Skipping 716 KB..
Full Log
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ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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LDB: ============= START OF LOAD BALANCING ============== 55.2363
LDB: Largest compute 200 load 0.429119 is 1.2% of average load 36.816448
LDB: Average compute 0.051581 is 0.1% of average load 36.816448
LDB: Partitioning computes with target load 3.681645
LDB: Increased migratable compute count from 2736 to 2736
LDB: Largest unpartitionable compute is 0.056099
LDB: ============== END OF LOAD BALANCING =============== 55.2384
Info: useSync: 1 useProxySync: 0
LDB: =============== DONE WITH MIGRATION ================ 55.2392
Info: Initial time: 4 CPUs 0.473683 s/step 5.48244 days/ns 3221.68 MB memory
TIMING: 100 CPU: 48.3397, 0.472744/step Wall: 48.3397, 0.472744/step, 0.0525271 hours remaining, 3221.683594 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
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ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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LDB: ============= START OF LOAD BALANCING ============== 64.6744
LDB: ============== END OF LOAD BALANCING =============== 64.6745
Info: useSync: 1 useProxySync: 0
LDB: =============== DONE WITH MIGRATION ================ 64.6749
TIMING: 120 CPU: 57.7749, 0.471763/step Wall: 57.7749, 0.471763/step, 0.0497972 hours remaining, 3221.839844 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
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ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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ENERGY: 138 21874.8525 19195.4803 5730.8549 192.8766 -333203.4344 21083.5324 0.0000 0.0000 42784.9639 -222340.8738 155.6399 -265125.8378 -222213.1815 155.6399 -2704.7055 -2927.3525 921491.4634 -2704.7055 -2927.3525
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TIMING: 140 CPU: 67.202, 0.471354/step Wall: 67.202, 0.471354/step, 0.0471354 hours remaining, 3222.011719 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
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ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
ENERGY: 150 21015.8994 19956.3834 5767.3089 192.0924 -334899.3753 20845.5771 0.0000 0.0000 44606.5898 -222515.5244 162.2665 -267122.1142 -222153.2665 162.2665 -4472.9374 -2881.9210 921491.4634 -4472.9374 -2881.9210
ENERGY: 151 20656.1101 20586.9276 5763.7530 189.5631 -335303.4338 20835.7246 0.0000 0.0000 44710.6379 -222560.7174 162.6450 -267271.3554 -222155.1378 162.6450 -5407.8407 -2907.6330 921491.4634 -5407.8407 -2907.6330
ENERGY: 152 21757.0224 21203.4203 5761.8055 186.4838 -335072.1089 20820.7500 0.0000 0.0000 42914.6705 -222427.9563 156.1118 -265342.6269 -222175.0515 156.1118 -5552.0273 -2878.0876 921491.4634 -5552.0273 -2878.0876
ENERGY: 153 22396.4537 21618.6023 5761.5688 183.0547 -334307.6861 20787.1624 0.0000 0.0000 41296.2811 -222264.5631 150.2245 -263560.8442 -222152.0204 150.2245 -4765.4777 -2800.4122 921491.4634 -4765.4777 -2800.4122
ENERGY: 154 20952.1343 21640.3348 5761.9239 179.5647 -333344.9135 20735.3658 0.0000 0.0000 41746.1291 -222329.4608 151.8609 -264075.5900 -222148.7915 151.8609 -3178.1874 -2707.3606 921491.4634 -3178.1874 -2707.3606
ENERGY: 155 18734.5491 21249.5941 5761.4993 176.3183 -332564.0955 20691.4723 0.0000 0.0000 43448.4574 -222502.2051 158.0535 -265950.6625 -222145.9854 158.0535 -1408.3063 -2623.9032 921491.4634 -1408.3063 -2623.9032
ENERGY: 156 18312.4483 20599.9074 5758.8570 173.6449 -332218.9145 20684.3829 0.0000 0.0000 44137.5522 -222552.1217 160.5603 -266689.6739 -222166.8046 160.5603 -219.5095 -2571.5313 921491.4634 -219.5095 -2571.5313
ENERGY: 157 20043.0837 19943.2666 5753.0947 171.8900 -332363.0656 20715.7864 0.0000 0.0000 43325.6934 -222410.2509 157.6070 -265735.9443 -222155.5008 157.6070 -38.8543 -2554.7665 921491.4634 -38.8543 -2554.7665
ENERGY: 158 21695.0846 19425.3239 5743.5667 171.3409 -332829.8100 20761.5805 0.0000 0.0000 42713.6820 -222319.2314 155.3806 -265032.9134 -222157.3219 155.3806 -715.5935 -2586.7969 921491.4634 -715.5935 -2586.7969
ENERGY: 159 21695.6536 19084.6409 5730.9315 172.1899 -333376.4005 20800.7929 0.0000 0.0000 43483.6005 -222408.5911 158.1814 -265892.1916 -222160.0968 158.1814 -1882.1013 -2660.7875 921491.4634 -1882.1013 -2660.7875
TIMING: 160 CPU: 76.6197, 0.470883/step Wall: 76.6197, 0.470883/step, 0.0444723 hours remaining, 3222.234375 MB of memory in use.
ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
ENERGY: 160 21093.2844 18859.3045 5717.0749 174.4916 -333735.9155 20833.5471 0.0000 0.0000 44515.8597 -222542.3534 161.9365 -267058.2130 -222175.6787 161.9365 -3202.8706 -2752.7604 921491.4634 -3202.8706 -2752.7604
ENERGY: 161 21561.6003 18685.5959 5704.9782 178.2042 -333710.7598 20865.7132 0.0000 0.0000 44220.7113 -222493.9567 160.8628 -266714.6680 -222160.9739 160.8628 -4385.1103 -2823.4852 921491.4634 -4385.1103 -2823.4852
ENERGY: 162 22512.8126 18508.1492 5697.2826 183.0024 -333202.6497 20887.8856 0.0000 0.0000 43070.6067 -222342.9105 156.6790 -265413.5172 -222161.4907 156.6790 -5004.1555 -2859.8871 921491.4634 -5004.1555 -2859.8871
ENERGY: 163 21937.9852 18346.8656 5696.1509 188.4544 -332368.8224 20884.6196 0.0000 0.0000 43005.6961 -222309.0505 156.4429 -265314.7467 -222160.7802 156.4429 -4776.8220 -2868.7270 921491.4634 -4776.8220 -2868.7270
ENERGY: 164 19652.8065 18261.0400 5702.5306 194.0206 -331567.4468 20861.9109 0.0000 0.0000 44426.5344 -222468.6038 161.6115 -266895.1381 -222170.9033 161.6115 -3836.1732 -2870.4449 921491.4634 -3836.1732 -2870.4449
ENERGY: 165 18074.0951 18343.8150 5716.1638 199.2019 -331183.0464 20849.6743 0.0000 0.0000 45425.8563 -222574.2400 165.2468 -268000.0963 -222153.1697 165.2468 -2737.5185 -2867.1446 921491.4634 -2737.5185 -2867.1446
ENERGY: 166 18979.7069 18650.1654 5734.9735 203.3281 -331407.1000 20870.8939 0.0000 0.0000 44483.6889 -222484.3434 161.8194 -266968.0323 -222151.2326 161.8194 -1964.3634 -2870.3839 921491.4634 -1964.3634 -2870.3839
ENERGY: 167 21026.8306 19216.2867 5755.9248 205.8794 -332212.1859 20917.6389 0.0000 0.0000 42775.8062 -222313.8194 155.6066 -265089.6257 -222150.5297 155.6066 -1671.2498 -2889.5868 921491.4634 -1671.2498 -2889.5868
ENERGY: 168 21619.4181 19999.6889 5775.3367 206.4584 -333382.4925 20963.4338 0.0000 0.0000 42492.3351 -222325.8216 154.5754 -264818.1567 -222149.7707 154.5754 -1735.9904 -2933.5976 921491.4634 -1735.9904 -2933.5976
ENERGY: 169 20648.4665 20870.4068 5789.9166 204.9287 -334596.5071 20994.5723 0.0000 0.0000 43600.1911 -222488.0250 158.6055 -266088.2162 -222133.5315 158.6055 -2095.8776 -2988.7947 921491.4634 -2095.8776 -2988.7947
ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
ENERGY: 170 20485.0015 21574.3800 5797.0542 201.1981 -335480.2503 21017.8094 0.0000 0.0000 43834.2690 -222570.5381 159.4570 -266404.8071 -222135.2419 159.4570 -2696.1968 -3030.4960 921491.4634 -2696.1968 -3030.4960
ENERGY: 171 22225.3643 21884.1726 5796.1347 195.5169 -335757.0017 21036.7488 0.0000 0.0000 42205.8540 -222413.2103 153.5333 -264619.0643 -222135.5891 153.5333 -3373.1627 -3035.3578 921491.4634 -3373.1627 -3035.3578
ENERGY: 172 23612.5243 21689.2905 5788.4217 188.3823 -335345.7510 21036.2039 0.0000 0.0000 40787.7257 -222243.2026 148.3745 -263030.9283 -222132.3042 148.3745 -3754.4380 -3004.4813 921491.4634 -3754.4380 -3004.4813
ENERGY: 173 22089.5492 21081.4672 5776.7002 180.5475 -334414.6779 21003.0505 0.0000 0.0000 41986.3986 -222296.9647 152.7350 -264283.3633 -222121.1461 152.7350 -3608.5986 -2944.3814 921491.4634 -3608.5986 -2944.3814
ENERGY: 174 18699.8472 20250.6918 5763.7521 172.7179 -333314.9343 20954.5022 0.0000 0.0000 44924.4954 -222548.9278 163.4230 -267473.4232 -222120.6679 163.4230 -3086.0087 -2871.4631 921491.4634 -3086.0087 -2871.4631
ENERGY: 175 17219.9375 19455.5736 5752.1494 165.6559 -332464.6997 20928.3118 0.0000 0.0000 46291.0145 -222652.0570 168.3940 -268943.0715 -222120.1886 168.3940 -2676.4053 -2794.4451 921491.4634 -2676.4053 -2794.4451
ENERGY: 176 19195.1038 18891.7630 5743.5896 160.0071 -332124.2129 20943.2095 0.0000 0.0000 44722.5121 -222468.0278 162.6882 -267190.5399 -222127.3370 162.6882 -2658.3219 -2727.5044 921491.4634 -2658.3219 -2727.5044
ENERGY: 177 21863.3195 18664.1735 5738.9484 156.2659 -332371.2413 20981.6518 0.0000 0.0000 42714.2625 -222252.6196 155.3827 -264966.8821 -222125.5137 155.3827 -2870.6844 -2681.8089 921491.4634 -2870.6844 -2681.8089
ENERGY: 178 21917.7899 18733.9559 5737.6245 154.5770 -332975.2976 21015.2133 0.0000 0.0000 43101.1546 -222314.9825 156.7902 -265416.1370 -222126.1322 156.7902 -2936.2255 -2665.7682 921491.4634 -2936.2255 -2665.7682
ENERGY: 179 20058.5719 19018.0839 5738.2698 154.9022 -333648.1819 21038.3004 0.0000 0.0000 45070.9165 -222569.1372 163.9556 -267640.0538 -222127.1794 163.9556 -2805.2708 -2668.3444 921491.4634 -2805.2708 -2668.3444
TIMING: 180 CPU: 86.0265, 0.470339/step Wall: 86.0265, 0.470339/step, 0.0418079 hours remaining, 3222.234375 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 19770.2944 19384.7963 5738.8341 156.9935 -334084.3523 21065.2916 0.0000 0.0000 45324.2214 -222643.9210 164.8771 -267968.1424 -222142.6343 164.8771 -2684.8630 -2671.3560 921491.4634 -2684.8630 -2671.3560
ENERGY: 181 22122.8096 19693.8082 5737.3498 160.4696 -334134.1966 21097.1423 0.0000 0.0000 42906.0428 -222416.5744 156.0804 -265322.6172 -222134.4680 156.0804 -2655.0379 -2656.7563 921491.4634 -2655.0379 -2656.7563
ENERGY: 182 23922.3458 19800.0772 5732.0748 164.8150 -333691.2981 21109.5294 0.0000 0.0000 40770.0178 -222192.4382 148.3101 -262962.4560 -222132.7633 148.3101 -2461.5987 -2635.7203 921491.4634 -2461.5987 -2635.7203
ENERGY: 183 22149.3487 19677.1533 5722.7616 169.5349 -332921.8734 21084.4911 0.0000 0.0000 41834.8233 -222283.7605 152.1836 -264118.5838 -222131.2588 152.1836 -1990.8046 -2626.5157 921491.4634 -1990.8046 -2626.5157
ENERGY: 184 18376.8755 19424.9914 5710.5469 174.1844 -332181.9079 21042.4479 0.0000 0.0000 44880.5526 -222572.3091 163.2631 -267452.8617 -222144.6143 163.2631 -1576.6175 -2645.2274 921491.4634 -1576.6175 -2645.2274
ENERGY: 185 16957.7743 19234.6872 5697.7241 178.4155 -331895.6960 21023.9443 0.0000 0.0000 46149.4986 -222653.6519 167.8792 -268803.1505 -222128.1657 167.8792 -1752.9882 -2679.2077 921491.4634 -1752.9882 -2679.2077
ENERGY: 186 19266.0405 19234.9570 5686.4352 181.9571 -332240.0935 21043.7459 0.0000 0.0000 44391.5886 -222435.3692 161.4844 -266826.9578 -222129.2888 161.4844 -2596.4731 -2731.4263 921491.4634 -2596.4731 -2731.4263
ENERGY: 187 22073.2967 19471.4302 5678.7398 184.6336 -333156.1125 21076.9265 0.0000 0.0000 42449.0055 -222222.0802 154.4178 -264671.0857 -222130.9080 154.4178 -3641.8535 -2802.0866 921491.4634 -3641.8535 -2802.0866
ENERGY: 188 22101.1829 19886.6772 5676.0120 186.3502 -334382.7609 21093.9045 0.0000 0.0000 43113.1615 -222325.4726 156.8338 -265438.6341 -222135.3908 156.8338 -4316.2654 -2887.0591 921491.4634 -4316.2654 -2887.0591
ENERGY: 189 20394.2462 20391.8601 5678.8863 187.1154 -335558.5039 21096.5840 0.0000 0.0000 45245.6387 -222564.1731 164.5912 -267809.8118 -222116.4323 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 20342.0727 20848.4448 5686.3598 187.0164 -336318.7432 21106.5487 0.0000 0.0000 45533.2634 -222615.0374 165.6375 -268148.3008 -222116.1590 165.6375 -4141.9211 -2962.8209 921491.4634 -4141.9211 -2962.8209
ENERGY: 191 22534.8507 21157.2827 5696.5257 186.2614 -336419.5251 21124.8644 0.0000 0.0000 43330.7336 -222389.0066 157.6253 -265719.7402 -222114.1140 157.6253 -3471.5978 -2915.5481 921491.4634 -3471.5978 -2915.5481
ENERGY: 192 23768.4831 21244.3748 5706.8010 185.1520 -335814.4793 21125.1404 0.0000 0.0000 41560.2537 -222224.2742 151.1848 -263784.5279 -222108.6419 151.1848 -2412.4656 -2830.7902 921491.4634 -2412.4656 -2830.7902
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ENERGY: 195 17581.7011 20169.9816 5719.7968 183.0839 -332603.8309 21048.2209 0.0000 0.0000 45307.7485 -222593.2981 164.8171 -267901.0466 -222091.6062 164.8171 -398.0876 -2592.7756 921491.4634 -398.0876 -2592.7756
ENERGY: 196 19755.8661 19594.9320 5717.4229 183.5644 -332319.6951 21082.8579 0.0000 0.0000 43603.6155 -222381.4362 158.6180 -265985.0517 -222096.3128 158.6180 -1480.5939 -2574.8092 921491.4634 -1480.5939 -2574.8092
ENERGY: 197 21700.3669 19122.7580 5714.1451 184.7200 -332668.2731 21129.4588 0.0000 0.0000 42574.3655 -222242.4588 154.8738 -264816.8243 -222086.7180 154.8738 -3040.7436 -2596.5494 921491.4634 -3040.7436 -2596.5494
ENERGY: 198 21224.0060 18800.3006 5711.3574 186.3640 -333385.4998 21161.1533 0.0000 0.0000 43911.2864 -222391.0321 159.7372 -266302.3185 -222090.4392 159.7372 -4381.6808 -2646.7680 921491.4634 -4381.6808 -2646.7680
ENERGY: 199 20113.4048 18634.4039 5710.3429 188.2374 -334151.8588 21182.1777 0.0000 0.0000 45722.9589 -222600.3331 166.3276 -268323.2920 -222093.2751 166.3276 -5152.2286 -2691.5412 921491.4634 -5152.2286 -2691.5412
LDB: ============= START OF LOAD BALANCING ============== 102.334
LDB: Largest compute 200 load 0.424641 is 1.2% of average load 36.640738
LDB: Average compute 0.051332 is 0.1% of average load 36.640738
LDB: TIME 102.336 LOAD: AVG 36.6407 MAX 37.659 PROXIES: TOTAL 112 MAXPE 28 MAXPATCH 1 None MEM: 3222.61 MB
LDB: TIME 102.338 LOAD: AVG 36.6407 MAX 37.6081 PROXIES: TOTAL 112 MAXPE 28 MAXPATCH 1 TorusLB MEM: 3222.61 MB
LDB: ============== END OF LOAD BALANCING =============== 102.34
Info: useSync: 1 useProxySync: 0
LDB: =============== DONE WITH MIGRATION ================ 102.343
Info: Initial time: 4 CPUs 0.470945 s/step 5.45076 days/ns 3223.46 MB memory
TIMING: 200 CPU: 95.4437, 0.470863/step Wall: 95.4437, 0.470863/step, 0.0392386 hours remaining, 3223.457031 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 21073.6838 18595.6349 5711.8747 190.0258 -334670.2813 21209.9247 0.0000 0.0000 45319.1600 -222569.9773 164.8586 -267889.1374 -222114.5246 164.8586 -5241.8527 -2703.6813 921491.4634 -5241.8527 -2703.6813
ENERGY: 201 23380.1032 18674.3332 5716.2802 191.4188 -334751.7133 21239.1340 0.0000 0.0000 43222.4694 -222327.9744 157.2315 -265550.4438 -222100.1080 157.2315 -4546.2006 -2661.1901 921491.4634 -4546.2006 -2661.1901
ENERGY: 202 23622.8118 18850.8449 5722.5980 192.1474 -334305.3007 21243.2752 0.0000 0.0000 42432.5587 -222241.0648 154.3580 -264673.6235 -222096.8292 154.3580 -3005.0520 -2588.0014 921491.4634 -3005.0520 -2588.0014
ENERGY: 203 20743.8946 19130.0389 5729.2400 192.0764 -333501.9373 21215.8254 0.0000 0.0000 44059.6985 -222431.1636 160.2771 -266490.8621 -222093.6428 160.2771 -1046.8258 -2512.4435 921491.4634 -1046.8258 -2512.4435
ENERGY: 204 17862.6124 19486.9555 5734.1463 191.2124 -332722.2199 21188.8402 0.0000 0.0000 45629.4719 -222628.9812 165.9875 -268258.4531 -222116.7005 165.9875 452.9933 -2462.2930 921491.4634 452.9933 -2462.2930
ENERGY: 205 18189.0790 19868.9413 5735.7153 189.6741 -332398.2550 21197.9185 0.0000 0.0000 44690.7149 -222526.2120 162.5725 -267216.9268 -222099.8063 162.5725 731.8536 -2447.6354 921491.4634 731.8536 -2447.6354
ENERGY: 206 20668.8901 20170.9984 5732.9811 187.6404 -332716.3434 21241.8391 0.0000 0.0000 42439.0584 -222274.9359 154.3816 -264713.9943 -222100.3400 154.3816 -230.6567 -2488.2937 921491.4634 -230.6567 -2488.2937
ENERGY: 207 21693.8031 20338.2889 5726.5434 185.3060 -333603.9791 21289.9001 0.0000 0.0000 42143.6914 -222226.4462 153.3072 -264370.1375 -222103.0935 153.3072 -1896.3477 -2585.9683 921491.4634 -1896.3477 -2585.9683
ENERGY: 208 20293.2703 20371.8902 5718.1572 182.8654 -334789.2377 21322.2409 0.0000 0.0000 44428.6270 -222472.1866 161.6191 -266900.8136 -222122.6315 161.6191 -3669.0642 -2719.7952 921491.4634 -3669.0642 -2719.7952
ENERGY: 209 19428.8171 20325.0058 5710.3389 180.5135 -335910.2414 21349.5044 0.0000 0.0000 46273.6801 -222642.3816 168.3309 -268916.0617 -222106.7901 168.3309 -5197.7274 -2836.6306 921491.4634 -5197.7274 -2836.6306
ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
ENERGY: 210 21385.1736 20194.2569 5705.3139 178.4614 -336615.7770 21385.1095 0.0000 0.0000 45251.4334 -222516.0282 164.6123 -267767.4616 -222108.2016 164.6123 -6091.3664 -2896.2627 921491.4634 -6091.3664 -2896.2627
ENERGY: 211 24099.1930 19985.8633 5704.9373 176.9105 -336667.8930 21415.1477 0.0000 0.0000 43031.7285 -222254.1128 156.5376 -265285.8413 -222106.8542 156.5376 -5900.2979 -2885.1010 921491.4634 -5900.2979 -2885.1010
ENERGY: 212 23739.2711 19730.8223 5710.0295 176.0352 -336013.6228 21412.5982 0.0000 0.0000 42995.1638 -222249.7026 156.4046 -265244.8664 -222104.2319 156.4046 -4424.1004 -2820.3211 921491.4634 -4424.1004 -2820.3211
ENERGY: 213 20150.2161 19524.5250 5720.1722 175.9508 -334874.6445 21380.5551 0.0000 0.0000 45418.7806 -222504.4447 165.2210 -267923.2253 -222097.3835 165.2210 -2174.3118 -2725.0842 921491.4634 -2174.3118 -2725.0842
ENERGY: 214 17315.5528 19421.7449 5733.3059 176.6827 -333645.3937 21358.4485 0.0000 0.0000 46958.4703 -222681.1885 170.8220 -269639.6588 -222093.7407 170.8220 -143.6685 -2626.0579 921491.4634 -143.6685 -2626.0579
ENERGY: 215 18210.5055 19441.9744 5746.5772 178.1492 -332787.3322 21379.5596 0.0000 0.0000 45302.6747 -222527.8917 164.7987 -267830.5663 -222091.0447 164.7987 784.0015 -2554.0368 921491.4634 784.0015 -2554.0368
ENERGY: 216 20973.4717 19522.5062 5756.9571 180.1770 -332560.1062 21436.4835 0.0000 0.0000 42442.1789 -222248.3318 154.3930 -264690.5107 -222073.6156 154.3930 420.9903 -2541.5428 921491.4634 420.9903 -2541.5428
ENERGY: 217 21778.3867 19581.4820 5762.2416 182.5517 -333010.6759 21497.2705 0.0000 0.0000 41983.6751 -222225.0683 152.7251 -264208.7434 -222064.4465 152.7251 -882.1698 -2598.7243 921491.4634 -882.1698 -2598.7243
ENERGY: 218 20165.9157 19540.0890 5761.2415 184.9927 -333856.1148 21546.6561 0.0000 0.0000 44178.6838 -222478.5361 160.7099 -266657.2199 -222068.8155 160.7099 -2628.0652 -2703.9746 921491.4634 -2628.0652 -2703.9746
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TIMING: 220 CPU: 104.886, 0.472122/step Wall: 104.886, 0.472122/step, 0.0367206 hours remaining, 3223.457031 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
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ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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TIMING: 240 CPU: 114.321, 0.471716/step Wall: 114.321, 0.471716/step, 0.0340684 hours remaining, 3223.457031 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
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ENERGY: 242 22110.7717 20111.8208 5758.5347 169.0441 -335904.8196 21831.0568 0.0000 0.0000 43526.8720 -222396.7195 158.3388 -265923.5915 -222063.5736 158.3388 -4623.1690 -2633.0914 921491.4634 -4623.1690 -2633.0914
ENERGY: 243 19462.3620 19969.6444 5749.3614 168.8705 -335233.7068 21770.4748 0.0000 0.0000 45537.0691 -222575.9246 165.6513 -268112.9936 -222061.6674 165.6513 -3760.4506 -2614.6993 921491.4634 -3760.4506 -2614.6993
ENERGY: 244 18822.2463 19849.3933 5737.4544 169.6534 -334482.6008 21720.5676 0.0000 0.0000 45629.1663 -222554.1194 165.9864 -268183.2857 -222078.7770 165.9864 -2667.7297 -2573.2149 921491.4634 -2667.7297 -2573.2149
ENERGY: 245 20148.2367 19811.7599 5725.7784 171.4559 -334087.5945 21701.2470 0.0000 0.0000 44168.5248 -222360.5917 160.6730 -266529.1165 -222068.6365 160.6730 -1771.6899 -2533.5454 921491.4634 -1771.6899 -2533.5454
ENERGY: 246 20878.5480 19853.7024 5716.8932 174.1558 -334213.1204 21705.0851 0.0000 0.0000 43600.4182 -222284.3178 158.6063 -265884.7360 -222067.4295 158.6063 -1173.7928 -2523.3912 921491.4634 -1173.7928 -2523.3912
ENERGY: 247 19868.5285 19979.6440 5712.7400 177.5412 -334802.1841 21719.8455 0.0000 0.0000 44912.1912 -222431.6937 163.3782 -267343.8849 -222068.1393 163.3782 -982.9999 -2552.5930 921491.4634 -982.9999 -2552.5930
ENERGY: 248 19035.4924 20164.4297 5713.8450 181.3144 -335623.1353 21746.4311 0.0000 0.0000 46185.9362 -222595.6865 168.0117 -268781.6227 -222090.3127 168.0117 -1359.1247 -2608.3066 921491.4634 -1359.1247 -2608.3066
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ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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ENERGY: 252 21994.9042 20013.1599 5733.2541 193.8023 -336093.2677 21826.9296 0.0000 0.0000 43905.3721 -222425.8456 159.7157 -266331.2177 -222091.3305 159.7157 -3843.4682 -2758.0338 921491.4634 -3843.4682 -2758.0338
ENERGY: 253 19499.8638 19667.1121 5729.5496 195.2411 -334977.1807 21784.0537 0.0000 0.0000 45520.0193 -222581.3412 165.5893 -268101.3605 -222082.7205 165.5893 -3300.1273 -2735.8131 921491.4634 -3300.1273 -2735.8131
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ENERGY: 255 20324.2311 19109.4101 5707.6062 196.0620 -333099.9232 21746.1515 0.0000 0.0000 43667.4213 -222349.0410 158.8501 -266016.4623 -222078.3975 158.8501 -2282.5423 -2662.7814 921491.4634 -2282.5423 -2662.7814
ENERGY: 256 20899.4409 18950.9577 5693.4518 195.6570 -332975.5972 21757.6848 0.0000 0.0000 43181.1613 -222297.2437 157.0812 -265478.4050 -222071.2738 157.0812 -2042.2408 -2664.5199 921491.4634 -2042.2408 -2664.5199
ENERGY: 257 20029.5653 18878.1873 5681.1759 194.7976 -333481.0039 21780.2419 0.0000 0.0000 44488.5469 -222428.4890 161.8371 -266917.0359 -222060.1683 161.8371 -2035.5362 -2692.1442 921491.4634 -2035.5362 -2692.1442
ENERGY: 258 19453.5867 18882.0666 5673.2911 193.6684 -334373.1545 21817.5078 0.0000 0.0000 45796.2578 -222556.7761 166.5942 -268353.0339 -222062.0607 166.5942 -2331.2328 -2737.1920 921491.4634 -2331.2328 -2737.1920
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TIMING: 260 CPU: 123.744, 0.471175/step Wall: 123.744, 0.471175/step, 0.0314117 hours remaining, 3223.761719 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
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ENERGY: 262 21606.2724 19814.6777 5694.0656 188.7122 -336291.7860 21947.6074 0.0000 0.0000 44601.6347 -222438.8160 162.2485 -267040.4506 -222052.4322 162.2485 -3214.7560 -2810.4636 921491.4634 -3214.7560 -2810.4636
ENERGY: 263 19781.1228 20140.5622 5703.8103 187.9445 -335614.9713 21924.4740 0.0000 0.0000 45349.7772 -222527.2804 164.9700 -267877.0575 -222051.1547 164.9700 -2647.8114 -2773.3902 921491.4634 -2647.8114 -2773.3902
ENERGY: 264 19385.2259 20436.4305 5710.6950 187.5052 -334855.9510 21907.7772 0.0000 0.0000 44751.4784 -222476.8387 162.7936 -267228.3171 -222069.1981 162.7936 -2191.1925 -2723.5293 921491.4634 -2191.1925 -2723.5293
ENERGY: 265 19946.8414 20681.9926 5713.6241 187.4392 -334395.6630 21906.0163 0.0000 0.0000 43607.6374 -222352.1119 158.6326 -265959.7493 -222054.3370 158.6326 -2038.0571 -2683.6034 921491.4634 -2038.0571 -2683.6034
ENERGY: 266 20048.7898 20788.8701 5712.1327 187.6137 -334399.4574 21914.4805 0.0000 0.0000 43399.3796 -222348.1910 157.8750 -265747.5706 -222054.3632 157.8750 -2130.7239 -2664.5955 921491.4634 -2130.7239 -2664.5955
ENERGY: 267 19648.0904 20691.2679 5707.0583 187.8501 -334831.4853 21930.8374 0.0000 0.0000 44220.2168 -222446.1644 160.8610 -266666.3812 -222055.6582 160.8610 -2435.4234 -2662.6782 921491.4634 -2435.4234 -2662.6782
ENERGY: 268 19962.9160 20375.7516 5700.1930 187.9286 -335513.7449 21959.1257 0.0000 0.0000 44823.5376 -222504.2924 163.0557 -267327.8300 -222075.9874 163.0557 -2903.2125 -2658.6180 921491.4634 -2903.2125 -2658.6180
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ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
ENERGY: 270 22620.1934 19450.9167 5690.3173 187.1618 -336650.6774 22028.8070 0.0000 0.0000 44308.0074 -222365.2737 161.1804 -266673.2812 -222067.0434 161.1804 -3583.3634 -2617.7582 921491.4634 -3583.3634 -2617.7582
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ENERGY: 272 21021.5584 18896.0660 5692.8269 184.9335 -335921.4614 22015.0580 0.0000 0.0000 45607.7077 -222503.3109 165.9083 -268111.0186 -222081.1571 165.9083 -2551.9684 -2501.8804 921491.4634 -2551.9684 -2501.8804
ENERGY: 273 20123.2136 18932.9079 5697.5118 183.8526 -334925.7012 21985.5296 0.0000 0.0000 45502.7162 -222499.9695 165.5264 -268002.6856 -222069.0458 165.5264 -1837.1975 -2434.6760 921491.4634 -1837.1975 -2434.6760
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ENERGY: 276 19401.8502 19594.7508 5701.2547 182.4904 -333292.1278 21971.0410 0.0000 0.0000 44028.5271 -222412.2137 160.1637 -266440.7409 -222072.9392 160.1637 -1580.1299 -2417.6040 921491.4634 -1580.1299 -2417.6040
ENERGY: 277 19149.2972 19724.7160 5695.5210 182.9396 -333864.3451 21997.2387 0.0000 0.0000 44632.8112 -222481.8214 162.3619 -267114.6326 -222061.0985 162.3619 -2311.7544 -2498.0545 921491.4634 -2311.7544 -2498.0545
ENERGY: 278 20199.4577 19713.7760 5686.9122 183.6585 -334821.1001 22041.3359 0.0000 0.0000 44532.2540 -222463.7058 161.9961 -266995.9599 -222063.4128 161.9961 -3254.8157 -2593.7696 921491.4634 -3254.8157 -2593.7696
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TIMING: 280 CPU: 133.152, 0.470404/step Wall: 133.152, 0.470404/step, 0.0287469 hours remaining, 3223.761719 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
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ENERGY: 286 19396.6310 20966.5623 5721.5031 185.8229 -334658.1148 22176.6863 0.0000 0.0000 43785.6882 -222425.2209 159.2803 -266210.9091 -222054.0579 159.2803 -1306.7501 -2717.2847 921491.4634 -1306.7501 -2717.2847
ENERGY: 287 19176.1190 20856.7823 5731.9346 184.4714 -334918.1479 22200.2910 0.0000 0.0000 44282.9439 -222485.6056 161.0892 -266768.5495 -222055.7250 161.0892 -2148.9612 -2753.3344 921491.4634 -2148.9612 -2753.3344
ENERGY: 288 20263.2088 20475.2851 5736.9557 182.7335 -335468.3148 22237.9037 0.0000 0.0000 44116.9907 -222455.2373 160.4855 -266572.2280 -222066.9051 160.4855 -3310.5879 -2790.1554 921491.4634 -3310.5879 -2790.1554
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ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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LDB: ============= START OF LOAD BALANCING ============== 149.472
LDB: Largest compute 200 load 0.519970 is 1.1% of average load 45.718269
LDB: Average compute 0.064056 is 0.1% of average load 45.718269
LDB: TIME 149.473 LOAD: AVG 45.7183 MAX 47.1289 PROXIES: TOTAL 112 MAXPE 28 MAXPATCH 1 None MEM: 3224.18 MB
LDB: TIME 149.474 LOAD: AVG 45.7183 MAX 47.1289 PROXIES: TOTAL 112 MAXPE 28 MAXPATCH 1 RefineTorusLB MEM: 3224.18 MB
LDB: TIME 149.479 LOAD: AVG 45.7183 MAX 46.2206 PROXIES: TOTAL 114 MAXPE 30 MAXPATCH 2 RefineTorusLB MEM: 3224.18 MB
LDB: ============== END OF LOAD BALANCING =============== 149.48
Info: useSync: 1 useProxySync: 0
LDB: =============== DONE WITH MIGRATION ================ 149.481
Info: Initial time: 4 CPUs 0.470925 s/step 5.45052 days/ns 3224.18 MB memory
TIMING: 300 CPU: 142.546, 0.469675/step Wall: 142.546, 0.469675/step, 0.026093 hours remaining, 3224.183594 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
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ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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TIMING: 320 CPU: 151.767, 0.461067/step Wall: 151.767, 0.461067/step, 0.0230534 hours remaining, 3224.183594 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
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ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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TIMING: 340 CPU: 160.98, 0.46063/step Wall: 160.98, 0.46063/step, 0.0204725 hours remaining, 3224.183594 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
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ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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TIMING: 360 CPU: 170.186, 0.46032/step Wall: 170.186, 0.46032/step, 0.0179013 hours remaining, 3224.183594 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
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ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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ENERGY: 378 20473.8100 20495.6594 5711.4639 183.2952 -336584.2282 22821.5835 0.0000 0.0000 44474.7541 -222423.6621 161.7869 -266898.4162 -222044.3967 161.7869 -2972.9874 -2523.3500 921491.4634 -2972.9874 -2523.3500
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TIMING: 380 CPU: 179.385, 0.45997/step Wall: 179.385, 0.45997/step, 0.0153323 hours remaining, 3224.183594 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
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ENERGY: 386 19981.2272 19220.9463 5707.6637 175.9384 -334865.1819 22880.7957 0.0000 0.0000 44519.8589 -222378.7515 161.9510 -266898.6105 -222051.0437 161.9510 122.6670 -2011.2428 921491.4634 122.6670 -2011.2428
ENERGY: 387 20367.2859 19202.4844 5710.9354 174.6759 -335109.8727 22905.2743 0.0000 0.0000 44377.1818 -222372.0349 161.4320 -266749.2168 -222053.0050 161.4320 -738.9584 -2019.1689 921491.4634 -738.9584 -2019.1689
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ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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LDB: ============= START OF LOAD BALANCING ============== 195.519
LDB: Largest compute 230 load 0.523229 is 1.1% of average load 45.690972
LDB: Average compute 0.063986 is 0.1% of average load 45.690972
LDB: TIME 195.52 LOAD: AVG 45.691 MAX 46.038 PROXIES: TOTAL 112 MAXPE 28 MAXPATCH 1 None MEM: 3224.18 MB
LDB: TIME 195.521 LOAD: AVG 45.691 MAX 46.038 PROXIES: TOTAL 114 MAXPE 30 MAXPATCH 2 RefineTorusLB MEM: 3224.18 MB
LDB: TIME 195.521 LOAD: AVG 45.691 MAX 46.038 PROXIES: TOTAL 114 MAXPE 30 MAXPATCH 2 RefineTorusLB MEM: 3224.18 MB
LDB: ============== END OF LOAD BALANCING =============== 195.522
Info: useSync: 1 useProxySync: 0
LDB: =============== DONE WITH MIGRATION ================ 195.522
Info: Benchmark time: 4 CPUs 0.460359 s/step 5.32823 days/ns 3224.18 MB memory
TIMING: 400 CPU: 188.585, 0.460001/step Wall: 188.585, 0.460001/step, 0.0127778 hours remaining, 3224.183594 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
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ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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ENERGY: 416 19942.3169 20661.9898 5710.0857 195.6954 -336157.5871 23063.1719 0.0000 0.0000 44200.2854 -222384.0421 160.7885 -266584.3275 -222052.9644 160.7885 -282.7611 -2224.6896 921491.4634 -282.7611 -2224.6896
ENERGY: 417 20031.3749 20631.3211 5709.0494 192.4696 -336373.1085 23072.1103 0.0000 0.0000 44338.4623 -222398.3209 161.2911 -266736.7832 -222044.6993 161.2911 -112.4551 -2227.1699 921491.4634 -112.4551 -2227.1699
ENERGY: 418 20154.6649 20457.0911 5705.5847 188.6537 -336970.7877 23098.6730 0.0000 0.0000 44915.1425 -222450.9778 163.3889 -267366.1203 -222046.7093 163.3889 -671.8545 -2269.9921 921491.4634 -671.8545 -2269.9921
ENERGY: 419 20790.7633 20185.5525 5700.4810 184.6055 -337717.8766 23139.8026 0.0000 0.0000 45250.3103 -222466.3613 164.6082 -267716.6716 -222049.5950 164.6082 -1783.9421 -2336.6464 921491.4634 -1783.9421 -2336.6464
TIMING: 420 CPU: 197.76, 0.45871/step Wall: 197.76, 0.45871/step, 0.0101936 hours remaining, 3224.183594 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
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ENERGY: 423 21418.8986 19324.4271 5689.6736 172.2146 -337416.8958 23180.6042 0.0000 0.0000 45183.9716 -222447.1062 164.3669 -267631.0777 -222051.5231 164.3669 -3955.8306 -2434.9305 921491.4634 -3955.8306 -2434.9305
ENERGY: 424 20531.3310 19270.7814 5692.6542 170.6563 -336406.2767 23140.4648 0.0000 0.0000 45151.0460 -222449.3430 164.2471 -267600.3890 -222060.4127 164.2471 -3030.1608 -2370.2033 921491.4634 -3030.1608 -2370.2033
ENERGY: 425 19942.3361 19314.5606 5697.3263 169.6876 -335607.5209 23103.7922 0.0000 0.0000 44956.0484 -222423.7697 163.5377 -267379.8181 -222050.7963 163.5377 -1980.9652 -2297.0089 921491.4634 -1980.9652 -2297.0089
ENERGY: 426 19603.3346 19432.3068 5702.4947 169.0990 -335270.6879 23080.2895 0.0000 0.0000 44862.7388 -222420.4246 163.1983 -267283.1634 -222049.1089 163.1983 -1125.8049 -2237.7214 921491.4634 -1125.8049 -2237.7214
ENERGY: 427 19598.5316 19595.2897 5707.1504 168.7509 -335498.4323 23074.5009 0.0000 0.0000 44915.2777 -222438.9310 163.3894 -267354.2087 -222048.7337 163.3894 -741.9008 -2207.6354 921491.4634 -741.9008 -2207.6354
ENERGY: 428 20140.4229 19760.4170 5710.4628 168.5259 -336199.9856 23087.7680 0.0000 0.0000 44884.2595 -222448.1295 163.2766 -267332.3890 -222058.0548 163.2766 -935.5731 -2206.9583 921491.4634 -935.5731 -2206.9583
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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 -338096.9207 23149.4495 0.0000 0.0000 44626.3100 -222402.4404 162.3383 -267028.7505 -222047.3913 162.3383 -2472.2456 -2268.0463 921491.4634 -2472.2456 -2268.0463
ENERGY: 431 22204.1021 20111.4153 5711.2600 168.0704 -338644.7646 23172.3807 0.0000 0.0000 44858.4631 -222419.0730 163.1828 -267277.5361 -222048.7167 163.1828 -3116.2805 -2293.5590 921491.4634 -3116.2805 -2293.5590
ENERGY: 432 21768.3704 20188.6725 5710.3546 168.1086 -338651.2104 23176.0848 0.0000 0.0000 45177.9910 -222461.6285 164.3451 -267639.6195 -222065.9058 164.3451 -3350.2742 -2296.1497 921491.4634 -3350.2742 -2296.1497
ENERGY: 433 21200.9073 20275.9664 5710.3763 168.4633 -338164.0639 23162.2912 0.0000 0.0000 45192.9283 -222453.1310 164.3995 -267646.0594 -222052.5981 164.3995 -3187.3732 -2272.1275 921491.4634 -3187.3732 -2272.1275
ENERGY: 434 20730.3414 20338.1500 5711.6061 169.3247 -337394.2706 23140.7737 0.0000 0.0000 44883.0997 -222420.9751 163.2724 -267304.0747 -222051.1462 163.2724 -2694.3107 -2227.7884 921491.4634 -2694.3107 -2227.7884
ENERGY: 435 20235.2201 20362.4016 5714.0003 170.8455 -336680.6556 23123.4099 0.0000 0.0000 44675.9839 -222398.7943 162.5190 -267074.7782 -222049.5888 162.5190 -2061.3580 -2179.8950 921491.4634 -2061.3580 -2179.8950
ENERGY: 436 19670.9241 20349.9983 5717.2345 173.0864 -336303.8813 23119.9079 0.0000 0.0000 44847.0983 -222425.6318 163.1414 -267272.7301 -222059.6960 163.1414 -1520.6595 -2145.1615 921491.4634 -1520.6595 -2145.1615
ENERGY: 437 19434.5515 20329.5093 5720.9893 175.9827 -336411.9785 23136.3869 0.0000 0.0000 45159.2686 -222455.2902 164.2770 -267614.5588 -222050.7504 164.2770 -1319.1166 -2134.4846 921491.4634 -1319.1166 -2134.4846
ENERGY: 438 19935.1531 20278.6096 5724.6883 179.3848 -336899.4576 23173.5520 0.0000 0.0000 45148.1322 -222459.9375 164.2365 -267608.0697 -222051.5669 164.2365 -1493.0939 -2145.0879 921491.4634 -1493.0939 -2145.0879
ENERGY: 439 21052.7406 20184.4296 5727.7929 183.0561 -337561.7717 23224.7482 0.0000 0.0000 44760.8210 -222428.1834 162.8276 -267189.0044 -222052.7966 162.8276 -1936.1987 -2169.8745 921491.4634 -1936.1987 -2169.8745
TIMING: 440 CPU: 206.929, 0.458456/step Wall: 206.929, 0.458456/step, 0.00764093 hours remaining, 3224.183594 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 20036.2370 5729.7527 186.7201 -338123.1806 23276.2485 0.0000 0.0000 44417.5458 -222405.1081 161.5788 -266822.6540 -222059.4775 161.5788 -2408.4612 -2197.9671 921491.4634 -2408.4612 -2197.9671
ENERGY: 441 22355.5486 19860.0407 5730.3487 190.1145 -338361.1715 23313.2044 0.0000 0.0000 44502.6964 -222409.2181 161.8886 -266911.9145 -222050.0862 161.8886 -2716.1028 -2221.5313 921491.4634 -2716.1028 -2221.5313
ENERGY: 442 21853.6119 19664.5347 5729.4854 192.9411 -338090.1533 23327.1567 0.0000 0.0000 44880.6320 -222441.7916 163.2634 -267322.4236 -222049.7758 163.2634 -2710.5577 -2229.0696 921491.4634 -2710.5577 -2229.0696
ENERGY: 443 21064.3317 19487.0720 5727.6164 194.9329 -337369.3150 23320.0156 0.0000 0.0000 45118.1107 -222457.2357 164.1273 -267575.3463 -222048.5998 164.1273 -2448.1649 -2220.3531 921491.4634 -2448.1649 -2220.3531
ENERGY: 444 20449.3365 19357.2688 5725.4095 195.8735 -336464.1920 23301.5274 0.0000 0.0000 44987.7176 -222447.0588 163.6530 -267434.7764 -222057.9797 163.6530 -2090.2099 -2206.4398 921491.4634 -2090.2099 -2206.4398
ENERGY: 445 20125.5609 19307.2516 5723.6513 195.6942 -335759.3911 23283.8137 0.0000 0.0000 44708.7154 -222414.7041 162.6380 -267123.4195 -222046.5428 162.6380 -1846.9625 -2201.6925 921491.4634 -1846.9625 -2201.6925
ENERGY: 446 19947.6805 19324.9005 5722.5430 194.3235 -335494.5705 23276.0449 0.0000 0.0000 44620.2944 -222408.7838 162.3164 -267029.0782 -222046.1620 162.3164 -1800.7517 -2216.7293 921491.4634 -1800.7517 -2216.7293
ENERGY: 447 19914.2848 19416.0210 5722.2107 191.8641 -335769.4397 23282.7456 0.0000 0.0000 44816.5086 -222425.8049 163.0301 -267242.3135 -222046.8342 163.0301 -1993.3111 -2253.0602 921491.4634 -1993.3111 -2253.0602
ENERGY: 448 20187.5921 19583.6801 5722.5764 188.5554 -336503.1798 23303.8901 0.0000 0.0000 45065.6672 -222451.2185 163.9365 -267516.8857 -222059.3481 163.9365 -2372.1878 -2303.7899 921491.4634 -2372.1878 -2303.7899
ENERGY: 449 20877.4059 19832.6987 5723.5712 184.8596 -337500.9070 23334.5920 0.0000 0.0000 45101.1676 -222446.6119 164.0657 -267547.7796 -222047.7099 164.0657 -2827.1081 -2356.1407 921491.4634 -2827.1081 -2356.1407
ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
ENERGY: 450 21754.4853 20108.1300 5724.4776 181.0898 -338419.3249 23364.6240 0.0000 0.0000 44854.3096 -222432.2086 163.1677 -267286.5182 -222048.7860 163.1677 -3116.6757 -2394.3897 921491.4634 -3116.6757 -2394.3897
ENERGY: 451 22355.5902 20357.7255 5724.7144 177.6517 -338952.0909 23381.8004 0.0000 0.0000 44542.6987 -222411.9100 162.0341 -266954.6087 -222048.8246 162.0341 -3074.2534 -2405.7798 921491.4634 -3074.2534 -2405.7798
ENERGY: 452 22246.2016 20536.0134 5723.8953 174.8859 -338927.1537 23378.0941 0.0000 0.0000 44452.9197 -222415.1437 161.7075 -266868.0634 -222059.6368 161.7075 -2659.9606 -2384.7568 921491.4634 -2659.9606 -2384.7568
ENERGY: 453 21399.8727 20641.1311 5722.2878 173.1350 -338392.7934 23354.5905 0.0000 0.0000 44683.7034 -222418.0727 162.5470 -267101.7761 -222043.5369 162.5470 -2048.3340 -2342.4669 921491.4634 -2048.3340 -2342.4669
ENERGY: 454 20248.3382 20654.1375 5720.2217 172.3637 -337567.1415 23320.6899 0.0000 0.0000 45008.1466 -222443.2439 163.7273 -267451.3904 -222041.8388 163.7273 -1453.4580 -2293.1451 921491.4634 -1453.4580 -2293.1451
ENERGY: 455 19486.7907 20584.7122 5718.4844 172.5169 -336790.6452 23290.4021 0.0000 0.0000 45086.5788 -222451.1600 164.0126 -267537.7388 -222040.8567 164.0126 -1151.8825 -2255.8572 921491.4634 -1151.8825 -2255.8572
ENERGY: 456 19493.3722 20440.6802 5717.7556 173.4249 -336350.1075 23274.9629 0.0000 0.0000 44811.4724 -222438.4394 163.0118 -267249.9119 -222055.3485 163.0118 -1305.5005 -2245.5824 921491.4634 -1305.5005 -2245.5824
ENERGY: 457 20047.4929 20251.9436 5718.5580 174.9241 -336395.8163 23277.8272 0.0000 0.0000 44521.8703 -222403.2001 161.9583 -266925.0705 -222049.4132 161.9583 -1906.4165 -2263.5013 921491.4634 -1906.4165 -2263.5013
ENERGY: 458 20585.8434 20019.2724 5720.7061 176.6081 -336835.0956 23294.7170 0.0000 0.0000 44632.7888 -222405.1598 162.3618 -267037.9486 -222051.2821 162.3618 -2684.6987 -2301.0428 921491.4634 -2684.6987 -2301.0428
ENERGY: 459 20903.4945 19784.9689 5724.0021 178.1985 -337468.1639 23318.6980 0.0000 0.0000 45113.9367 -222444.8652 164.1121 -267558.8019 -222053.1410 164.1121 -3350.5832 -2341.5797 921491.4634 -3350.5832 -2341.5797
TIMING: 460 CPU: 216.088, 0.457962/step Wall: 216.088, 0.457962/step, 0.00508847 hours remaining, 3224.183594 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 21262.6138 19597.9062 5728.0971 179.4910 -338014.3760 23341.7998 0.0000 0.0000 45423.8566 -222480.6113 165.2395 -267904.4679 -222064.6833 165.2395 -3669.8203 -2365.2413 921491.4634 -3669.8203 -2365.2413
ENERGY: 461 21862.8763 19507.1073 5732.5753 180.4333 -338251.6207 23355.3932 0.0000 0.0000 45154.6139 -222458.6216 164.2601 -267613.2354 -222058.0503 164.2601 -3556.1667 -2361.1800 921491.4634 -3556.1667 -2361.1800
ENERGY: 462 22264.2256 19487.8106 5736.4822 180.9531 -337988.7160 23351.1083 0.0000 0.0000 44559.9291 -222408.2071 162.0968 -266968.1362 -222056.7211 162.0968 -2954.8201 -2323.4251 921491.4634 -2954.8201 -2323.4251
ENERGY: 463 21821.1792 19513.9013 5738.9361 181.1160 -337284.1018 23326.9474 0.0000 0.0000 44313.4570 -222388.5649 161.2002 -266702.0219 -222054.6239 161.2002 -2012.4425 -2264.0778 921491.4634 -2012.4425 -2264.0778
ENERGY: 464 20535.2460 19559.9269 5739.2518 181.0096 -336389.3831 23291.1938 0.0000 0.0000 44654.0266 -222428.7283 162.4391 -267082.7549 -222058.5727 162.4391 -1050.9227 -2205.5268 921491.4634 -1050.9227 -2205.5268
ENERGY: 465 19322.7827 19631.8852 5737.2899 180.7155 -335701.1525 23259.7388 0.0000 0.0000 45094.5687 -222474.1718 164.0416 -267568.7405 -222052.9386 164.0416 -512.3346 -2174.4007 921491.4634 -512.3346 -2174.4007
ENERGY: 466 19088.4511 19708.3579 5733.2107 180.2808 -335443.7717 23245.0600 0.0000 0.0000 45020.7907 -222467.6204 163.7733 -267488.4111 -222052.9783 163.7733 -630.3313 -2182.6710 921491.4634 -630.3313 -2182.6710
ENERGY: 467 19841.8070 19783.1741 5727.6704 179.7757 -335721.0943 23249.4526 0.0000 0.0000 44523.6665 -222415.5481 161.9649 -266939.2145 -222054.3493 161.9649 -1393.6028 -2232.5923 921491.4634 -1393.6028 -2232.5923
ENERGY: 468 20761.8482 19845.4942 5721.5089 179.2779 -336451.5662 23265.8122 0.0000 0.0000 44291.6586 -222385.9662 161.1209 -266677.6249 -222056.3590 161.1209 -2508.6714 -2314.1341 921491.4634 -2508.6714 -2314.1341
ENERGY: 469 21236.3015 19910.2021 5715.6824 178.8504 -337458.3199 23284.3958 0.0000 0.0000 44720.3205 -222412.5672 162.6802 -267132.8877 -222046.0749 162.6802 -3596.7407 -2405.7973 921491.4634 -3596.7407 -2405.7973
ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
ENERGY: 470 21411.1731 19972.8935 5710.9491 178.5947 -338383.2507 23297.0670 0.0000 0.0000 45346.4578 -222466.1156 164.9580 -267812.5734 -222047.6088 164.9580 -4259.6997 -2477.6832 921491.4634 -4259.6997 -2477.6832
ENERGY: 471 21732.8678 20054.6837 5707.9626 178.5890 -338913.2454 23297.5082 0.0000 0.0000 45471.3370 -222470.2970 165.4122 -267941.6340 -222047.5358 165.4122 -4290.5685 -2504.3177 921491.4634 -4290.5685 -2504.3177
ENERGY: 472 22081.2362 20161.5554 5707.0091 178.9047 -338870.6770 23279.4489 0.0000 0.0000 45028.5300 -222433.9927 163.8014 -267462.5227 -222059.5056 163.8014 -3659.7362 -2479.9185 921491.4634 -3659.7362 -2479.9185
ENERGY: 473 21866.1364 20289.3430 5707.9843 179.6165 -338307.7195 23240.7361 0.0000 0.0000 44634.5177 -222389.3857 162.3681 -267023.9033 -222043.8537 162.3681 -2556.3618 -2408.1658 921491.4634 -2556.3618 -2408.1658
ENERGY: 474 20842.9705 20372.0990 5710.2160 180.7466 -337438.4557 23189.2345 0.0000 0.0000 44733.2310 -222409.9579 162.7272 -267143.1889 -222041.2617 162.7272 -1295.5526 -2316.2729 921491.4634 -1295.5526 -2316.2729
ENERGY: 475 19674.2081 20371.7678 5712.9876 182.2512 -336604.2317 23142.3815 0.0000 0.0000 45070.2142 -222450.4214 163.9531 -267520.6356 -222039.4528 163.9531 -344.6450 -2232.2127 921491.4634 -344.6450 -2232.2127
ENERGY: 476 19235.7862 20282.0277 5715.7683 184.0125 -336100.0907 23115.8463 0.0000 0.0000 45106.0637 -222460.5859 164.0835 -267566.6496 -222053.6135 164.0835 -92.4050 -2183.0654 921491.4634 -92.4050 -2183.0654
ENERGY: 477 19704.7250 20145.9814 5718.4976 185.9230 -336101.8791 23114.2936 0.0000 0.0000 44812.3213 -222420.1373 163.0149 -267232.4585 -222044.8409 163.0149 -667.4947 -2171.8229 921491.4634 -667.4947 -2171.8229
ENERGY: 478 20493.4775 19974.7638 5721.0254 187.7262 -336537.4036 23131.2457 0.0000 0.0000 44627.0338 -222402.1313 162.3409 -267029.1651 -222047.4105 162.3409 -1807.1605 -2198.7957 921491.4634 -1807.1605 -2198.7957
ENERGY: 479 21125.3057 19793.3955 5723.3295 189.2099 -337215.5837 23156.6768 0.0000 0.0000 44802.1583 -222425.5081 162.9779 -267227.6664 -222050.5458 162.9779 -3089.8517 -2246.7919 921491.4634 -3089.8517 -2246.7919
TIMING: 480 CPU: 225.241, 0.457678/step Wall: 225.241, 0.457678/step, 0.00254265 hours remaining, 3224.183594 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 21624.0326 19623.1963 5725.3111 190.1901 -337854.6783 23181.5113 0.0000 0.0000 45051.6820 -222458.7549 163.8856 -267510.4369 -222064.6208 163.8856 -4077.7327 -2291.4892 921491.4634 -4077.7327 -2291.4892
ENERGY: 481 22092.4854 19510.0432 5727.0952 190.6351 -338199.2477 23196.7954 0.0000 0.0000 45041.3372 -222440.8562 163.8480 -267482.1934 -222052.5264 163.8480 -4466.2395 -2305.6734 921491.4634 -4466.2395 -2305.6734
ENERGY: 482 22186.3469 19466.6794 5728.4964 190.3598 -338044.5414 23192.7469 0.0000 0.0000 44865.8523 -222414.0599 163.2096 -267279.9122 -222051.4111 163.2096 -4059.3100 -2278.0616 921491.4634 -4059.3100 -2278.0616
ENERGY: 483 21553.1415 19511.5746 5729.5660 189.3226 -337426.2181 23165.8734 0.0000 0.0000 44861.8971 -222414.8428 163.1953 -267276.7399 -222048.7671 163.1953 -2964.1724 -2216.4118 921491.4634 -2964.1724 -2216.4118
ENERGY: 484 20460.8927 19631.1941 5730.2465 187.5455 -336590.8880 23126.1345 0.0000 0.0000 45003.6033 -222451.2714 163.7107 -267454.8747 -222059.8739 163.7107 -1565.2427 -2143.1852 921491.4634 -1565.2427 -2143.1852
ENERGY: 485 19688.7721 19800.2994 5730.5256 185.2458 -335902.5862 23092.8464 0.0000 0.0000 44955.5726 -222449.3243 163.5360 -267404.8969 -222045.9603 163.5360 -422.1571 -2086.8738 921491.4634 -422.1571 -2086.8738
ENERGY: 486 19602.5427 19954.8179 5729.7198 182.4662 -335612.3564 23080.3801 0.0000 0.0000 44645.9119 -222416.5179 162.4096 -267062.4298 -222044.6758 162.4096 87.3179 -2070.0984 921491.4634 87.3179 -2070.0984
ENERGY: 487 19881.0925 20072.0216 5727.4347 179.4360 -335846.4479 23091.0537 0.0000 0.0000 44503.3498 -222392.0597 161.8910 -266895.4094 -222045.2404 161.8910 -192.2348 -2106.8843 921491.4634 -192.2348 -2106.8843
ENERGY: 488 20125.2098 20156.1365 5723.5441 176.4338 -336552.5452 23118.8609 0.0000 0.0000 44827.0562 -222425.3040 163.0685 -267252.3602 -222057.1937 163.0685 -1145.7536 -2194.6683 921491.4634 -1145.7536 -2194.6683
ENERGY: 489 20526.8872 20236.4613 5718.5749 173.8639 -337540.4657 23156.7303 0.0000 0.0000 45266.1010 -222461.8472 164.6656 -267727.9482 -222045.6084 164.6656 -2511.2408 -2316.7070 921491.4634 -2511.2408 -2316.7070
ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
ENERGY: 490 21410.7491 20292.9027 5712.8912 171.8438 -338458.1364 23196.4870 0.0000 0.0000 45213.5633 -222459.6992 164.4745 -267673.2626 -222048.2207 164.4745 -3823.4043 -2437.4158 921491.4634 -3823.4043 -2437.4158
ENERGY: 491 22430.4642 20312.1367 5707.3795 170.5404 -338984.5797 23226.0930 0.0000 0.0000 44733.0091 -222404.9567 162.7264 -267137.9659 -222049.4637 162.7264 -4629.6939 -2524.6218 921491.4634 -4629.6939 -2524.6218
ENERGY: 492 22612.9550 20289.6817 5702.9944 170.0208 -338937.5819 23232.7198 0.0000 0.0000 44542.1950 -222387.0151 162.0323 -266929.2101 -222060.3860 162.0323 -4606.8529 -2557.4733 921491.4634 -4606.8529 -2557.4733
ENERGY: 493 21558.2189 20260.7381 5700.7779 170.3201 -338358.0634 23214.0530 0.0000 0.0000 45033.8228 -222420.1326 163.8207 -267453.9554 -222046.5901 163.8207 -3796.3823 -2540.0999 921491.4634 -3796.3823 -2540.0999
ENERGY: 494 20068.3366 20225.0267 5700.9806 171.2193 -337454.3832 23183.0789 0.0000 0.0000 45622.2473 -222483.4939 165.9612 -268105.7412 -222044.0868 165.9612 -2500.8995 -2482.1071 921491.4634 -2500.8995 -2482.1071
ENERGY: 495 19383.2460 20186.8305 5703.5926 172.5416 -336566.9880 23159.4619 0.0000 0.0000 45484.1229 -222477.1925 165.4587 -267961.3154 -222041.5563 165.4587 -1249.6838 -2407.3058 921491.4634 -1249.6838 -2407.3058
ENERGY: 496 19722.4830 20130.6474 5708.0350 174.0933 -335998.7146 23154.2631 0.0000 0.0000 44699.5269 -222409.6659 162.6046 -267109.1928 -222049.0670 162.6046 -478.8997 -2343.4752 921491.4634 -478.8997 -2343.4752
ENERGY: 497 20212.6664 20059.9175 5713.4613 175.7242 -335952.5031 23166.3541 0.0000 0.0000 44261.0287 -222363.3510 161.0095 -266624.3797 -222042.7500 161.0095 -421.0231 -2316.7929 921491.4634 -421.0231 -2316.7929
ENERGY: 498 20182.0163 19957.1212 5718.5597 177.2604 -336366.4922 23189.3581 0.0000 0.0000 44728.2533 -222413.9233 162.7091 -267142.1766 -222044.5219 162.7091 -993.4678 -2331.6474 921491.4634 -993.4678 -2331.6474
ENERGY: 499 20158.0678 19847.7304 5722.4090 178.6361 -337058.4815 23219.2401 0.0000 0.0000 45439.2642 -222493.1339 165.2956 -267932.3981 -222047.2062 165.2956 -2020.8688 -2376.3391 921491.4634 -2020.8688 -2376.3391
Info: Benchmark time: 4 CPUs 0.457418 s/step 5.29419 days/ns 3224.18 MB memory
TIMING: 500 CPU: 234.327, 0.454294/step Wall: 234.327, 0.454294/step, 0 hours remaining, 3224.183594 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 20974.8938 19756.6579 5724.4523 179.8271 -337741.4185 23251.1006 0.0000 0.0000 45359.0776 -222495.4091 165.0039 -267854.4867 -222061.0909 165.0039 -3197.5168 -2425.4141 921491.4634 -3197.5168 -2425.4141
WRITING EXTENDED SYSTEM TO OUTPUT FILE AT STEP 500
WRITING COORDINATES TO OUTPUT FILE AT STEP 500
The last position output (seq=-2) takes 0.002 seconds, 3229.793 MB of memory in use
WRITING VELOCITIES TO OUTPUT FILE AT STEP 500
The last velocity output (seq=-2) takes 0.002 seconds, 3229.793 MB of memory in use
====================================================
WallClock: 242.153152 CPUTime: 242.153152 Memory: 3229.792969 MB
[Partition 0][Node 0] End of program
Application 102593045 resources: utime ~949s, stime ~20s, Rss ~127264, inblocks ~67176, outblocks ~72238
Displaying status file:
verified
[SSH] completed
[SSH] exit-status: 0
[workspace] $ /bin/sh -xe /tmp/jenkins6160183373727472952.sh
+ scp BW_REMOTE_2:/scratch/system/bwjenkins/tests/namd/2.10/cle5.2_gnu5.1.0/cputime /var/lib/jenkins/jobs/NAMD-h2ologin4/workspace
+ scp BW_REMOTE_2:/scratch/system/bwjenkins/tests/namd/2.10/cle5.2_gnu5.1.0/memory /var/lib/jenkins/jobs/NAMD-h2ologin4/workspace
+ scp BW_REMOTE_2:/scratch/system/bwjenkins/tests/namd/2.10/cle5.2_gnu5.1.0/wallclock /var/lib/jenkins/jobs/NAMD-h2ologin4/workspace
Recording plot data
Saving plot series data from: /var/lib/jenkins/jobs/NAMD-h2ologin4/workspace/wallclock
Saving plot series data from: /var/lib/jenkins/jobs/NAMD-h2ologin4/workspace/cputime
Saving plot series data from: /var/lib/jenkins/jobs/NAMD-h2ologin4/workspace/memory
Finished: SUCCESS
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