -265478.4052   -222071.2741       157.0812          -2042.2410     -2664.5199    921491.4634     -2042.2410     -2664.5199

ENERGY:     257     20029.5654     18878.1872      5681.1759       194.7976        -333481.0039     21780.2417         0.0000         0.0000     44488.5468        -222428.4892       161.8371   -266917.0361   -222060.1685       161.8371          -2035.5364     -2692.1442    921491.4634     -2035.5364     -2692.1442

ENERGY:     258     19453.5867     18882.0665      5673.2911       193.6684        -334373.1544     21817.5076         0.0000         0.0000     45796.2578        -222556.7764       166.5942   -268353.0342   -222062.0609       166.5942          -2331.2330     -2737.1920    921491.4634     -2331.2330     -2737.1920

ENERGY:     259     20717.7708     18984.1027      5671.3007       192.3773        -335369.5276     21871.0064         0.0000         0.0000     45431.1555        -222501.8140       165.2661   -267932.9696   -222063.7308       165.2661          -2890.3672     -2780.4961    921491.4634     -2890.3672     -2780.4961

TIMING: 260  CPU: 123.613, 0.469791/step  Wall: 123.613, 0.469791/step, 0.0313194 hours remaining, 3223.960938 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     22744.9542     19188.2460      5675.1875       191.0393        -336169.7724     21924.7891         0.0000         0.0000     44083.4305        -222362.1256       160.3634   -266445.5562   -222069.6813       160.3634          -3407.4793     -2810.9878    921491.4634     -3407.4793     -2810.9878

ENERGY:     261     23215.5572     19485.4653      5683.6413       189.7700        -336523.9795     21953.3900         0.0000         0.0000     43676.0233        -222320.1323       158.8814   -265996.1556   -222052.8237       158.8814          -3555.3694     -2822.8648    921491.4634     -3555.3694     -2822.8648

ENERGY:     262     21606.2723     19814.6775      5694.0656       188.7122        -336291.7854     21947.6072         0.0000         0.0000     44601.6346        -222438.8160       162.2485   -267040.4506   -222052.4323       162.2485          -3214.7559     -2810.4637    921491.4634     -3214.7559     -2810.4637

ENERGY:     263     19781.1227     20140.5621      5703.8103       187.9445        -335614.9709     21924.4738         0.0000         0.0000     45349.7771        -222527.2804       164.9700   -267877.0575   -222051.1547       164.9700          -2647.8114     -2773.3903    921491.4634     -2647.8114     -2773.3903

ENERGY:     264     19385.2259     20436.4305      5710.6950       187.5052        -334855.9510     21907.7771         0.0000         0.0000     44751.4783        -222476.8391       162.7936   -267228.3173   -222069.1985       162.7936          -2191.1926     -2723.5294    921491.4634     -2191.1926     -2723.5294

ENERGY:     265     19946.8415     20681.9926      5713.6241       187.4392        -334395.6632     21906.0162         0.0000         0.0000     43607.6372        -222352.1123       158.6326   -265959.7495   -222054.3374       158.6326          -2038.0573     -2683.6035    921491.4634     -2038.0573     -2683.6035

ENERGY:     266     20048.7900     20788.8702      5712.1327       187.6137        -334399.4578     21914.4804         0.0000         0.0000     43399.3794        -222348.1914       157.8750   -265747.5708   -222054.3637       157.8750          -2130.7242     -2664.5956    921491.4634     -2130.7242     -2664.5956

ENERGY:     267     19648.0906     20691.2681      5707.0583       187.8501        -334831.4858     21930.8373         0.0000         0.0000     44220.2166        -222446.1648       160.8610   -266666.3814   -222055.6587       160.8610          -2435.4236     -2662.6783    921491.4634     -2435.4236     -2662.6783

ENERGY:     268     19962.9161     20375.7518      5700.1930       187.9286        -335513.7451     21959.1256         0.0000         0.0000     44823.5375        -222504.2925       163.0557   -267327.8300   -222075.9876       163.0557          -2903.2126     -2658.6181    921491.4634     -2903.2126     -2658.6181

ENERGY:     269     21396.7813     19927.1704      5694.0390       187.7639        -336221.0663     21997.2160         0.0000         0.0000     44586.5097        -222431.5859       162.1935   -267018.0956   -222066.1974       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     22620.1933     19450.9169      5690.3173       187.1618        -336650.6775     22028.8070         0.0000         0.0000     44308.0074        -222365.2738       161.1804   -266673.2812   -222067.0435       161.1804          -3583.3634     -2617.7583    921491.4634     -3583.3634     -2617.7583

ENERGY:     271     22345.5822     19078.8066      5690.0209       186.1610        -336571.7891     22035.2500         0.0000         0.0000     44829.4471        -222406.5212       163.0772   -267235.9683   -222066.8387       163.0772          -3261.2174     -2569.2622    921491.4634     -3261.2174     -2569.2622

ENERGY:     272     21021.5583     18896.0662      5692.8269       184.9335        -335921.4615     22015.0579         0.0000         0.0000     45607.7076        -222503.3112       165.9083   -268111.0188   -222081.1574       165.9083          -2551.9683     -2501.8805    921491.4634     -2551.9683     -2501.8805

ENERGY:     273     20123.2134     18932.9080      5697.5118       183.8526        -334925.7012     21985.5295         0.0000         0.0000     45502.7161        -222499.9697       165.5264   -268002.6858   -222069.0461       165.5264          -1837.1974     -2434.6760    921491.4634     -1837.1974     -2434.6760

ENERGY:     274     20074.7416     19121.4861      5701.6806       183.0070        -333931.6257     21965.2976         0.0000         0.0000     44478.5175        -222406.8954       161.8006   -266885.4128   -222066.8030       161.8006          -1366.5213     -2384.6634    921491.4634     -1366.5213     -2384.6634

ENERGY:     275     20005.4318     19374.0679      5703.3424       182.5376        -333318.5603     21960.8299         0.0000         0.0000     43741.9681        -222350.3826       159.1213   -266092.3507   -222065.7694       159.1213          -1269.7932     -2374.8869    921491.4634     -1269.7932     -2374.8869

ENERGY:     276     19401.8503     19594.7506      5701.2547       182.4904        -333292.1282     21971.0409         0.0000         0.0000     44028.5270        -222412.2143       160.1637   -266440.7413   -222072.9397       160.1637          -1580.1301     -2417.6040    921491.4634     -1580.1301     -2417.6040

ENERGY:     277     19149.2973     19724.7158      5695.5210       182.9396        -333864.3455     21997.2387         0.0000         0.0000     44632.8110        -222481.8220       162.3619   -267114.6331   -222061.0991       162.3619          -2311.7546     -2498.0545    921491.4634     -2311.7546     -2498.0545

ENERGY:     278     20199.4577     19713.7758      5686.9122       183.6585        -334821.1004     22041.3359         0.0000         0.0000     44532.2540        -222463.7064       161.9961   -266995.9604   -222063.4134       161.9961          -3254.8157     -2593.7696    921491.4634     -3254.8157     -2593.7696

ENERGY:     279     21984.3649     19593.9429      5677.5176       184.5187        -335888.5802     22096.4199         0.0000         0.0000     43975.0880        -222376.7282       159.9693   -266351.8162   -222065.2026       159.9693          -4044.3213     -2682.8389    921491.4634     -4044.3213     -2682.8389

TIMING: 280  CPU: 132.992, 0.46895/step  Wall: 132.992, 0.46895/step, 0.0286581 hours remaining, 3223.960938 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     22859.3230     19458.4364      5670.0026       185.3899        -336752.6633     22145.1354         0.0000         0.0000     44066.7339        -222367.6421       160.3027   -266434.3760   -222073.4249       160.3027          -4286.3893     -2748.0546    921491.4634     -4286.3893     -2748.0546

ENERGY:     281     22172.5958     19445.1181      5667.0588       186.2206        -337154.6804     22172.1191         0.0000         0.0000     45063.2424        -222448.3255       163.9277   -267511.5679   -222064.8521       163.9277          -3881.2950     -2782.5902    921491.4634     -3881.2950     -2782.5902

ENERGY:     282     20943.7897     19615.5378      5669.9796       186.8360        -336942.5036     22176.7654         0.0000         0.0000     45823.3371        -222526.2580       166.6927   -268349.5951   -222063.3318       166.6927          -2992.3271     -2779.3668    921491.4634     -2992.3271     -2779.3668

ENERGY:     283     20432.1059     19966.6615      5678.8137       187.1634        -336251.9203     22171.0648         0.0000         0.0000     45328.8522        -222487.2589       164.8939   -267816.1111   -222060.8462       164.8939          -2008.7736     -2748.2306    921491.4634     -2008.7736     -2748.2306

ENERGY:     284     20506.3998     20401.8823      5692.0830       187.1346        -335412.6304     22166.2909         0.0000         0.0000     44071.4481        -222387.3916       160.3198   -266458.8397   -222061.5542       160.3198          -1267.2791     -2712.3902    921491.4634     -1267.2791     -2712.3902

ENERGY:     285     20203.3288     20789.9631      5707.3565       186.7145        -334827.1971     22167.0165         0.0000         0.0000     43418.2630        -222354.5547       157.9437   -265772.8177   -222053.5969       157.9437          -1010.8439     -2700.0821    921491.4634     -1010.8439     -2700.0821

ENERGY:     286     19396.6311     20966.5625      5721.5032       185.8229        -334658.1155     22176.6862         0.0000         0.0000     43785.6882        -222425.2214       159.2803   -266210.9096   -222054.0584       159.2803          -1306.7504     -2717.2848    921491.4634     -1306.7504     -2717.2848

ENERGY:     287     19176.1192     20856.7826      5731.9346       184.4714        -334918.1487     22200.2910         0.0000         0.0000     44282.9438        -222485.6061       161.0892   -266768.5500   -222055.7255       161.0892          -2148.9614     -2753.3345    921491.4634     -2148.9614     -2753.3345

ENERGY:     288     20263.2089     20475.2854      5736.9558       182.7335        -335468.3155     22237.9037         0.0000         0.0000     44116.9906        -222455.2377       160.4855   -266572.2283   -222066.9055       160.4855          -3310.5880     -2790.1554    921491.4634     -3310.5880     -2790.1554

ENERGY:     289     21886.4835     19928.6981      5736.1905       180.7560        -336126.9128     22279.0689         0.0000         0.0000     43733.4514        -222382.2643       159.0903   -266115.7157   -222062.2726       159.0903          -4368.9815     -2809.8750    921491.4634     -4368.9815     -2809.8750

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     19325.5267      5730.3279       178.6973        -336571.4578     22308.2174         0.0000         0.0000     44027.4235        -222385.2804       160.1597   -266412.7040   -222063.4686       160.1597          -4815.3286     -2796.0390    921491.4634     -4815.3286     -2796.0390

ENERGY:     291     22115.7702     18802.2910      5721.4122       176.7646        -336554.3560     22315.5629         0.0000         0.0000     44963.0866        -222459.4685       163.5634   -267422.5551   -222063.1776       163.5634          -4450.6673     -2738.1109    921491.4634     -4450.6673     -2738.1109

ENERGY:     292     21262.5908     18472.4016      5712.2431       175.1751        -335987.2699     22302.8783         0.0000         0.0000     45560.3454        -222501.6356       165.7360   -268061.9810   -222072.5162       165.7360          -3435.4154     -2639.3512    921491.4634     -3435.4154     -2639.3512

ENERGY:     293     20783.4660     18411.7342      5705.7252       174.1484        -335092.9704     22279.1181         0.0000         0.0000     45283.4160        -222455.3626       164.7286   -267738.7786   -222061.5455       164.7286          -2166.7335     -2517.2544    921491.4634     -2166.7335     -2517.2544

ENERGY:     294     20398.6128     18589.6435      5703.5791       173.8101        -334179.1785     22254.0799         0.0000         0.0000     44662.2337        -222397.2194       162.4689   -267059.4530   -222058.8852       162.4689          -1006.6042     -2405.5592    921491.4634     -1006.6042     -2405.5592

ENERGY:     295     19706.6743     18924.3581      5706.2255       174.2141        -333602.5013     22236.6568         0.0000         0.0000     44449.5910        -222404.7815       161.6954   -266854.3725   -222057.5862       161.6954           -311.5567     -2335.1538    921491.4634      -311.5567     -2335.1538

ENERGY:     296     19122.8992     19301.4531      5712.5929       175.3096        -333576.4725     22236.1188         0.0000         0.0000     44573.6028        -222454.4961       162.1465   -267028.0989   -222067.3940       162.1465           -347.2084     -2322.9740    921491.4634      -347.2084     -2322.9740

ENERGY:     297     19439.7490     19641.8015      5720.7182       176.9777        -334148.9752     22258.2524         0.0000         0.0000     44466.2677        -222445.2088       161.7561   -266911.4765   -222050.8189       161.7561          -1189.5388     -2359.0875    921491.4634     -1189.5388     -2359.0875

ENERGY:     298     20578.5047     19886.6662      5727.8935       178.9488        -335137.5238     22299.1410         0.0000         0.0000     44067.5343        -222398.8353       160.3056   -266466.3696   -222053.6277       160.3056          -2519.0814     -2427.9309    921491.4634     -2519.0814     -2427.9309

ENERGY:     299     21598.9656     20050.9658      5731.9440       180.9390        -336266.8202     22346.0657         0.0000         0.0000     43977.6320        -222380.3080       159.9785   -266357.9400   -222056.3730       159.9785          -3820.1264     -2506.2687    921491.4634     -3820.1264     -2506.2687

LDB: ============= START OF LOAD BALANCING ============== 148.291
LDB: Largest compute 200 load 0.522150 is 1.1% of average load 45.701969
LDB: Average compute 0.064028 is 0.1% of average load 45.701969
LDB: TIME 148.293 LOAD: AVG 45.702 MAX 46.9866  PROXIES: TOTAL 112 MAXPE 28 MAXPATCH 1 None MEM: 3224.16 MB
LDB: TIME 148.294 LOAD: AVG 45.702 MAX 46.9866  PROXIES: TOTAL 112 MAXPE 28 MAXPATCH 1 RefineTorusLB MEM: 3224.16 MB
LDB: TIME 148.309 LOAD: AVG 45.702 MAX 46.2254  PROXIES: TOTAL 113 MAXPE 29 MAXPATCH 1 RefineTorusLB MEM: 3224.16 MB
LDB: ============== END OF LOAD BALANCING =============== 148.31
Info: useSync: 1 useProxySync: 0
LDB: =============== DONE WITH MIGRATION ================ 148.311
Info: Initial time: 4 CPUs 0.469555 s/step 5.43467 days/ns 3224.16 MB memory
TIMING: 300  CPU: 142.374, 0.469103/step  Wall: 142.374, 0.469103/step, 0.0260613 hours remaining, 3224.160156 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     21869.9882     20174.1888      5731.6694       182.6816        -337209.9029     22385.4779         0.0000         0.0000     44423.7995        -222442.0975       161.6016   -266865.8970   -222076.5871       161.6016          -4600.9408     -2563.6018    921491.4634     -4600.9408     -2563.6018

ENERGY:     301     21754.7697     20299.7851      5727.3852       184.0330        -337665.0999     22409.6626         0.0000         0.0000     44817.7466        -222471.7176       163.0346   -267289.4642   -222059.2470       163.0346          -4657.8462     -2584.2292    921491.4634     -4657.8462     -2584.2292

ENERGY:     302     21723.0645     20395.7907      5720.2599       184.8676        -337483.0151     22416.9291         0.0000         0.0000     44599.2670        -222442.8362       162.2399   -267042.1032   -222057.3401       162.2399          -3958.8647     -2554.2736    921491.4634     -3958.8647     -2554.2736

ENERGY:     303     21512.5327     20430.0801      5712.5286       185.2198        -336784.9549     22409.2048         0.0000         0.0000     44154.6909        -222380.6981       160.6226   -266535.3890   -222054.2090       160.6226          -2717.2716     -2487.9821    921491.4634     -2717.2716     -2487.9821

ENERGY:     304     20579.5056     20379.6045      5706.6112       185.2163        -335895.7346     22392.3086         0.0000         0.0000     44259.5531        -222392.9352       161.0041   -266652.4884   -222063.7240       161.0041          -1310.8209     -2411.5371    921491.4634     -1310.8209     -2411.5371

ENERGY:     305     19294.2489     20267.1926      5704.5649       185.0761        -335184.3679     22377.9875         0.0000         0.0000     44903.5551        -222451.7429       163.3468   -267355.2979   -222049.0632       163.3468           -285.4665     -2359.8439    921491.4634      -285.4665     -2359.8439

ENERGY:     306     18813.6234     20091.4462      5706.8791       184.8700        -334861.4718     22380.1169         0.0000         0.0000     45195.6071        -222488.9291       164.4092   -267684.5361   -222048.9456       164.4092            -34.4476     -2342.9901    921491.4634       -34.4476     -2342.9901

ENERGY:     307     19699.8291     19880.2871      5712.8835       184.6555        -334994.2785     22404.6078         0.0000         0.0000     44676.1365        -222435.8791       162.5195   -267112.0156   -222050.4566       162.5195           -686.7126     -2362.0197    921491.4634      -686.7126     -2362.0197

ENERGY:     308     21066.5789     19666.1168      5720.7563       184.4262        -335495.7182     22443.3090         0.0000         0.0000     44039.4396        -222375.0913       160.2034   -266414.5309   -222060.2283       160.2034          -1960.6043     -2406.6006    921491.4634     -1960.6043     -2406.6006

ENERGY:     309     21696.0235     19507.1879      5728.2464       184.2113        -336171.4700     22480.8020         0.0000         0.0000     44190.3410        -222384.6579       160.7523   -266574.9989   -222050.0297       160.7523          -3383.0056     -2467.8899    921491.4634     -3383.0056     -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     21508.7275     19421.0239      5732.7586       183.9063        -336693.8612     22505.8456         0.0000         0.0000     44871.0068        -222470.5925       163.2284   -267341.5994   -222052.4940       163.2284          -4424.6314     -2515.2222    921491.4634     -4424.6314     -2515.2222

ENERGY:     311     21459.6722     19421.2607      5732.5580       183.4896        -336798.7867     22515.0559         0.0000         0.0000     44986.9609        -222499.7894       163.6502   -267486.7503   -222053.3070       163.6502          -4795.7694     -2523.0992    921491.4634     -4795.7694     -2523.0992

ENERGY:     312     21894.2736     19475.0867      5727.0397       182.9545        -336390.8679     22507.7148         0.0000         0.0000     44171.5551        -222432.2434       160.6840   -266603.7985   -222064.5096       160.6840          -4390.5734     -2479.7746    921491.4634     -4390.5734     -2479.7746

ENERGY:     313     21935.6982     19529.7470      5717.1322       182.3602        -335633.4777     22483.0129         0.0000         0.0000     43439.9891        -222345.5380       158.0227   -265785.5271   -222050.9857       158.0227          -3324.4413     -2406.1160    921491.4634     -3324.4413     -2406.1160

ENERGY:     314     20774.0372     19507.1855      5704.6248       181.6523        -334801.1007     22445.5163         0.0000         0.0000     43813.5138        -222374.5708       159.3815   -266188.0846   -222048.2694       159.3815          -1862.2382     -2326.9766    921491.4634     -1862.2382     -2326.9766

ENERGY:     315     19161.1204     19408.2594      5692.2116       180.8666        -334233.4705     22410.8357         0.0000         0.0000     44907.4429        -222472.7339       163.3609   -267380.1768   -222046.1401       163.3609           -549.3942     -2270.2360    921491.4634      -549.3942     -2270.2360

ENERGY:     316     18669.4293     19303.6206      5682.5271       180.0732        -334172.3647     22398.3988         0.0000         0.0000     45428.4349        -222509.8807       165.2562   -267938.3157   -222062.0712       165.2562             64.5860     -2251.8060    921491.4634        64.5860     -2251.8060

ENERGY:     317     19739.5967     19309.4451      5677.5265       179.4130        -334705.9341     22416.0668         0.0000         0.0000     44959.2156        -222424.6704       163.5493   -267383.8859   -222046.6271       163.5493           -296.1491     -2282.4175    921491.4634      -296.1491     -2282.4175

ENERGY:     318     21109.3876     19471.3043      5677.4840       178.9393        -335675.6979     22454.1808         0.0000         0.0000     44425.4200        -222358.9819       161.6075   -266784.4020   -222048.7807       161.6075          -1378.4203     -2356.1402    921491.4634     -1378.4203     -2356.1402

ENERGY:     319     21567.4386     19787.0344      5681.4413       178.7485        -336801.6071     22496.5472         0.0000         0.0000     44691.1807        -222399.2164       162.5742   -267090.3971   -222051.9252       162.5742          -2725.8800     -2457.2026    921491.4634     -2725.8800     -2457.2026

TIMING: 320  CPU: 151.595, 0.461007/step  Wall: 151.595, 0.461007/step, 0.0230504 hours remaining, 3224.160156 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     20196.2691      5687.3971       178.9168        -337738.1162     22532.5473         0.0000         0.0000     45250.4875        -222499.1146       164.6088   -267749.6022   -222076.2073       164.6088          -3895.6023     -2553.5003    921491.4634     -3895.6023     -2553.5003

ENERGY:     321     21615.1673     20628.0219      5693.0806       179.5146        -338181.7104     22557.3344         0.0000         0.0000     45018.7805        -222489.8112       163.7660   -267508.5917   -222064.2789       163.7660          -4609.2359     -2621.5363    921491.4634     -4609.2359     -2621.5363

ENERGY:     322     22179.0067     20957.0458      5696.1855       180.4970        -337965.9629     22565.0701         0.0000         0.0000     43989.5240        -222398.6339       160.0218   -266388.1578   -222063.6578       160.0218          -4596.8828     -2640.5013    921491.4634     -4596.8828     -2640.5013

ENERGY:     323     21976.7003     21085.8081      5695.4506       181.8003        -337194.0744     22550.8101         0.0000         0.0000     43361.4903        -222342.0148       157.7372   -265703.5051   -222061.4467       157.7372          -3808.3604     -2616.6944    921491.4634     -3808.3604     -2616.6944

ENERGY:     324     20558.5067     20952.0214      5690.8582       183.3007        -336170.3972     22520.5739         0.0000         0.0000     43857.2500        -222407.8863       159.5406   -266265.1363   -222068.7482       159.5406          -2506.6899     -2573.6931    921491.4634     -2506.6899     -2573.6931

ENERGY:     325     19096.1753     20584.7378      5683.7433       184.8442        -335297.0510     22494.0542         0.0000         0.0000     44763.3954        -222490.1010       162.8369   -267253.4964   -222060.9512       162.8369          -1264.0245     -2529.6546    921491.4634     -1264.0245     -2529.6546

ENERGY:     326     18959.6362     20052.8004      5675.9627       186.2078        -334820.0102     22490.4167         0.0000         0.0000     44971.8222        -222483.1642       163.5951   -267454.9864   -222059.6109       163.5951           -572.2143     -2503.0559    921491.4634      -572.2143     -2503.0559

ENERGY:     327     20020.7822     19506.2794      5669.7116       187.2139        -334851.2528     22513.0143         0.0000         0.0000     44550.7424        -222403.5089       162.0634   -266954.2514   -222059.8761       162.0634           -657.4994     -2506.5014    921491.4634      -657.4994     -2506.5014

ENERGY:     328     20934.1980     19092.0092      5666.7484       187.7399        -335303.4710     22549.7451         0.0000         0.0000     44493.2355        -222379.7950       161.8542   -266873.0304   -222061.7261       161.8542          -1393.2040     -2547.3519    921491.4634     -1393.2040     -2547.3519

ENERGY:     329     21066.6666     18910.0877      5668.0553       187.7546        -335996.4126     22586.9564         0.0000         0.0000     45124.3163        -222452.5756       164.1499   -267576.8920   -222059.3368       164.1499          -2499.2292     -2610.9952    921491.4634     -2499.2292     -2610.9952

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

ENERGY:     330     21142.6835     18933.5043      5673.1988       187.2569        -336566.3115     22617.7578         0.0000         0.0000     45495.0144        -222516.8959       165.4984   -268011.9102   -222062.1152       165.4984          -3602.9590     -2673.3213    921491.4634     -3602.9590     -2673.3213

ENERGY:     331     21864.6854     19091.0591      5680.9136       186.3262        -336735.1748     22637.2713         0.0000         0.0000     44806.2162        -222468.7030       162.9927   -267274.9192   -222063.3973       162.9927          -4373.7647     -2707.8811    921491.4634     -4373.7647     -2707.8811

ENERGY:     332     22513.8605     19292.8539      5689.3391       185.0892        -336383.5018     22636.4042         0.0000         0.0000     43697.6285        -222368.3263       158.9600   -266065.9548   -222061.8462       158.9600          -4514.5069     -2704.7030    921491.4634     -4514.5069     -2704.7030

ENERGY:     333     21854.9973     19482.7895      5696.6505       183.7309        -335681.4579     22608.9728         0.0000         0.0000     43501.2418        -222353.0750       158.2456   -265854.3168   -222052.0754       158.2456          -3943.3085     -2666.2162    921491.4634     -3943.3085     -2666.2162

ENERGY:     334     20023.4849     19603.2612      5701.0454       182.3864        -334880.5298     22564.8641         0.0000         0.0000     44357.3051        -222448.1827       161.3597   -266805.4879   -222049.6962       161.3597          -2855.3037     -2607.1877    921491.4634     -2855.3037     -2607.1877

ENERGY:     335     18726.9584     19647.0447      5701.6423       181.1975        -334325.9454     22528.7344         0.0000         0.0000     45026.6264        -222513.7416       163.7945   -267540.3681   -222047.5434       163.7945          -1753.1269     -2542.6965    921491.4634     -1753.1269     -2542.6965

ENERGY:     336     19127.9135     19639.0994      5698.6022       180.2744        -334271.7854     22519.6996         0.0000         0.0000     44649.6648        -222456.5316       162.4232   -267106.1964   -222055.6202       162.4232          -1093.5006     -2488.8702    921491.4634     -1093.5006     -2488.8702

ENERGY:     337     20420.1635     19649.7063      5693.3319       179.7347        -334824.3558     22536.4221         0.0000         0.0000     43995.5997        -222349.3977       160.0439   -266344.9973   -222040.1025       160.0439          -1064.7185     -2460.5860    921491.4634     -1064.7185     -2460.5860

ENERGY:     338     21007.5747     19722.4644      5687.5590       179.5437        -335808.8620     22564.1943         0.0000         0.0000     44285.9171        -222361.6089       161.1000   -266647.5260   -222041.5959       161.1000          -1500.9500     -2462.8576    921491.4634     -1500.9500     -2462.8576

ENERGY:     339     20742.6011     19892.4866      5683.2969       179.6501        -336924.5160     22593.0216         0.0000         0.0000     45359.3477        -222474.1120       165.0048   -267833.4597   -222043.8630       165.0048          -2199.9377     -2485.1215    921491.4634     -2199.9377     -2485.1215

TIMING: 340  CPU: 160.809, 0.460705/step  Wall: 160.809, 0.460705/step, 0.0204758 hours remaining, 3224.160156 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     20139.5374      5681.9995       179.9655        -337821.3682     22621.7134         0.0000         0.0000     45758.5728        -222540.9727       166.4571   -268299.5455   -222070.3955       166.4571          -2966.9709     -2503.9485    921491.4634     -2966.9709     -2503.9485

ENERGY:     341     22051.8626     20407.8963      5684.3134       180.4786        -338209.1665     22646.3197         0.0000         0.0000     44797.5819        -222440.7140       162.9613   -267238.2959   -222054.5350       162.9613          -3585.3813     -2498.5443    921491.4634     -3585.3813     -2498.5443

ENERGY:     342     22895.9212     20582.1011      5689.2420       181.0293        -337942.4473     22653.2569         0.0000         0.0000     43612.4990        -222328.3978       158.6503   -265940.8968   -222054.3605       158.6503          -3711.7545     -2460.9856    921491.4634     -3711.7545     -2460.9856

ENERGY:     343     21993.5594     20596.8905      5695.1198       181.5548        -337132.3416     22633.1271         0.0000         0.0000     43686.5575        -222345.5325       158.9197   -266032.0900   -222053.2451       158.9197          -3217.8262     -2399.3476    921491.4634     -3217.8262     -2399.3476

ENERGY:     344     19898.5079     20447.2066      5699.9573       182.0106        -336095.2672     22596.5926         0.0000         0.0000     44790.9364        -222480.0559       162.9371   -267270.9922   -222071.3577       162.9371          -2338.1159     -2329.7492    921491.4634     -2338.1159     -2329.7492

ENERGY:     345     18694.7358     20199.0881      5702.3270       182.4513        -335224.1271     22568.7534         0.0000         0.0000     45351.4659        -222525.3055       164.9762   -267876.7714   -222058.0554       164.9762          -1576.2390     -2261.7960    921491.4634     -1576.2390     -2261.7960

ENERGY:     346     19350.9890     19892.9542      5701.0894       182.7368        -334783.0718     22565.1334         0.0000         0.0000     44652.5017        -222437.6672       162.4335   -267090.1689   -222056.8255       162.4335          -1239.3023     -2211.7781    921491.4634     -1239.3023     -2211.7781

ENERGY:     347     20669.8296     19583.9410      5696.3949       182.8447        -334881.4382     22581.1979         0.0000         0.0000     43831.1325        -222336.0975       159.4456   -266167.2300   -222056.9473       159.4456          -1358.8148     -2194.9212    921491.4634     -1358.8148     -2194.9212

ENERGY:     348     21062.2472     19315.9903      5689.3479       182.7918        -335425.6667     22604.2198         0.0000         0.0000     44195.9873        -222375.0823       160.7729   -266571.0696   -222064.0951       160.7729          -1766.2768     -2218.9158    921491.4634     -1766.2768     -2218.9158

ENERGY:     349     20718.9516     19143.3231      5681.9008       182.6959        -336197.3780     22630.4372         0.0000         0.0000     45349.6292        -222490.4404       164.9695   -267840.0695   -222056.3112       164.9695          -2336.6408     -2270.6250    921491.4634     -2336.6408     -2270.6250

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

ENERGY:     350     21009.3452     19066.8674      5675.7227       182.5405        -336836.8352     22661.9751         0.0000         0.0000     45710.0734        -222530.3109       166.2807   -268240.3843   -222058.0880       166.2807          -2896.5509     -2326.8868    921491.4634     -2896.5509     -2326.8868

ENERGY:     351     22235.3179     19085.8713      5672.3994       182.3761        -337072.3443     22693.2954         0.0000         0.0000     44770.4135        -222432.6707       162.8625   -267203.0843   -222058.6359       162.8625          -3254.0185     -2369.0508    921491.4634     -3254.0185     -2369.0508

ENERGY:     352     22912.9247     19180.1280      5672.7329       182.2243        -336794.7850     22708.6916         0.0000         0.0000     43795.3992        -222342.6843       159.3156   -266138.0834   -222059.3899       159.3156          -3190.0135     -2394.0290    921491.4634     -3190.0135     -2394.0290

ENERGY:     353     21825.9773     19344.0935      5676.6445       182.1014        -336147.6543     22699.4229         0.0000         0.0000     44043.1855        -222376.2292       160.2170   -266419.4148   -222047.6764       160.2170          -2709.1540     -2407.4664    921491.4634     -2709.1540     -2407.4664

ENERGY:     354     19814.0380     19544.5090      5682.7360       181.9868        -335375.1818     22676.8662         0.0000         0.0000     44983.0756        -222491.9700       163.6361   -267475.0456   -222046.2243       163.6361          -2040.9898     -2415.4742    921491.4634     -2040.9898     -2415.4742

ENERGY:     355     18879.8418     19773.7508      5689.2466       181.9196        -334823.9953     22664.4416         0.0000         0.0000     45120.2677        -222514.5272       164.1351   -267634.7949   -222044.8383       164.1351          -1600.3169     -2424.6827    921491.4634     -1600.3169     -2424.6827

ENERGY:     356     19622.4372     20015.8110      5694.4280       181.9402        -334758.7689     22674.4075         0.0000         0.0000     44153.0884        -222416.6567       160.6168   -266569.7451   -222053.0963       160.6168          -1622.0264     -2446.8266    921491.4634     -1622.0264     -2446.8266

ENERGY:     357     20687.2713     20255.1056      5697.1708       182.0215        -335288.0644     22700.2944         0.0000         0.0000     43438.0176        -222328.1832       158.0156   -265766.2008   -222042.2331       158.0156          -2061.3609     -2486.6662    921491.4634     -2061.3609     -2486.6662

ENERGY:     358     20785.4067     20424.8431      5696.9833       182.1295        -336225.9478     22730.2414         0.0000         0.0000     44019.5821        -222386.7617       160.1311   -266406.3438   -222043.9946       160.1311          -2636.8582     -2541.3593    921491.4634     -2636.8582     -2541.3593

ENERGY:     359     20493.6441     20484.4986      5694.4424       182.1894        -337270.5927     22762.0663         0.0000         0.0000     45152.8977        -222500.8541       164.2538   -267653.7518   -222046.1003       164.2538          -3161.2177     -2593.4281    921491.4634     -3161.2177     -2593.4281

TIMING: 360  CPU: 170.014, 0.46027/step  Wall: 170.014, 0.46027/step, 0.0178994 hours remaining, 3224.160156 MB of memory in use.
ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     360     21112.5811     20418.0335      5690.9152       182.1442        -338077.5507     22797.1673         0.0000         0.0000     45362.4568        -222514.2526       165.0162   -267876.7094   -222065.3878       165.0162          -3505.9503     -2622.8572    921491.4634     -3505.9503     -2622.8572

ENERGY:     361     22462.8273     20259.6927      5688.3191       181.9496        -338397.1524     22827.2216         0.0000         0.0000     44580.8521        -222396.2899       162.1729   -266977.1420   -222052.4542       162.1729          -3542.5441     -2618.5019    921491.4634     -3542.5441     -2618.5019

ENERGY:     362     22808.6000     20031.2791      5688.3204       181.6678        -338079.7611     22835.7522         0.0000         0.0000     44200.9553        -222333.1864       160.7909   -266534.1416   -222051.2759       160.7909          -3087.0695     -2583.1906    921491.4634     -3087.0695     -2583.1906

ENERGY:     363     21303.6020     19794.1189      5692.1162       181.3427        -337235.0089     22818.0648         0.0000         0.0000     45033.6627        -222412.1017       163.8201   -267445.7644   -222049.5302       163.8201          -2242.6818     -2529.7065    921491.4634     -2242.6818     -2529.7065

ENERGY:     364     19323.8976     19612.6015      5699.8913       181.0103        -336175.1998     22790.5190         0.0000         0.0000     46034.3488        -222532.9313       167.4603   -268567.2801   -222068.5919       167.4603          -1420.0425     -2476.3757    921491.4634     -1420.0425     -2476.3757

ENERGY:     365     18830.5841     19548.3422      5710.7558       180.6857        -335316.0970     22775.7828         0.0000         0.0000     45760.0887        -222509.8577       166.4626   -268269.9464   -222057.4403       166.4626          -1100.2608     -2433.4822    921491.4634     -1100.2608     -2433.4822

ENERGY:     366     19854.2640     19578.5651      5722.5902       180.3919        -334923.1930     22780.3499         0.0000         0.0000     44422.2469        -222384.7849       161.5959   -266807.0318   -222057.2777       161.5959          -1392.6928     -2417.6863    921491.4634     -1392.6928     -2417.6863

ENERGY:     367     20741.0598     19662.8837      5732.9484       180.1165        -335098.3158     22794.3492         0.0000         0.0000     43662.6182        -222324.3401       158.8326   -265986.9583   -222058.3714       158.8326          -2104.1275     -2437.9268    921491.4634     -2104.1275     -2437.9268

ENERGY:     368     20561.5938     19748.2122      5739.6691       179.8275        -335728.0876     22808.6650         0.0000         0.0000     44272.8404        -222417.2795       161.0524   -266690.1199   -222068.2914       161.0524          -2928.4887     -2487.3070    921491.4634     -2928.4887     -2487.3070

ENERGY:     369     20346.9678     19812.6207      5741.6370       179.5048        -336580.3309     22825.3357         0.0000         0.0000     45155.6306        -222518.6342       164.2638   -267674.2649   -222061.1003       164.2638          -3666.9890     -2542.4574    921491.4634     -3666.9890     -2542.4574

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

ENERGY:     370     21302.3705     19815.7283      5738.6028       179.1429        -337296.0554     22846.3048         0.0000         0.0000     44920.4942        -222493.4118       163.4084   -267413.9061   -222062.2628       163.4084          -4081.4434     -2576.8189    921491.4634     -4081.4434     -2576.8189

ENERGY:     371     22799.2770     19758.4808      5731.5881       178.8004        -337606.4369     22861.3510         0.0000         0.0000     43904.8961        -222372.0436       159.7139   -266276.9397   -222061.9341       159.7139          -3956.1477     -2578.2817    921491.4634     -3956.1477     -2578.2817

ENERGY:     372     22964.3595     19665.2850      5722.4284       178.5955        -337391.7868     22854.0836         0.0000         0.0000     43672.6555        -222334.3793       158.8691   -266007.0348   -222060.3196       158.8691          -3189.3378     -2552.6171    921491.4634     -3189.3378     -2552.6171

ENERGY:     373     21253.1596     19603.3416      5713.4759       178.7080        -336784.3111     22822.4881         0.0000         0.0000     44782.9949        -222430.1430       162.9082   -267213.1378   -222050.3115       162.9082          -2037.0646     -2511.6655    921491.4634     -2037.0646     -2511.6655

ENERGY:     374     19285.9365     19613.0720      5706.5680       179.1985        -336019.1232     22785.5048         0.0000         0.0000     45912.3277        -222536.5156       167.0164   -268448.8433   -222048.2691       167.0164           -983.4304     -2469.0309    921491.4634      -983.4304     -2469.0309

ENERGY:     375     18893.7028     19735.2395      5703.0316       180.0533        -335443.7684     22766.6833         0.0000         0.0000     45660.9717        -222504.0862       166.1021   -268165.0579   -222047.0945       166.1021           -539.4860     -2439.8660    921491.4634      -539.4860     -2439.8660

ENERGY:     376     19884.0274     19962.1764      5703.2010       181.1433        -335321.8632     22772.8701         0.0000         0.0000     44434.3273        -222384.1177       161.6399   -266818.4450   -222050.5531       161.6399           -874.6223     -2439.6902    921491.4634      -874.6223     -2439.6902

ENERGY:     377     20646.4609     20251.1593      5706.5522       182.3248        -335763.5802     22794.3774         0.0000         0.0000     43848.2752        -222334.4304       159.5080   -266182.7056   -222041.4015       159.5080          -1819.5859     -2472.4985    921491.4634     -1819.5859     -2472.4985

ENERGY:     378     20473.8100     20495.6594      5711.4639       183.2952        -336584.2279     22821.5838         0.0000         0.0000     44474.7534        -222423.6623       161.7869   -266898.4156   -222044.3969       161.7869          -2972.9873     -2523.3498    921491.4634     -2972.9873     -2523.3498

ENERGY:     379     20419.4577     20623.8791      5716.2160       183.8420        -337495.6096     22854.5154         0.0000         0.0000     45185.6411        -222512.0584       164.3729   -267697.6995   -222047.0131       164.3729          -3997.4171     -2563.3071    921491.4634     -3997.4171     -2563.3071

TIMING: 380  CPU: 179.215, 0.46003/step  Wall: 179.215, 0.46003/step, 0.0153343 hours remaining, 3224.160156 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     21458.1130     20605.4119      5719.3306       183.8284        -338176.3452     22892.6531         0.0000         0.0000     44833.7899        -222483.2182       163.0930   -267317.0081   -222063.6480       163.0930          -4580.2699     -2564.2100    921491.4634     -4580.2699     -2564.2100

ENERGY:     381     22824.3125     20467.0310      5720.1164       183.2929        -338395.2411     22923.6571         0.0000         0.0000     43906.3002        -222370.5309       159.7191   -266276.8311   -222053.0347       159.7191          -4470.7192     -2514.6119    921491.4634     -4470.7192     -2514.6119

ENERGY:     382     22844.1902     20220.4986      5718.3197       182.2157        -338010.6532     22930.5475         0.0000         0.0000     43766.5296        -222348.3520       159.2106   -266114.8815   -222051.0364       159.2106          -3524.7146     -2418.5486    921491.4634     -3524.7146     -2418.5486

ENERGY:     383     21263.6991     19910.9247      5714.6670       180.7419        -337128.0226     22911.2848         0.0000         0.0000     44707.9440        -222438.7612       162.6352   -267146.7051   -222048.1881       162.6352          -2023.0800     -2294.0130    921491.4634     -2023.0800     -2294.0130

ENERGY:     384     19625.4112     19596.0355      5710.5349       179.0647        -336052.0486     22884.2537         0.0000         0.0000     45539.1828        -222517.5659       165.6590   -268056.7486   -222062.0926       165.6590           -569.2378     -2166.9356    921491.4634      -569.2378     -2166.9356

ENERGY:     385     19327.8180     19356.8913      5707.7752       177.4354        -335210.6402     22871.6147         0.0000         0.0000     45299.7166        -222469.3890       164.7879   -267769.1056   -222051.0994       164.7879            215.3515     -2064.3635    921491.4634       215.3515     -2064.3635

ENERGY:     386     19981.2273     19220.9465      5707.6638       175.9384        -334865.1819     22880.7961         0.0000         0.0000     44519.8582        -222378.7516       161.9510   -266898.6098   -222051.0438       161.9510            122.6669     -2011.2426    921491.4634       122.6669     -2011.2426

ENERGY:     387     20367.2861     19202.4844      5710.9354       174.6759        -335109.8728     22905.2747         0.0000         0.0000     44377.1813        -222372.0350       161.4320   -266749.2163   -222053.0051       161.4320           -738.9585     -2019.1687    921491.4634      -738.9585     -2019.1687

ENERGY:     388     20282.3988     19280.0167      5717.2934       173.7038        -335824.1524     22938.2904         0.0000         0.0000     44972.7759        -222459.6735       163.5986   -267432.4494   -222067.4821       163.5986          -2063.8554     -2076.2820    921491.4634     -2063.8554     -2076.2820

ENERGY:     389     20685.9714     19431.2563      5725.6291       173.0778        -336772.2810     22978.5923         0.0000         0.0000     45279.3791        -222498.3750       164.7139   -267777.7541   -222059.2969       164.7139          -3501.7338     -2158.1991    921491.4634     -3501.7338     -2158.1991

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

ENERGY:     390     21929.5051     19598.7447      5733.9032       172.7580        -337596.2519     23021.3366         0.0000         0.0000     44698.9836        -222441.0206       162.6026   -267140.0042   -222061.4799       162.6026          -4540.4921     -2229.7773    921491.4634     -4540.4921     -2229.7773

ENERGY:     391     22937.3143     19764.3494      5740.3107       172.7562        -338017.7283     23051.7304         0.0000         0.0000     43987.0071        -222364.2602       160.0126   -266351.2673   -222061.6925       160.0126          -4746.5203     -2270.9347    921491.4634     -4746.5203     -2270.9347

ENERGY:     392     22488.0358     19924.0528      5743.6080       173.0775        -337898.4690     23055.0077         0.0000         0.0000     44125.3367        -222389.3505       160.5158   -266514.6873   -222067.3169       160.5158          -3965.0284     -2276.9601    921491.4634     -3965.0284     -2276.9601

ENERGY:     393     20924.3594     20087.8867      5743.5041       173.6901        -337346.1131     23032.5730         0.0000         0.0000     44913.3818        -222470.7179       163.3825   -267384.0997   -222058.1711       163.3825          -2525.7425     -2257.0108    921491.4634     -2525.7425     -2257.0108

ENERGY:     394     19713.0845     20210.4902      5740.1181       174.4904        -336587.4371     23002.1147         0.0000         0.0000     45247.1172        -222500.0220       164.5966   -267747.1392   -222054.8629       164.5966           -988.4118     -2227.7232    921491.4634      -988.4118     -2227.7232

ENERGY:     395     19644.4020     20265.5067      5734.3763       175.3161        -335972.1487     22982.1023         0.0000         0.0000     44739.8937        -222430.5516       162.7514   -267170.4452   -222052.2374       162.7514             57.9320     -2215.1747    921491.4634        57.9320     -2215.1747

ENERGY:     396     20000.9211     20248.4505      5727.6303       175.9620        -335765.9676     22978.8841         0.0000         0.0000     44270.3051        -222363.8143       161.0432   -266634.1194   -222050.8950       161.0432            285.8963     -2246.0848    921491.4634       285.8963     -2246.0848

ENERGY:     397     19906.7786     20200.7709      5721.4919       176.2273        -336102.8182     22990.0377         0.0000         0.0000     44712.8676        -222394.6442       162.6531   -267107.5118   -222042.6600       162.6531           -376.0864     -2327.2102    921491.4634      -376.0864     -2327.2102

ENERGY:     398     19692.8117     20133.3590      5716.9814       176.0456        -336812.3385     23014.0587         0.0000         0.0000     45592.7323        -222486.3497       165.8538   -268079.0820   -222045.7223       165.8538          -1710.2237     -2443.6965    921491.4634     -1710.2237     -2443.6965

ENERGY:     399     20395.5109     20061.2890      5714.6367       175.4775        -337634.0289     23050.4588         0.0000         0.0000     45731.2028        -222505.4532       166.3575   -268236.6560   -222049.1604       166.3575          -3349.4392     -2564.3620    921491.4634     -3349.4392     -2564.3620

LDB: ============= START OF LOAD BALANCING ============== 194.352
LDB: Largest compute 230 load 0.528398 is 1.2% of average load 45.604527
LDB: Average compute 0.063865 is 0.1% of average load 45.604527
LDB: TIME 194.354 LOAD: AVG 45.6045 MAX 46.0404  PROXIES: TOTAL 112 MAXPE 28 MAXPATCH 1 None MEM: 3224.16 MB
LDB: TIME 194.354 LOAD: AVG 45.6045 MAX 46.0404  PROXIES: TOTAL 113 MAXPE 29 MAXPATCH 1 RefineTorusLB MEM: 3224.16 MB
LDB: TIME 194.354 LOAD: AVG 45.6045 MAX 46.0404  PROXIES: TOTAL 113 MAXPE 29 MAXPATCH 1 RefineTorusLB MEM: 3224.16 MB
LDB: ============== END OF LOAD BALANCING =============== 194.355
Info: useSync: 1 useProxySync: 0
LDB: =============== DONE WITH MIGRATION ================ 194.356
Info: Benchmark time: 4 CPUs 0.460347 s/step 5.32809 days/ns 3224.16 MB memory
TIMING: 400  CPU: 188.413, 0.459924/step  Wall: 188.413, 0.459924/step, 0.0127757 hours remaining, 3224.160156 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     21983.9557     19981.4881      5714.2278       174.7230        -338264.6731     23090.3529         0.0000         0.0000     44890.2683        -222429.6573       163.2985   -267319.9257   -222060.6834       163.2985          -4748.6077     -2656.9998    921491.4634     -4748.6077     -2656.9998

ENERGY:     401     23053.7072     19909.1477      5715.0562       174.0724        -338477.1025     23114.9568         0.0000         0.0000     44157.6678        -222352.4946       160.6335   -266510.1623   -222050.1992       160.6335          -5384.8814     -2700.1794    921491.4634     -5384.8814     -2700.1794

ENERGY:     402     22444.0479     19835.9108      5715.8942       173.8391        -338107.6288     23109.6379         0.0000         0.0000     44436.8097        -222391.4892       161.6489   -266828.2989   -222049.2228       161.6489          -4939.3794     -2681.7025    921491.4634     -4939.3794     -2681.7025

ENERGY:     403     20784.9694     19778.4828      5715.7218       174.2695        -337239.9784     23077.8402         0.0000         0.0000     45225.5960        -222483.0987       164.5183   -267708.6947   -222046.6856       164.5183          -3613.5978     -2605.7429    921491.4634     -3613.5978     -2605.7429

ENERGY:     404     19687.5953     19735.4029      5713.8114       175.5084        -336169.1138     23038.2900         0.0000         0.0000     45313.8389        -222504.6668       164.8393   -267818.5057   -222060.2370       164.8393          -1967.0746     -2494.0438    921491.4634     -1967.0746     -2494.0438

ENERGY:     405     19798.8802     19696.7725      5710.0281       177.6162        -335317.9345     23008.3947         0.0000         0.0000     44511.4431        -222414.7997       161.9204   -266926.2428   -222047.5589       161.9204           -627.4749     -2380.7862    921491.4634      -627.4749     -2380.7862

ENERGY:     406     20210.3505     19614.0443      5704.4964       180.4779        -334953.8234     22994.4762         0.0000         0.0000     43902.7660        -222347.2120       159.7062   -266249.9780   -222046.2403       159.7062             66.0353     -2300.4795    921491.4634        66.0353     -2300.4795

ENERGY:     407     20044.4889     19493.9063      5698.1032       183.8794        -335181.5230     22996.8160         0.0000         0.0000     44376.0633        -222388.2659       161.4279   -266764.3292   -222047.0769       161.4279            -41.3220     -2272.9969    921491.4634       -41.3220     -2272.9969

ENERGY:     408     19735.8470     19387.6642      5692.2151       187.5226        -335902.8218     23017.8173         0.0000         0.0000     45394.4121        -222487.3434       165.1324   -267881.7555   -222063.5314       165.1324           -920.8282     -2294.1556    921491.4634      -920.8282     -2294.1556

ENERGY:     409     20350.1188     19376.4605      5688.4775       191.1593        -336896.6846     23057.9921         0.0000         0.0000     45733.6058        -222498.8705       166.3663   -268232.4764   -222051.6706       166.3663          -2367.4921     -2346.9326    921491.4634     -2367.4921     -2346.9326

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

ENERGY:     410     21850.5211     19470.1800      5687.6649       194.4179        -337813.1844     23106.2028         0.0000         0.0000     45077.0714        -222427.1262       163.9780   -267504.1977   -222054.6429       163.9780          -3838.6212     -2402.0240    921491.4634     -3838.6212     -2402.0240

ENERGY:     411     22931.8001     19651.0974      5689.8740       197.0388        -338354.2242     23140.9044         0.0000         0.0000     44380.5347        -222362.9748       161.4442   -266743.5095   -222056.2116       161.4442          -4745.1591     -2436.8801    921491.4634     -4745.1591     -2436.8801

ENERGY:     412     22535.8950     19878.8219      5694.3233       198.8205        -338356.4972     23146.2934         0.0000         0.0000     44499.5085        -222402.8345       161.8770   -266902.3430   -222068.4601       161.8770          -4717.2138     -2436.3028    921491.4634     -4717.2138     -2436.3028

ENERGY:     413     21130.1416     20138.5247      5699.9333       199.7191        -337872.5317     23125.1114         0.0000         0.0000     45113.2143        -222465.8871       164.1095   -267579.1015   -222055.3455       164.1095          -3850.6269     -2398.9549    921491.4634     -3850.6269     -2398.9549

ENERGY:     414     19987.3856     20381.5505      5705.1135       199.5118        -337122.7796     23094.4556         0.0000         0.0000     45271.6528        -222483.1099       164.6858   -267754.7627   -222052.1626       164.6858          -2501.3242     -2333.9464    921491.4634     -2501.3242     -2333.9464

ENERGY:     415     19745.2666     20572.1258      5708.7452       198.1487        -336456.1972     23071.1990         0.0000         0.0000     44733.2273        -222427.4847       162.7272   -267160.7120   -222049.0348       162.7272          -1174.6452     -2266.5615    921491.4634     -1174.6452     -2266.5615

ENERGY:     416     19942.3170     20661.9895      5710.0857       195.6953        -336157.5861     23063.1714         0.0000         0.0000     44200.2850        -222384.0422       160.7885   -266584.3272   -222052.9645       160.7885           -282.7614     -2224.6897    921491.4634      -282.7614     -2224.6897

ENERGY:     417     20031.3750     20631.3208      5709.0493       192.4696        -336373.1075     23072.1097         0.0000         0.0000     44338.4620        -222398.3210       161.2911   -266736.7830   -222044.6994       161.2911           -112.4554     -2227.1699    921491.4634      -112.4554     -2227.1699

ENERGY:     418     20154.6648     20457.0908      5705.5847       188.6536        -336970.7866     23098.6725         0.0000         0.0000     44915.1423        -222450.9779       163.3889   -267366.1202   -222046.7094       163.3889           -671.8547     -2269.9921    921491.4634      -671.8547     -2269.9921

ENERGY:     419     20790.7631     20185.5522      5700.4810       184.6054        -337717.8755     23139.8022         0.0000         0.0000     45250.3100        -222466.3614       164.6082   -267716.6714   -222049.5951       164.6082          -1783.9422     -2336.6465    921491.4634     -1783.9422     -2336.6465

TIMING: 420  CPU: 197.59, 0.458821/step  Wall: 197.59, 0.458821/step, 0.010196 hours remaining, 3224.160156 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     21812.8759     19887.3910      5695.0414       180.6770        -338321.5512     23183.0573         0.0000         0.0000     45121.9776        -222440.5310       164.1414   -267562.5085   -222061.1152       164.1414          -3051.6030     -2402.9274    921491.4634     -3051.6030     -2402.9274

ENERGY:     421     22491.6105     19639.6135      5690.9237       177.2518        -338550.3534     23210.1383         0.0000         0.0000     44931.8958        -222408.9197       163.4499   -267340.8156   -222052.6023       163.4499          -4041.3726     -2452.8636    921491.4634     -4041.3726     -2452.8636

ENERGY:     422     22275.7613     19449.5349      5688.9976       174.4058        -338225.0313     23208.5475         0.0000         0.0000     45004.7080        -222423.0762       163.7148   -267427.7843   -222052.8454       163.7148          -4363.1152     -2465.6373    921491.4634     -4363.1152     -2465.6373

ENERGY:     423     21418.8984     19324.4272      5689.6736       172.2145        -337416.8954     23180.6039         0.0000         0.0000     45183.9709        -222447.1068       164.3669   -267631.0777   -222051.5237       164.3669          -3955.8307     -2434.9306    921491.4634     -3955.8307     -2434.9306

ENERGY:     424     20531.3309     19270.7815      5692.6542       170.6563        -336406.2761     23140.4645         0.0000         0.0000     45151.0453        -222449.3435       164.2471   -267600.3887   -222060.4131       164.2471          -3030.1609     -2370.2034    921491.4634     -3030.1609     -2370.2034

ENERGY:     425     19942.3360     19314.5607      5697.3263       169.6876        -335607.5203     23103.7919         0.0000         0.0000     44956.0476        -222423.7702       163.5377   -267379.8177   -222050.7967       163.5377          -1980.9654     -2297.0090    921491.4634     -1980.9654     -2297.0090

ENERGY:     426     19603.3346     19432.3068      5702.4947       169.0990        -335270.6873     23080.2891         0.0000         0.0000     44862.7380        -222420.4251       163.1983   -267283.1631   -222049.1094       163.1983          -1125.8051     -2237.7215    921491.4634     -1125.8051     -2237.7215

ENERGY:     427     19598.5315     19595.2897      5707.1504       168.7509        -335498.4315     23074.5006         0.0000         0.0000     44915.2771        -222438.9315       163.3894   -267354.2085   -222048.7342       163.3894           -741.9010     -2207.6355    921491.4634      -741.9010     -2207.6355

ENERGY:     428     20140.4227     19760.4169      5710.4628       168.5259        -336199.9844     23087.7676         0.0000         0.0000     44884.2590        -222448.1296       163.2766   -267332.3886   -222058.0549       163.2766           -935.5731     -2206.9583    921491.4634      -935.5731     -2206.9583

ENERGY:     429     21147.3675     19912.0618      5712.1357       168.3557        -337181.5898     23116.4519         0.0000         0.0000     44706.5238        -222418.6933       162.6300   -267125.2171   -222045.4880       162.6300          -1630.8084     -2233.4561    921491.4634     -1630.8084     -2233.4561

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

ENERGY:     430     22013.9872     20024.3738      5712.1700       168.1897        -338096.9196     23149.4491         0.0000         0.0000     44626.3093        -222402.4405       162.3382   -267028.7498   -222047.3914       162.3382          -2472.2456     -2268.0464    921491.4634     -2472.2456     -2268.0464

ENERGY:     431     22204.1020     20111.4154      5711.2600       168.0704        -338644.7636     23172.3803         0.0000         0.0000     44858.4624        -222419.0731       163.1828   -267277.5355   -222048.7168       163.1828          -3116.2805     -2293.5591    921491.4634     -3116.2805     -2293.5591

ENERGY:     432     21768.3702     20188.6725      5710.3546       168.1086        -338651.2093     23176.0844         0.0000         0.0000     45177.9904        -222461.6286       164.3451   -267639.6190   -222065.9059       164.3451          -3350.2742     -2296.1497    921491.4634     -3350.2742     -2296.1497

ENERGY:     433     21200.9070     20275.9665      5710.3763       168.4633        -338164.0630     23162.2909         0.0000         0.0000     45192.9279        -222453.1312       164.3995   -267646.0590   -222052.5983       164.3995          -3187.3733     -2272.1276    921491.4634     -3187.3733     -2272.1276

ENERGY:     434     20730.3412     20338.1500      5711.6061       169.3247        -337394.2697     23140.7733         0.0000         0.0000     44883.0993        -222420.9752       163.2724   -267304.0745   -222051.1463       163.2724          -2694.3108     -2227.7885    921491.4634     -2694.3108     -2227.7885

ENERGY:     435     20235.2200     20362.4015      5714.0003       170.8455        -336680.6548     23123.4095         0.0000         0.0000     44675.9835        -222398.7945       162.5189   -267074.7780   -222049.5889       162.5189          -2061.3582     -2179.8951    921491.4634     -2061.3582     -2179.8951

ENERGY:     436     19670.9242     20349.9981      5717.2345       173.0864        -336303.8806     23119.9075         0.0000         0.0000     44847.0980        -222425.6318       163.1414   -267272.7298   -222059.6960       163.1414          -1520.6600     -2145.1618    921491.4634     -1520.6600     -2145.1618

ENERGY:     437     19434.5516     20329.5092      5720.9893       175.9827        -336411.9779     23136.3865         0.0000         0.0000     45159.2684        -222455.2902       164.2770   -267614.5586   -222050.7503       164.2770          -1319.1170     -2134.4850    921491.4634     -1319.1170     -2134.4850

ENERGY:     438     19935.1532     20278.6096      5724.6883       179.3848        -336899.4570     23173.5516         0.0000         0.0000     45148.1320        -222459.9374       164.2365   -267608.0694   -222051.5669       164.2365          -1493.0943     -2145.0882    921491.4634     -1493.0943     -2145.0882

ENERGY:     439     21052.7407     20184.4297      5727.7929       183.0561        -337561.7712     23224.7479         0.0000         0.0000     44760.8207        -222428.1833       162.8276   -267189.0040   -222052.7966       162.8276          -1936.1990     -2169.8748    921491.4634     -1936.1990     -2169.8748

TIMING: 440  CPU: 206.759, 0.458497/step  Wall: 206.759, 0.458497/step, 0.00764162 hours remaining, 3224.160156 MB of memory in use.
ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     440     22071.5683     20036.2372      5729.7527       186.7201        -338123.1801     23276.2482         0.0000         0.0000     44417.5455        -222405.1080       161.5788   -266822.6535   -222059.4774       161.5788          -2408.4613     -2197.9672    921491.4634     -2408.4613     -2197.9672

ENERGY:     441     22355.5485     19860.0409      5730.3487       190.1145        -338361.1709     23313.2041         0.0000         0.0000     44502.6961        -222409.2181       161.8886   -266911.9142   -222050.0862       161.8886          -2716.1028     -2221.5314    921491.4634     -2716.1028     -2221.5314

ENERGY:     442     21853.6116     19664.5349      5729.4854       192.9411        -338090.1527     23327.1564         0.0000         0.0000     44880.6318        -222441.7915       163.2634   -267322.4233   -222049.7757       163.2634          -2710.5577     -2229.0697    921491.4634     -2710.5577     -2229.0697

ENERGY:     443     21064.3315     19487.0722      5727.6164       194.9329        -337369.3145     23320.0153         0.0000         0.0000     45118.1105        -222457.2356       164.1273   -267575.3461   -222048.5998       164.1273          -2448.1649     -2220.3532    921491.4634     -2448.1649     -2220.3532

ENERGY:     444     20449.3364     19357.2689      5725.4095       195.8735        -336464.1918     23301.5271         0.0000         0.0000     44987.7175        -222447.0590       163.6530   -267434.7765   -222057.9800       163.6530          -2090.2102     -2206.4401    921491.4634     -2090.2102     -2206.4401

ENERGY:     445     20125.5609     19307.2516      5723.6513       195.6942        -335759.3911     23283.8134         0.0000         0.0000     44708.7154        -222414.7044       162.6380   -267123.4198   -222046.5430       162.6380          -1846.9629     -2201.6928    921491.4634     -1846.9629     -2201.6928

ENERGY:     446     19947.6805     19324.9005      5722.5429       194.3235        -335494.5706     23276.0445         0.0000         0.0000     44620.2945        -222408.7841       162.3164   -267029.0787   -222046.1623       162.3164          -1800.7520     -2216.7296    921491.4634     -1800.7520     -2216.7296

ENERGY:     447     19914.2847     19416.0210      5722.2107       191.8641        -335769.4398     23282.7452         0.0000         0.0000     44816.5089        -222425.8052       163.0301   -267242.3141   -222046.8345       163.0301          -1993.3115     -2253.0605    921491.4634     -1993.3115     -2253.0605

ENERGY:     448     20187.5921     19583.6801      5722.5764       188.5554        -336503.1800     23303.8898         0.0000         0.0000     45065.6675        -222451.2188       163.9365   -267516.8863   -222059.3483       163.9365          -2372.1880     -2303.7900    921491.4634     -2372.1880     -2303.7900

ENERGY:     449     20877.4060     19832.6987      5723.5712       184.8596        -337500.9071     23334.5917         0.0000         0.0000     45101.1677        -222446.6122       164.0657   -267547.7800   -222047.7102       164.0657          -2827.1082     -2356.1408    921491.4634     -2827.1082     -2356.1408

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

ENERGY:     450     21754.4853     20108.1301      5724.4776       181.0897        -338419.3249     23364.6237         0.0000         0.0000     44854.3096        -222432.2089       163.1677   -267286.5186   -222048.7864       163.1677          -3116.6758     -2394.3897    921491.4634     -3116.6758     -2394.3897

ENERGY:     451     22355.5901     20357.7255      5724.7144       177.6517        -338952.0909     23381.8001         0.0000         0.0000     44542.6988        -222411.9103       162.0341   -266954.6092   -222048.8249       162.0341          -3074.2534     -2405.7799    921491.4634     -3074.2534     -2405.7799

ENERGY:     452     22246.2014     20536.0133      5723.8953       174.8859        -338927.1538     23378.0938         0.0000         0.0000     44452.9199        -222415.1443       161.7075   -266868.0642   -222059.6373       161.7075          -2659.9607     -2384.7570    921491.4634     -2659.9607     -2384.7570

ENERGY:     453     21399.8727     20641.1309      5722.2878       173.1350        -338392.7935     23354.5902         0.0000         0.0000     44683.7036        -222418.0733       162.5470   -267101.7769   -222043.5375       162.5470          -2048.3341     -2342.4670    921491.4634     -2048.3341     -2342.4670

ENERGY:     454     20248.3384     20654.1371      5720.2217       172.3637        -337567.1417     23320.6897         0.0000         0.0000     45008.1466        -222443.2445       163.7273   -267451.3911   -222041.8394       163.7273          -1453.4582     -2293.1452    921491.4634     -1453.4582     -2293.1452

ENERGY:     455     19486.7910     20584.7118      5718.4844       172.5169        -336790.6455     23290.4020         0.0000         0.0000     45086.5788        -222451.1606       164.0126   -267537.7394   -222040.8573       164.0126          -1151.8827     -2255.8573    921491.4634     -1151.8827     -2255.8573

ENERGY:     456     19493.3724     20440.6798      5717.7555       173.4248        -336350.1078     23274.9628         0.0000         0.0000     44811.4725        -222438.4399       163.0118   -267249.9125   -222055.3490       163.0118          -1305.5006     -2245.5824    921491.4634     -1305.5006     -2245.5824

ENERGY:     457     20047.4930     20251.9433      5718.5580       174.9241        -336395.8167     23277.8272         0.0000         0.0000     44521.8704        -222403.2007       161.9583   -266925.0711   -222049.4137       161.9583          -1906.4167     -2263.5014    921491.4634     -1906.4167     -2263.5014

ENERGY:     458     20585.8435     20019.2722      5720.7060       176.6081        -336835.0960     23294.7171         0.0000         0.0000     44632.7887        -222405.1603       162.3618   -267037.9490   -222051.2826       162.3618          -2684.6988     -2301.0428    921491.4634     -2684.6988     -2301.0428

ENERGY:     459     20903.4946     19784.9690      5724.0021       178.1984        -337468.1643     23318.6982         0.0000         0.0000     45113.9364        -222444.8656       164.1121   -267558.8020   -222053.1415       164.1121          -3350.5832     -2341.5797    921491.4634     -3350.5832     -2341.5797

TIMING: 460  CPU: 215.925, 0.458254/step  Wall: 215.925, 0.458254/step, 0.00509171 hours remaining, 3224.160156 MB of memory in use.
ETITLE:      TS           BOND          ANGLE          DIHED          IMPRP               ELECT            VDW       BOUNDARY           MISC        KINETIC               TOTAL           TEMP      POTENTIAL         TOTAL3        TEMPAVG            PRESSURE      GPRESSURE         VOLUME       PRESSAVG      GPRESSAVG

ENERGY:     460     21262.6139     19597.9064      5728.0971       179.4910        -338014.3765     23341.8001         0.0000         0.0000     45423.8561        -222480.6118       165.2395   -267904.4679   -222064.6838       165.2395          -3669.8202     -2365.2413    921491.4634     -3669.8202     -2365.2413

ENERGY:     461     21862.8763     19507.1076      5732.5752       180.4333        -338251.6213     23355.3936         0.0000         0.0000     45154.6133        -222458.6221       164.2601   -267613.2354   -222058.0509       164.2601          -3556.1666     -2361.1800    921491.4634     -3556.1666     -2361.1800

ENERGY:     462     22264.2255     19487.8110      5736.4822       180.9531        -337988.7168     23351.1087         0.0000         0.0000     44559.9286        -222408.2076       162.0968   -266968.1362   -222056.7216       162.0968          -2954.8200     -2323.4251    921491.4634     -2954.8200     -2323.4251

ENERGY:     463     21821.1792     19513.9016      5738.9361       181.1160        -337284.1026     23326.9479         0.0000         0.0000     44313.4564        -222388.5654       161.2002   -266702.0218   -222054.6244       161.2002          -2012.4424     -2264.0778    921491.4634     -2012.4424     -2264.0778

ENERGY:     464     20535.2461     19559.9273      5739.2518       181.0096        -336389.3838     23291.1944         0.0000         0.0000     44654.0259        -222428.7287       162.4391   -267082.7546   -222058.5731       162.4391          -1050.9226     -2205.5267    921491.4634     -1050.9226     -2205.5267

ENERGY:     465     19322.7828     19631.8855      5737.2898       180.7155        -335701.1532     23259.7394         0.0000         0.0000     45094.5679        -222474.1722       164.0416   -267568.7401   -222052.9391       164.0416           -512.3346     -2174.4007    921491.4634      -512.3346     -2174.4007

ENERGY:     466     19088.4511     19708.3582      5733.2107       180.2808        -335443.7723     23245.0608         0.0000         0.0000     45020.7898        -222467.6209       163.7733   -267488.4107   -222052.9788       163.7733           -630.3314     -2182.6709    921491.4634      -630.3314     -2182.6709

ENERGY:     467     19841.8070     19783.1743      5727.6703       179.7757        -335721.0947     23249.4534         0.0000         0.0000     44523.6655        -222415.5485       161.9649   -266939.2141   -222054.3498       161.9649          -1393.6029     -2232.5922    921491.4634     -1393.6029     -2232.5922

ENERGY:     468     20761.8481     19845.4942      5721.5089       179.2779        -336451.5662     23265.8130         0.0000         0.0000     44291.6575        -222385.9666       161.1209   -266677.6242   -222056.3594       161.1209          -2508.6714     -2314.1340    921491.4634     -2508.6714     -2314.1340

ENERGY:     469     21236.3014     19910.2020      5715.6824       178.8504        -337458.3197     23284.3967         0.0000         0.0000     44720.3193        -222412.5676       162.6802   -267132.8869   -222046.0754       162.6802          -3596.7405     -2405.7971    921491.4634     -3596.7405     -2405.7971

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

ENERGY:     470     21411.1728     19972.8932      5710.9491       178.5947        -338383.2503     23297.0678         0.0000         0.0000     45346.4566        -222466.1160       164.9579   -267812.5727   -222047.6092       164.9579          -4259.6993     -2477.6830    921491.4634     -4259.6993     -2477.6830

ENERGY:     471     21732.8674     20054.6833      5707.9626       178.5890        -338913.2449     23297.5091         0.0000         0.0000     45471.3360        -222470.2974       165.4122   -267941.6334   -222047.5363       165.4122          -4290.5681     -2504.3174    921491.4634     -4290.5681     -2504.3174

ENERGY:     472     22081.2359     20161.5548      5707.0091       178.9047        -338870.6765     23279.4498         0.0000         0.0000     45028.5290        -222433.9932       163.8014   -267462.5223   -222059.5061       163.8014          -3659.7358     -2479.9183    921491.4634     -3659.7358     -2479.9183

ENERGY:     473     21866.1362     20289.3423      5707.9843       179.6165        -338307.7192     23240.7370         0.0000         0.0000     44634.5168        -222389.3862       162.3681   -267023.9030   -222043.8542       162.3681          -2556.3615     -2408.1657    921491.4634     -2556.3615     -2408.1657

ENERGY:     474     20842.9705     20372.0984      5710.2160       180.7466        -337438.4556     23189.2355         0.0000         0.0000     44733.2301        -222409.9584       162.7272   -267143.1886   -222041.2623       162.7272          -1295.5524     -2316.2727    921491.4634     -1295.5524     -2316.2727

ENERGY:     475     19674.2081     20371.7672      5712.9876       182.2512        -336604.2319     23142.3825         0.0000         0.0000     45070.2134        -222450.4219       163.9530   -267520.6353   -222039.4533       163.9530           -344.6450     -2232.2125    921491.4634      -344.6450     -2232.2125

ENERGY:     476     19235.7863     20282.0274      5715.7683       184.0125        -336100.0909     23115.8473         0.0000         0.0000     45106.0629        -222460.5863       164.0835   -267566.6492   -222053.6139       164.0835            -92.4050     -2183.0651    921491.4634       -92.4050     -2183.0651

ENERGY:     477     19704.7250     20145.9814      5718.4976       185.9230        -336101.8795     23114.2946         0.0000         0.0000     44812.3204        -222420.1376       163.0149   -267232.4580   -222044.8412       163.0149           -667.4946     -2171.8227    921491.4634      -667.4946     -2171.8227

ENERGY:     478     20493.4776     19974.7639      5721.0254       187.7262        -336537.4041     23131.2466         0.0000         0.0000     44627.0329        -222402.1316       162.3409   -267029.1644   -222047.4108       162.3409          -1807.1603     -2198.7955    921491.4634     -1807.1603     -2198.7955

ENERGY:     479     21125.3056     19793.3957      5723.3295       189.2099        -337215.5842     23156.6777         0.0000         0.0000     44802.1575        -222425.5084       162.9779   -267227.6658   -222050.5461       162.9779          -3089.8514     -2246.7916    921491.4634     -3089.8514     -2246.7916

TIMING: 480  CPU: 225.085, 0.458038/step  Wall: 225.085, 0.458038/step, 0.00254465 hours remaining, 3224.160156 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     21624.0324     19623.1965      5725.3111       190.1901        -337854.6791     23181.5122         0.0000         0.0000     45051.6813        -222458.7555       163.8856   -267510.4368   -222064.6214       163.8856          -4077.7324     -2291.4892    921491.4634     -4077.7324     -2291.4892

ENERGY:     481     22092.4851     19510.0434      5727.0952       190.6351        -338199.2487     23196.7962         0.0000         0.0000     45041.3368        -222440.8568       163.8480   -267482.1936   -222052.5270       163.8480          -4466.2392     -2305.6733    921491.4634     -4466.2392     -2305.6733

ENERGY:     482     22186.3467     19466.6795      5728.4964       190.3598        -338044.5425     23192.7477         0.0000         0.0000     44865.8520        -222414.0605       163.2096   -267279.9125   -222051.4117       163.2096          -4059.3096     -2278.0615    921491.4634     -4059.3096     -2278.0615

ENERGY:     483     21553.1415     19511.5746      5729.5660       189.3227        -337426.2192     23165.8742         0.0000         0.0000     44861.8969        -222414.8434       163.1953   -267276.7403   -222048.7677       163.1953          -2964.1722     -2216.4116    921491.4634     -2964.1722     -2216.4116

ENERGY:     484     20460.8928     19631.1940      5730.2465       187.5455        -336590.8889     23126.1352         0.0000         0.0000     45003.6030        -222451.2719       163.7107   -267454.8749   -222059.8744       163.7107          -1565.2425     -2143.1849    921491.4634     -1565.2425     -2143.1849

ENERGY:     485     19688.7722     19800.2992      5730.5256       185.2458        -335902.5869     23092.8470         0.0000         0.0000     44955.5723        -222449.3248       163.5360   -267404.8971   -222045.9608       163.5360           -422.1571     -2086.8735    921491.4634      -422.1571     -2086.8735

ENERGY:     486     19602.5427     19954.8176      5729.7198       182.4662        -335612.3568     23080.3807         0.0000         0.0000     44645.9115        -222416.5184       162.4096   -267062.4298   -222044.6763       162.4096             87.3179     -2070.0982    921491.4634        87.3179     -2070.0982

ENERGY:     487     19881.0925     20072.0212      5727.4348       179.4360        -335846.4479     23091.0543         0.0000         0.0000     44503.3491        -222392.0601       161.8910   -266895.4092   -222045.2409       161.8910           -192.2347     -2106.8840    921491.4634      -192.2347     -2106.8840

ENERGY:     488     20125.2097     20156.1359      5723.5441       176.4338        -336552.5448     23118.8614         0.0000         0.0000     44827.0554        -222425.3045       163.0685   -267252.3599   -222057.1942       163.0685          -1145.7533     -2194.6679    921491.4634     -1145.7533     -2194.6679

ENERGY:     489     20526.8869     20236.4606      5718.5749       173.8639        -337540.4649     23156.7308         0.0000         0.0000     45266.1002        -222461.8477       164.6656   -267727.9479   -222045.6089       164.6656          -2511.2403     -2316.7066    921491.4634     -2511.2403     -2316.7066

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

ENERGY:     490     21410.7486     20292.9018      5712.8912       171.8438        -338458.1354     23196.4875         0.0000         0.0000     45213.5628        -222459.6997       164.4745   -267673.2626   -222048.2212       164.4745          -3823.4036     -2437.4154    921491.4634     -3823.4036     -2437.4154

ENERGY:     491     22430.4637     20312.1356      5707.3795       170.5404        -338984.5788     23226.0934         0.0000         0.0000     44733.0089        -222404.9572       162.7264   -267137.9662   -222049.4642       162.7264          -4629.6932     -2524.6215    921491.4634     -4629.6932     -2524.6215

ENERGY:     492     22612.9546     20289.6807      5702.9944       170.0208        -338937.5812     23232.7203         0.0000         0.0000     44542.1951        -222387.0153       162.0323   -266929.2104   -222060.3863       162.0323          -4606.8523     -2557.4730    921491.4634     -4606.8523     -2557.4730

ENERGY:     493     21558.2190     20260.7371      5700.7779       170.3200        -338358.0633     23214.0534         0.0000         0.0000     45033.8230        -222420.1328       163.8207   -267453.9558   -222046.5903       163.8207          -3796.3819     -2540.0996    921491.4634     -3796.3819     -2540.0996

ENERGY:     494     20068.3370     20225.0259      5700.9806       171.2193        -337454.3837     23183.0793         0.0000         0.0000     45622.2475        -222483.4941       165.9612   -268105.7417   -222044.0870       165.9612          -2500.8994     -2482.1069    921491.4634     -2500.8994     -2482.1069

ENERGY:     495     19383.2466     20186.8300      5703.5926       172.5416        -336566.9890     23159.4623         0.0000         0.0000     45484.1231        -222477.1927       165.4587   -267961.3159   -222041.5566       165.4587          -1249.6840     -2407.3057    921491.4634     -1249.6840     -2407.3057

ENERGY:     496     19722.4836     20130.6473      5708.0350       174.0933        -335998.7161     23154.2633         0.0000         0.0000     44699.5272        -222409.6664       162.6046   -267109.1935   -222049.0674       162.6046           -478.9001     -2343.4752    921491.4634      -478.9001     -2343.4752

ENERGY:     497     20212.6668     20059.9178      5713.4613       175.7242        -335952.5047     23166.3543         0.0000         0.0000     44261.0289        -222363.3514       161.0095   -266624.3804   -222042.7504       161.0095           -421.0235     -2316.7929    921491.4634      -421.0235     -2316.7929

ENERGY:     498     20182.0164     19957.1218      5718.5596       177.2604        -336366.4938     23189.3583         0.0000         0.0000     44728.2536        -222413.9237       162.7091   -267142.1773   -222044.5224       162.7091           -993.4680     -2331.6474    921491.4634      -993.4680     -2331.6474

ENERGY:     499     20158.0676     19847.7311      5722.4089       178.6361        -337058.4829     23219.2402         0.0000         0.0000     45439.2646        -222493.1343       165.2956   -267932.3989   -222047.2066       165.2956          -2020.8687     -2376.3391    921491.4634     -2020.8687     -2376.3391

Info: Benchmark time: 4 CPUs 0.457591 s/step 5.29619 days/ns 3224.16 MB memory
TIMING: 500  CPU: 234.172, 0.454352/step  Wall: 234.172, 0.454352/step, 0 hours remaining, 3224.160156 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     20974.8934     19756.6586      5724.4523       179.8271        -337741.4197     23251.1007         0.0000         0.0000     45359.0780        -222495.4095       165.0039   -267854.4876   -222061.0914       165.0039          -3197.5167     -2425.4143    921491.4634     -3197.5167     -2425.4143

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, 3229.609 MB of memory in use
WRITING VELOCITIES TO OUTPUT FILE AT STEP 500
The last velocity output (seq=-2) takes 0.002 seconds, 3229.609 MB of memory in use
====================================================

WallClock: 241.012161  CPUTime: 241.012161  Memory: 3229.609375 MB
[Partition 0][Node 0] End of program
Application 109965757 resources: utime ~947s, stime ~19s, Rss ~126872, inblocks ~67171, outblocks ~72238
Displaying status file:
verified
WALL=241.012161
CPU=241.012161
MEM=3229.609375

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

[workspace] $ /bin/sh -xe /tmp/jenkins1795637790414776720.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