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nanoparticlesims/growth_Melting_Silver_ICO_3269/freezeSims/run_68/freeze.log

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main_MD> Reading input file
read_input> Process type: freezing
Read_input> Process caloric with a T-change of 25.000000000000000 [K] and a rate of 9.9999999999999992E+022 [K/ns]
read_input> Input for metadynamics has been read
read_input> Metadynamics has not been chosen.
read_input> Reading initial positions fromtoFreeze_68.xyz
read_input> Finish reading initial positions
read_input> Validating positions
read_input> Initializing random number generator
read_input> Checking program
read_rgl> START READING FILE ../pot.pot
read_rgl>> END READING FILE ../pot.pot
READ_RGL>> atomic speciesAgAg imet1 4 imet2 4
READ_RGL>> atomic radius 1.4450000999999999 1.4450000999999999
read_rgl> PARAMETERS SELECTION
FOR IMET1 :: Ag 4
ECOH :: 2.9500000000000002 A :: 0.10308871000000000 QSI :: 1.1895434899999999
p :: 10.850000000000000 q :: 3.1800000000000002
ATOMIC RADIUS :: 1.4450000999999999
choice_pot> values:
frac = 0.12062503764379931 arete = 4.0870774781009569
choice_pot> mass is== 108.00000000000000 for elem1=
read_input> ntipo1 = 68 ntipo2 = 0
read_input> Finish reading input
main_MD> Allocating global variables
main_MD> Number of outputs that will be created: 1650
main_MD> Size of nv and nvoiz: 68 6800
main_MD> Size of nv and nvoiz: 68 6800
main_MD> Number of time-steps (npas) = 50000
main_MD> Number of CVs (num_cv) = 1
main_MD> Max allowed number of atoms = 2900
main_MD> Max number of atoms = 68
main_MD> Consider changing parameter nsiz in module_parameters.f90 for performance
main_MD> collvar_wanted = F
main_MD> INPUT AND POTENTIAL FILE READING IS DONE
main_MD> THERMALIZATION IS STARTING
init> 3.5776538252956916E-002 -1.1614993555545287E-002 3.8003365594373908E-002 initial drift of cluster / NP1 for coalescence
init> 0.28891142686652121 0.31364914598426052 0.30238599075487427 scaling for velocity /for coalescence NP1
init.f90 > facguy = 3.6266482522790723E-003
preparo> IN BIGVOI : LIMIT 1.2247448652052084 1.2247448652052084 1.2247448652052084
preparo> END t=0 TIME STEP
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.68174 -2.10151 -1.59884
force_rgl> df(natom) 2.88962 -4.95324 3.14064
preparo> THERMALIZATION PROCESS AT 1139.0196657160152
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -147.23271950000029 12.658272364702073 -159.89099186470236 6.7925453355303954E-004
preparo> END THERMALISATION ON NPAST DEFINE IN PARACLUSTER MODULE
main_MD> Time-loop is starting for freezing
main_MD> Now the computation of EXECUTION TIME starts
main_MD> Running from loop 1 to 33
FREEZING PROCESS: loop number 1 T-loop= 1116.0000000000000
main_MD> interactions number 1 at Temperature= 1116.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.45731 -0.23915 -0.63610
force_rgl> df(natom) -1.36309 -1.45160 -1.31823
5.0000 -159.27168 -148.31819 10.95348 3.18134 -147.59924 1244.60250
10.0000 -158.88225 -149.42075 9.46150 3.08069 -149.27591 1204.97944
15.0000 -160.48030 -148.81627 11.66402 3.04322 -149.90024 1150.84188
20.0000 -162.71369 -151.55612 11.15757 3.01533 -150.36492 1146.23557
25.0000 -160.27296 -150.98431 9.28865 2.92075 -151.94056 1110.38594
30.0000 -161.92540 -151.96338 9.96202 2.98943 -150.79634 1113.40715
35.0000 -162.15225 -151.40389 10.74836 2.95558 -151.36030 1109.82749
40.0000 -159.79422 -152.00520 7.78902 2.96461 -151.20979 1108.23493
45.0000 -159.67419 -151.32881 8.34538 2.94040 -151.61329 1093.76413
50.0000 -160.91999 -153.07679 7.84320 2.98202 -150.91982 1092.47441
55.0000 -160.94354 -151.36100 9.58255 2.86868 -152.80812 1056.02514
60.0000 -163.27437 -153.13494 10.13943 2.90431 -152.21445 1070.28042
65.0000 -160.94470 -149.94108 11.00362 2.94380 -151.55664 1084.62682
70.0000 -159.77298 -150.05774 9.71525 3.00056 -150.61100 1114.66303
75.0000 -160.08466 -149.90254 10.18212 3.03964 -149.95996 1150.82374
80.0000 -161.01772 -149.07201 11.94571 3.07388 -149.38942 1208.14015
85.0000 -160.96104 -150.08060 10.88044 3.05878 -149.64103 1192.12303
90.0000 -158.33865 -147.25002 11.08862 3.05040 -149.78054 1176.27093
95.0000 -158.87200 -148.06384 10.80816 3.12103 -148.60397 1208.55014
100.0000 -161.58254 -150.18070 11.40184 3.12055 -148.61189 1225.26861
105.0000 -161.90265 -153.14943 8.75322 2.93265 -151.74230 1096.42269
110.0000 -159.05158 -151.38275 7.66883 2.88584 -152.52220 1070.50615
115.0000 -160.95338 -148.45274 12.50064 3.02860 -150.14381 1168.89101
120.0000 -162.32246 -151.89096 10.43150 2.97225 -151.08251 1117.09042
125.0000 -160.30653 -151.24540 9.06113 2.94108 -151.60193 1081.56519
130.0000 -158.84709 -150.70232 8.14477 2.99071 -150.77503 1114.88068
135.0000 -162.34606 -152.12670 10.21936 2.93608 -151.68520 1093.90369
140.0000 -159.91749 -151.37463 8.54286 2.97442 -151.04647 1113.66963
145.0000 -160.16682 -151.38265 8.78417 2.98959 -150.79372 1127.50454
150.0000 -160.80858 -150.77306 10.03552 3.01749 -150.32882 1138.00411
155.0000 -159.83108 -150.04553 9.78556 2.98536 -150.86422 1125.70310
160.0000 -160.96270 -151.47872 9.48398 2.92365 -151.89228 1068.14228
165.0000 -160.83296 -151.64379 9.18917 2.92687 -151.83856 1102.20758
170.0000 -160.41363 -151.29367 9.11996 2.93966 -151.62556 1091.90578
175.0000 -160.86440 -150.71666 10.14774 2.98689 -150.83876 1130.28640
180.0000 -160.80975 -152.19471 8.61504 2.92992 -151.78783 1034.89766
185.0000 -160.54524 -151.97349 8.57175 2.91583 -152.02262 1094.64375
190.0000 -160.02166 -150.86461 9.15705 2.92016 -151.95033 1066.37941
195.0000 -159.40383 -150.56336 8.84047 3.05005 -149.78649 1152.96596
200.0000 -161.75788 -152.65433 9.10355 2.94537 -151.53033 1101.73043
205.0000 -163.17511 -154.27365 8.90146 2.81356 -153.72635 1026.67353
210.0000 -160.69594 -153.54302 7.15292 2.76363 -154.55817 983.77048
215.0000 -161.96028 -152.41932 9.54097 2.86742 -152.82897 1024.27084
220.0000 -160.79171 -150.94010 9.85161 2.99697 -150.67081 1107.86783
225.0000 -160.24611 -151.71281 8.53330 2.91830 -151.98132 1051.11257
230.0000 -159.15028 -149.06325 10.08703 3.00031 -150.61505 1102.44870
235.0000 -161.54016 -151.23504 10.30511 3.01682 -150.34012 1133.63652
240.0000 -160.11095 -150.18669 9.92426 2.96396 -151.22074 1123.36604
245.0000 -160.11676 -149.77691 10.33985 3.02793 -150.15490 1143.17518
250.0000 -160.43410 -149.97108 10.46302 3.04404 -149.88662 1145.88698
FREEZING PROCESS: loop number 2 T-loop= 1091.0000000000000
main_MD> interactions number 2 at Temperature= 1091.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.06514 -0.49262 2.06130
force_rgl> df(natom) 3.26062 2.14719 0.38583
255.0000 -162.08327 -150.58499 11.49828 2.96459 -151.21018 1087.94617
260.0000 -161.54358 -150.19612 11.34746 2.93123 -151.76604 1063.86451
265.0000 -160.42578 -149.74698 10.67880 3.02134 -150.26479 1149.86660
270.0000 -161.40909 -150.37778 11.03132 3.01468 -150.37565 1146.52670
275.0000 -160.56846 -151.34991 9.21854 3.01423 -150.38317 1161.85192
280.0000 -161.01853 -152.27281 8.74571 2.94256 -151.57721 1101.55144
285.0000 -161.11377 -150.05114 11.06263 2.92453 -151.87753 1096.67409
290.0000 -160.99504 -151.64455 9.35049 3.01336 -150.39771 1119.98302
295.0000 -161.01612 -149.91236 11.10377 3.03786 -149.98955 1156.58132
300.0000 -161.12240 -151.11976 10.00264 3.06513 -149.53529 1182.18825
305.0000 -162.76140 -154.25042 8.51097 2.87475 -152.70695 1070.54737
310.0000 -163.96157 -155.26261 8.69896 2.77979 -154.28901 951.71214
315.0000 -160.82257 -152.09063 8.73194 2.78466 -154.20774 976.76865
320.0000 -163.14307 -154.15110 8.99197 2.88629 -152.51459 1068.27592
325.0000 -161.65897 -153.03970 8.61927 2.75367 -154.72405 982.95684
330.0000 -162.92981 -155.01107 7.91875 2.80869 -153.80744 991.45269
335.0000 -162.17787 -152.93334 9.24453 2.84025 -153.28175 1015.98485
340.0000 -162.56217 -152.96177 9.60040 2.83330 -153.39741 1069.13637
345.0000 -163.32259 -155.45359 7.86900 2.77735 -154.32960 1008.39234
350.0000 -162.47894 -153.51072 8.96822 2.77169 -154.42396 995.61702
355.0000 -161.09078 -153.51773 7.57305 2.87372 -152.72415 1025.38104
360.0000 -161.91905 -151.42127 10.49778 2.91227 -152.08178 1046.80790
365.0000 -161.52641 -151.25472 10.27169 2.94564 -151.52595 1085.45605
370.0000 -162.17724 -152.68367 9.49356 2.91392 -152.05431 1081.92476
375.0000 -163.64661 -152.11659 11.53002 2.84747 -153.16142 1019.06576
380.0000 -163.08936 -154.06854 9.02082 2.91193 -152.08755 1071.27411
385.0000 -162.94358 -153.29677 9.64681 2.83100 -153.43583 1013.22085
390.0000 -161.49132 -150.78386 10.70746 2.85078 -153.10628 1050.22189
395.0000 -161.03920 -150.56725 10.47195 2.98424 -150.88275 1099.93665
400.0000 -161.74117 -151.97512 9.76606 2.96899 -151.13688 1095.25188
405.0000 -162.05526 -153.17518 8.88008 2.88751 -152.49438 1055.55161
410.0000 -160.04798 -151.53378 8.51419 2.93546 -151.69559 1110.55859
415.0000 -161.91384 -152.49674 9.41709 2.99000 -150.78680 1120.66650
420.0000 -163.23597 -153.87202 9.36395 2.86347 -152.89485 1027.64435
425.0000 -160.80829 -151.68452 9.12377 2.91842 -151.97938 1067.10487
430.0000 -161.39483 -151.84003 9.55480 2.99964 -150.62627 1106.72132
435.0000 -160.72591 -151.20021 9.52570 2.91685 -152.00563 1047.29123
440.0000 -160.41865 -149.90469 10.51396 2.98905 -150.80263 1133.04560
445.0000 -158.29624 -147.95075 10.34549 3.06003 -149.62023 1161.68103
450.0000 -157.55530 -147.90762 9.64769 3.17644 -147.68077 1253.89472
455.0000 -159.75260 -149.56524 10.18736 3.10197 -148.92140 1179.90406
460.0000 -160.79437 -151.63801 9.15636 2.99533 -150.69813 1134.52445
465.0000 -160.40642 -150.16743 10.23899 2.96457 -151.21052 1092.78868
470.0000 -159.70458 -148.67325 11.03133 3.05777 -149.65775 1163.94527
475.0000 -158.22397 -148.40720 9.81677 3.13499 -148.37134 1243.40566
480.0000 -160.10357 -148.77212 11.33144 3.05005 -149.78649 1148.13056
485.0000 -159.81329 -149.12100 10.69228 3.06653 -149.51195 1194.62233
490.0000 -161.10020 -149.23365 11.86654 3.01694 -150.33809 1163.32049
495.0000 -159.45213 -150.44342 9.00871 3.02022 -150.28348 1138.67408
500.0000 -162.10598 -152.68144 9.42454 2.97382 -151.05645 1102.18285
FREEZING PROCESS: loop number 3 T-loop= 1066.0000000000000
main_MD> interactions number 3 at Temperature= 1066.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.48649 2.10893 1.62817
force_rgl> df(natom) 0.85279 -1.85072 0.96971
505.0000 -163.87378 -155.53445 8.33933 2.76398 -154.55242 986.61921
510.0000 -160.73967 -151.44588 9.29379 2.87869 -152.64128 1060.43967
515.0000 -160.74918 -151.69512 9.05406 2.87331 -152.73097 1045.35208
520.0000 -161.67198 -151.83950 9.83248 2.88631 -152.51431 1080.32464
525.0000 -162.34738 -152.15527 10.19211 2.94457 -151.54378 1046.78248
530.0000 -161.04513 -152.14874 8.89639 2.95400 -151.38661 1115.39414
535.0000 -162.43632 -152.31583 10.12049 2.88851 -152.47772 1041.51985
540.0000 -161.20773 -152.54921 8.65852 2.90146 -152.26201 1038.53645
545.0000 -161.36601 -153.05609 8.30992 2.90265 -152.24209 1049.30893
550.0000 -159.78057 -150.61362 9.16695 2.83815 -153.31665 1012.02196
555.0000 -162.16603 -153.23348 8.93255 2.89747 -152.32839 1051.51183
560.0000 -163.48395 -154.03910 9.44485 2.84823 -153.14882 1024.76260
565.0000 -161.45762 -152.57212 8.88551 2.85750 -152.99426 1050.94824
570.0000 -163.14138 -152.88619 10.25519 2.81151 -153.76053 1020.09053
575.0000 -161.68495 -150.78437 10.90057 2.88730 -152.49787 1080.24324
580.0000 -161.74437 -151.82279 9.92158 2.93757 -151.66043 1109.79677
585.0000 -160.50901 -151.94858 8.56043 2.93262 -151.74283 1060.57805
590.0000 -159.65255 -150.88237 8.77019 2.95457 -151.37717 1061.18075
595.0000 -160.82884 -151.20252 9.62633 2.96123 -151.26611 1076.98552
600.0000 -161.84510 -152.64008 9.20501 2.98067 -150.94238 1128.99703
605.0000 -162.48547 -153.54529 8.94018 2.90243 -152.24582 1033.62743
610.0000 -160.60339 -150.53427 10.06912 2.90437 -152.21354 1058.17401
615.0000 -160.16314 -150.09717 10.06598 2.95472 -151.37460 1108.86712
620.0000 -161.41514 -152.29714 9.11799 2.95326 -151.39902 1090.04357
625.0000 -161.44101 -153.40721 8.03380 2.86248 -152.91130 991.53444
630.0000 -160.29255 -151.52902 8.76352 2.90394 -152.22057 1035.48763
635.0000 -160.03982 -151.79501 8.24482 2.99533 -150.69816 1081.30949
640.0000 -162.17139 -152.52568 9.64572 2.89843 -152.31243 1043.34094
645.0000 -159.94486 -151.04303 8.90183 2.95123 -151.43285 1080.99864
650.0000 -161.42945 -152.27917 9.15028 2.88408 -152.55156 1050.21573
655.0000 -162.03223 -150.89732 11.13491 2.93714 -151.66750 1087.19610
660.0000 -161.05315 -151.43586 9.61729 2.98401 -150.88661 1122.27452
665.0000 -162.53634 -151.92633 10.61001 2.99772 -150.65826 1140.06952
670.0000 -161.80730 -151.54307 10.26423 2.91772 -151.99100 1061.94870
675.0000 -160.56567 -150.89110 9.67457 2.94092 -151.60458 1090.98788
680.0000 -159.74709 -150.58928 9.15781 2.98178 -150.92386 1107.21298
685.0000 -159.22238 -149.93558 9.28680 3.01434 -150.38139 1139.93337
690.0000 -160.88769 -150.78418 10.10351 3.00255 -150.57777 1131.03863
695.0000 -161.56905 -153.15220 8.41685 2.88943 -152.46230 1058.12937
700.0000 -162.29729 -153.03678 9.26052 2.88723 -152.49908 1034.03840
705.0000 -160.91769 -152.24440 8.67329 2.87371 -152.72424 1044.04511
710.0000 -160.18020 -150.20896 9.97124 2.95989 -151.28851 1083.32258
715.0000 -158.54117 -147.77189 10.76928 3.10911 -148.80250 1180.15261
720.0000 -160.19211 -151.76613 8.42599 3.05285 -149.73980 1122.18598
725.0000 -161.59828 -153.60292 7.99536 2.91497 -152.03682 1071.46169
730.0000 -161.46658 -149.28903 12.17754 2.90253 -152.24415 1088.02114
735.0000 -160.33659 -150.92267 9.41392 3.02178 -150.25740 1144.74239
740.0000 -161.30937 -151.09651 10.21285 2.97411 -151.05165 1121.79526
745.0000 -161.21658 -152.19102 9.02555 3.00552 -150.52825 1132.53166
750.0000 -161.85744 -152.36969 9.48775 2.85970 -152.95773 1041.11279
FREEZING PROCESS: loop number 4 T-loop= 1041.0000000000000
main_MD> interactions number 4 at Temperature= 1041.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -6.68710 5.56412 4.56654
force_rgl> df(natom) 2.00739 -0.67152 -1.95965
755.0000 -159.65500 -150.45177 9.20323 2.96207 -151.25210 1090.51076
760.0000 -163.50493 -155.55711 7.94782 2.85235 -153.08006 1040.47917
765.0000 -161.16575 -152.27559 8.89016 2.82989 -153.45437 1025.49890
770.0000 -162.98347 -153.93030 9.05317 2.82365 -153.55831 1025.59968
775.0000 -161.53472 -154.30346 7.23126 2.77788 -154.32071 987.27651
780.0000 -160.76716 -151.42184 9.34532 2.87865 -152.64193 1033.54781
785.0000 -159.15278 -150.39833 8.75444 2.95465 -151.37583 1123.17704
790.0000 -161.12214 -151.03518 10.08696 3.01007 -150.45246 1154.69977
795.0000 -162.11186 -151.21905 10.89281 2.99054 -150.77792 1148.51204
800.0000 -161.45962 -150.66989 10.78974 2.97793 -150.98791 1091.99983
805.0000 -160.25535 -151.02939 9.22596 2.98785 -150.82263 1092.32169
810.0000 -161.06039 -150.16165 10.89874 3.01133 -150.43153 1135.18032
815.0000 -163.26534 -154.03963 9.22571 2.92457 -151.87686 1069.83847
820.0000 -161.71269 -151.35111 10.36158 2.92844 -151.81250 1096.18039
825.0000 -161.32886 -151.49288 9.83598 2.98373 -150.89132 1108.07986
830.0000 -159.75224 -150.83722 8.91502 2.97008 -151.11871 1087.66818
835.0000 -160.75512 -149.97735 10.77777 3.05023 -149.78347 1179.52986
840.0000 -161.98575 -153.69601 8.28974 2.95414 -151.38435 1091.38959
845.0000 -162.24673 -153.29407 8.95266 2.81285 -153.73823 1007.34894
850.0000 -161.17973 -152.27174 8.90799 2.86703 -152.83553 1030.35584
855.0000 -162.02037 -153.54562 8.47475 2.84127 -153.26476 1022.55712
860.0000 -162.82012 -152.97360 9.84652 2.83602 -153.35210 1010.52439
865.0000 -163.58849 -155.21441 8.37407 2.77217 -154.41592 957.51301
870.0000 -164.36453 -154.47224 9.89229 2.76002 -154.61831 959.27524
875.0000 -161.07855 -153.57356 7.50499 2.78174 -154.25642 977.36204
880.0000 -160.12490 -150.82171 9.30319 2.91075 -152.10712 1057.80905
885.0000 -160.03710 -149.99268 10.04441 2.91162 -152.09265 1074.52618
890.0000 -161.13427 -151.51602 9.61825 2.96541 -151.19652 1076.86967
895.0000 -161.89878 -154.17892 7.71986 2.88787 -152.48839 1044.76017
900.0000 -162.88091 -154.13656 8.74436 2.79683 -154.00499 960.76840
905.0000 -162.33859 -152.39412 9.94447 2.81990 -153.62075 1008.82522
910.0000 -161.82430 -151.91870 9.90560 2.91223 -152.08254 1045.93928
915.0000 -159.44998 -149.24789 10.20208 2.98589 -150.85534 1129.10518
920.0000 -159.73938 -148.91740 10.82197 3.15882 -147.97430 1207.96691
925.0000 -159.58821 -149.44328 10.14493 3.08945 -149.13006 1141.41065
930.0000 -160.71887 -150.73148 9.98739 3.02974 -150.12474 1117.37104
935.0000 -160.41462 -150.07312 10.34151 3.01344 -150.39634 1143.94344
940.0000 -160.65509 -151.53808 9.11701 2.96430 -151.21496 1083.77836
945.0000 -161.84915 -153.11437 8.73478 2.86594 -152.85374 1038.02511
950.0000 -159.46360 -150.61057 8.85303 2.95718 -151.33358 1091.50798
955.0000 -158.33273 -149.10182 9.23091 3.06153 -149.59514 1153.79396
960.0000 -161.56884 -151.63058 9.93826 3.02808 -150.15239 1122.08921
965.0000 -161.60184 -152.67727 8.92457 2.92320 -151.89970 1080.12159
970.0000 -159.59519 -148.94891 10.64628 2.97848 -150.97883 1100.60299
975.0000 -162.19393 -152.95079 9.24314 2.91404 -152.05230 1079.70886
980.0000 -162.01825 -151.34632 10.67194 2.87817 -152.64996 1072.19878
985.0000 -160.12682 -151.19271 8.93412 2.96135 -151.26424 1091.57507
990.0000 -163.38096 -153.85349 9.52747 2.91113 -152.10089 1077.69711
995.0000 -161.73151 -153.08222 8.64929 2.83335 -153.39658 1055.95843
1000.0000 -162.08751 -153.78470 8.30281 2.86530 -152.86431 1043.71798
FREEZING PROCESS: loop number 5 T-loop= 1016.0000000000000
main_MD> interactions number 5 at Temperature= 1016.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.60497 -2.14905 -1.12343
force_rgl> df(natom) -4.01327 1.39087 2.03921
1005.0000 -162.33261 -154.14265 8.18996 2.80964 -153.79162 983.80763
1010.0000 -162.68132 -153.73527 8.94605 2.82308 -153.56773 1028.39987
1015.0000 -162.31944 -152.56867 9.75077 2.83335 -153.39670 1005.64182
1020.0000 -159.71180 -149.49948 10.21231 3.01654 -150.34478 1148.88763
1025.0000 -161.33919 -150.25222 11.08698 2.97276 -151.07413 1099.82724
1030.0000 -159.86245 -149.94960 9.91286 3.04045 -149.94635 1148.64359
1035.0000 -161.64746 -152.33218 9.31527 2.99368 -150.72563 1133.01950
1040.0000 -161.61171 -152.56839 9.04333 2.89264 -152.40893 1031.00351
1045.0000 -160.88757 -152.40257 8.48500 2.89722 -152.33266 1057.41555
1050.0000 -161.28031 -153.23350 8.04681 2.88334 -152.56380 1035.19842
1055.0000 -164.22528 -154.48411 9.74117 2.76245 -154.57788 973.78715
1060.0000 -162.72928 -154.32689 8.40239 2.78873 -154.13997 987.58074
1065.0000 -162.83447 -153.54894 9.28553 2.77875 -154.30624 994.90341
1070.0000 -162.97511 -153.33744 9.63766 2.79114 -154.09986 977.01178
1075.0000 -159.70374 -150.00295 9.70078 2.89275 -152.40707 1070.95130
1080.0000 -162.28679 -152.39393 9.89287 2.98671 -150.84167 1130.31958
1085.0000 -159.41246 -150.44202 8.97044 2.99973 -150.62477 1092.82514
1090.0000 -163.54742 -153.86561 9.68181 2.95903 -151.30289 1096.64103
1095.0000 -162.23882 -152.19138 10.04743 2.85910 -152.96760 1049.46885
1100.0000 -162.50682 -153.61354 8.89328 2.83266 -153.40822 1022.10345
1105.0000 -163.75796 -155.61510 8.14286 2.79143 -154.09495 974.64087
1110.0000 -162.52155 -153.19612 9.32543 2.73545 -155.02772 950.23515
1115.0000 -161.28891 -152.89686 8.39205 2.87434 -152.71373 1008.13093
1120.0000 -160.78927 -151.72874 9.06052 2.95140 -151.43000 1033.58103
1125.0000 -163.09499 -153.13329 9.96170 2.89044 -152.44557 1062.33581
1130.0000 -163.52513 -155.35083 8.17430 2.84405 -153.21833 1020.13914
1135.0000 -162.01107 -154.58912 7.42196 2.74514 -154.86626 933.03763
1140.0000 -162.69204 -155.78030 6.91174 2.79146 -154.09461 992.30355
1145.0000 -161.63702 -152.40728 9.22974 2.77217 -154.41593 1003.24785
1150.0000 -160.59761 -152.04511 8.55250 2.89955 -152.29372 1085.29547
1155.0000 -160.19877 -150.44328 9.75549 2.92359 -151.89320 1079.50167
1160.0000 -160.52439 -152.30602 8.21837 2.93694 -151.67080 1092.53799
1165.0000 -160.71738 -150.94914 9.76825 2.92190 -151.92149 1062.37585
1170.0000 -163.28808 -154.57034 8.71774 2.89525 -152.36540 1049.86800
1175.0000 -162.41344 -153.43866 8.97478 2.77993 -154.28662 980.18361
1180.0000 -163.86558 -155.01241 8.85317 2.72647 -155.17723 972.06057
1185.0000 -165.05097 -154.89655 10.15442 2.69039 -155.77834 937.35591
1190.0000 -164.83941 -155.38639 9.45302 2.71216 -155.41561 951.12750
1195.0000 -165.48376 -156.02545 9.45831 2.69074 -155.77258 927.41320
1200.0000 -163.65748 -155.03437 8.62311 2.71501 -155.36817 944.00491
1205.0000 -163.02203 -154.47271 8.54932 2.73283 -155.07130 975.66928
1210.0000 -162.58104 -152.60333 9.97772 2.82730 -153.49740 1034.23546
1215.0000 -161.08430 -153.61032 7.47398 2.84711 -153.16741 1004.04214
1220.0000 -164.29827 -154.94535 9.35292 2.75731 -154.66353 979.50952
1225.0000 -163.20334 -154.02003 9.18331 2.73769 -154.99033 963.04842
1230.0000 -162.90504 -154.03335 8.87169 2.79851 -153.97714 1006.07673
1235.0000 -160.99864 -152.12714 8.87151 2.84387 -153.22146 1017.42149
1240.0000 -162.61706 -153.94997 8.66709 2.80015 -153.94970 999.73746
1245.0000 -160.21042 -152.41636 7.79407 2.84986 -153.12167 1020.22283
1250.0000 -160.39621 -151.30805 9.08816 2.91507 -152.03528 1054.40055
FREEZING PROCESS: loop number 6 T-loop= 991.00000000000000
main_MD> interactions number 6 at Temperature= 991.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.30534 3.23218 3.18922
force_rgl> df(natom) 0.83054 0.15166 -2.08648
1255.0000 -161.87032 -152.00054 9.86978 2.97644 -151.01272 1100.14289
1260.0000 -160.59577 -151.17062 9.42515 2.87151 -152.76095 1036.71472
1265.0000 -162.18506 -152.69990 9.48516 2.92753 -151.82761 1087.34043
1270.0000 -160.51292 -150.93573 9.57720 3.00567 -150.52587 1121.69400
1275.0000 -161.20542 -152.27527 8.93015 2.95938 -151.29693 1050.36287
1280.0000 -162.06487 -153.11322 8.95165 2.85813 -152.98378 1014.79161
1285.0000 -159.91558 -149.96770 9.94788 2.96113 -151.26778 1088.39160
1290.0000 -161.72145 -151.53989 10.18156 2.94724 -151.49924 1074.13030
1295.0000 -162.62786 -153.45999 9.16787 2.84680 -153.17259 1044.55627
1300.0000 -162.84975 -154.58472 8.26503 2.81816 -153.64967 1014.72469
1305.0000 -164.10210 -155.14021 8.96189 2.69845 -155.64414 924.62845
1310.0000 -162.35898 -153.61172 8.74726 2.78676 -154.17283 988.00345
1315.0000 -160.89730 -151.98488 8.91242 2.87959 -152.62636 1045.45670
1320.0000 -160.48987 -151.57426 8.91561 2.96125 -151.26587 1092.92580
1325.0000 -162.44773 -153.38915 9.05857 2.88617 -152.51667 1067.93177
1330.0000 -163.86215 -155.29840 8.56375 2.76494 -154.53634 1003.06697
1335.0000 -164.26584 -155.71022 8.55562 2.75327 -154.73077 990.52095
1340.0000 -163.19275 -154.73576 8.45699 2.77616 -154.34936 975.29752
1345.0000 -163.68003 -156.19913 7.48091 2.71271 -155.40642 908.76583
1350.0000 -163.46930 -154.48654 8.98276 2.73388 -155.05382 957.48621
1355.0000 -161.57353 -153.20986 8.36367 2.78761 -154.15862 982.97225
1360.0000 -161.09883 -151.82885 9.26998 2.91219 -152.08315 1034.21605
1365.0000 -161.55875 -151.86839 9.69036 2.90643 -152.17920 1069.07362
1370.0000 -161.77351 -150.39931 11.37420 2.95026 -151.44888 1095.01209
1375.0000 -161.56781 -152.87163 8.69618 2.94977 -151.45716 1086.28683
1380.0000 -164.69322 -155.72084 8.97238 2.77906 -154.30117 967.84357
1385.0000 -162.36586 -154.70549 7.66037 2.70842 -155.47802 948.86273
1390.0000 -163.79831 -155.57496 8.22335 2.71243 -155.41124 931.01725
1395.0000 -162.47096 -153.99180 8.47916 2.76389 -154.55384 988.96483
1400.0000 -164.20233 -155.84542 8.35691 2.74888 -154.80390 994.35410
1405.0000 -165.75941 -156.83506 8.92436 2.73627 -155.01397 968.89402
1410.0000 -165.06657 -156.10850 8.95807 2.66474 -156.20561 912.35738
1415.0000 -163.91522 -154.71007 9.20515 2.78038 -154.27908 977.24035
1420.0000 -165.87294 -157.64171 8.23123 2.69016 -155.78223 922.27903
1425.0000 -163.18184 -154.94071 8.24112 2.62016 -156.94840 885.89173
1430.0000 -164.01373 -155.78881 8.22492 2.70587 -155.52046 943.95554
1435.0000 -163.88803 -157.47339 6.41464 2.67879 -155.97161 891.28814
1440.0000 -164.12311 -157.09850 7.02461 2.63535 -156.69530 871.61894
1445.0000 -163.54846 -154.10034 9.44813 2.71792 -155.31962 924.36527
1450.0000 -162.16464 -152.82256 9.34209 2.83849 -153.31094 978.37286
1455.0000 -163.62886 -153.40555 10.22331 2.84787 -153.15479 1034.73188
1460.0000 -162.98908 -155.32341 7.66567 2.75002 -154.78485 994.22334
1465.0000 -162.25093 -153.24699 9.00395 2.83304 -153.40177 1011.67810
1470.0000 -162.15201 -152.90958 9.24243 2.87459 -152.70955 1062.77458
1475.0000 -163.05974 -154.69465 8.36509 2.87825 -152.64869 1065.71109
1480.0000 -161.83546 -152.94525 8.89021 2.80639 -153.84576 1005.24793
1485.0000 -160.94982 -151.15468 9.79515 2.97037 -151.11392 1114.31787
1490.0000 -162.55817 -152.61643 9.94175 2.92406 -151.88539 1087.76136
1495.0000 -164.66473 -154.99821 9.66653 2.84859 -153.14281 1027.64407
1500.0000 -162.19542 -154.13940 8.05602 2.73068 -155.10709 912.31283
FREEZING PROCESS: loop number 7 T-loop= 966.00000000000000
main_MD> interactions number 7 at Temperature= 966.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.93612 1.99029 3.51991
force_rgl> df(natom) -0.92380 -0.14287 0.20539
1505.0000 -165.49927 -156.93267 8.56661 2.75268 -154.74056 948.40416
1510.0000 -162.31883 -155.86187 6.45696 2.64636 -156.51194 918.46813
1515.0000 -163.01059 -155.08118 7.92941 2.74371 -154.89001 936.49430
1520.0000 -163.30638 -155.13150 8.17488 2.74410 -154.88358 963.89344
1525.0000 -163.14267 -154.04529 9.09738 2.75176 -154.75595 973.85454
1530.0000 -162.41903 -154.47464 7.94439 2.77945 -154.29457 968.43879
1535.0000 -164.17147 -155.05077 9.12070 2.78648 -154.17746 987.16967
1540.0000 -164.31533 -157.22974 7.08558 2.66785 -156.15386 913.23648
1545.0000 -164.62233 -155.83532 8.78701 2.63417 -156.71500 861.01207
1550.0000 -162.95700 -154.59420 8.36280 2.71695 -155.33587 927.16574
1555.0000 -162.98739 -154.96421 8.02318 2.68931 -155.79629 905.70608
1560.0000 -164.25249 -156.31412 7.93837 2.72284 -155.23774 920.20739
1565.0000 -163.32067 -153.50289 9.81779 2.72135 -155.26255 939.40467
1570.0000 -164.19834 -157.65243 6.54591 2.68500 -155.86810 921.09025
1575.0000 -164.53545 -156.62716 7.90829 2.63395 -156.71871 882.13298
1580.0000 -164.86881 -156.89028 7.97853 2.64084 -156.60392 896.92708
1585.0000 -163.56838 -155.13968 8.42870 2.68939 -155.79507 924.69527
1590.0000 -162.80798 -153.39562 9.41236 2.76343 -154.56144 948.55831
1595.0000 -163.64557 -153.98849 9.65708 2.78712 -154.16688 971.71043
1600.0000 -162.21115 -153.31203 8.89912 2.82400 -153.55244 1025.28351
1605.0000 -163.73443 -155.70637 8.02806 2.77110 -154.43377 982.61568
1610.0000 -162.94423 -154.67596 8.26826 2.70847 -155.47720 937.77701
1615.0000 -162.63375 -153.70286 8.93089 2.81328 -153.73097 968.56596
1620.0000 -163.20840 -154.39462 8.81378 2.76843 -154.47815 967.49665
1625.0000 -162.04446 -153.38722 8.65724 2.84456 -153.20981 1034.59306
1630.0000 -161.53219 -152.73586 8.79633 2.86556 -152.86007 1070.67002
1635.0000 -161.33994 -153.95173 7.38820 2.82479 -153.53927 1015.60787
1640.0000 -160.81196 -152.20895 8.60301 2.90026 -152.28201 1063.04890
1645.0000 -160.19363 -151.77474 8.41889 2.95754 -151.32773 1093.16563
1650.0000 -161.71387 -152.11551 9.59836 2.85956 -152.95997 999.13130
1655.0000 -163.04900 -153.42574 9.62326 2.86367 -152.89147 1040.37532
1660.0000 -164.14194 -155.95088 8.19106 2.73422 -155.04808 938.68094
1665.0000 -162.28490 -154.48866 7.79624 2.70041 -155.61137 921.90401
1670.0000 -162.99883 -154.99706 8.00178 2.75158 -154.75886 938.81762
1675.0000 -162.06628 -154.17946 7.88682 2.78889 -154.13734 983.64642
1680.0000 -162.37628 -154.84276 7.53352 2.81247 -153.74448 991.27502
1685.0000 -162.02281 -153.31935 8.70346 2.78559 -154.19233 978.75543
1690.0000 -162.83986 -154.50521 8.33465 2.77556 -154.35936 970.78991
1695.0000 -165.32332 -155.96999 9.35334 2.76165 -154.59118 986.76073
1700.0000 -162.90121 -155.20035 7.70086 2.70164 -155.59101 955.85975
1705.0000 -164.15701 -155.79077 8.36624 2.74315 -154.89943 958.86964
1710.0000 -163.38373 -155.32283 8.06089 2.68521 -155.86458 920.93965
1715.0000 -165.17137 -154.22830 10.94308 2.75005 -154.78443 963.06507
1720.0000 -163.47192 -155.95452 7.51741 2.66716 -156.16530 908.29085
1725.0000 -162.15959 -154.80731 7.35228 2.74301 -154.90177 941.16461
1730.0000 -163.63649 -154.50825 9.12824 2.77756 -154.32603 960.17702
1735.0000 -163.46748 -154.68930 8.77818 2.74403 -154.88472 997.79253
1740.0000 -163.75109 -156.01401 7.73707 2.74322 -154.89822 982.86941
1745.0000 -164.37791 -155.42235 8.95556 2.69610 -155.68325 912.62998
1750.0000 -162.04206 -152.08910 9.95296 2.86446 -152.87835 1012.85235
FREEZING PROCESS: loop number 8 T-loop= 941.00000000000000
main_MD> interactions number 8 at Temperature= 941.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.15024 -2.21262 -2.96153
force_rgl> df(natom) -0.94091 2.27564 2.04240
1755.0000 -161.43402 -152.63755 8.79647 2.90743 -152.16247 1063.97493
1760.0000 -160.24737 -150.64383 9.60353 2.94929 -151.46502 1082.12860
1765.0000 -162.00169 -152.60610 9.39558 2.87235 -152.74689 1056.29633
1770.0000 -162.65007 -155.04554 7.60453 2.78539 -154.19559 1010.62628
1775.0000 -164.45614 -156.77415 7.68199 2.69029 -155.78007 919.04930
1780.0000 -165.92591 -157.33227 8.59364 2.61867 -156.97321 863.12562
1785.0000 -164.02118 -156.38835 7.63283 2.65552 -156.35923 896.11575
1790.0000 -164.32176 -156.99162 7.33014 2.59625 -157.34666 868.15000
1795.0000 -163.24447 -154.86078 8.38369 2.67130 -156.09642 901.16039
1800.0000 -163.28826 -154.70624 8.58202 2.68981 -155.78795 925.70653
1805.0000 -163.70591 -155.59215 8.11376 2.72030 -155.28005 954.11407
1810.0000 -163.35683 -155.04130 8.31553 2.68219 -155.91497 913.46549
1815.0000 -163.27912 -155.15388 8.12524 2.69891 -155.63643 939.54581
1820.0000 -163.57313 -155.18061 8.39252 2.74984 -154.78793 969.08489
1825.0000 -162.75534 -154.86430 7.89104 2.75224 -154.74795 969.74725
1830.0000 -163.35761 -155.03548 8.32213 2.77377 -154.38925 989.51294
1835.0000 -162.87603 -155.18617 7.68986 2.74047 -154.94397 940.56956
1840.0000 -163.84600 -154.66735 9.17865 2.74735 -154.82948 975.78984
1845.0000 -162.16826 -154.22665 7.94161 2.76678 -154.50567 1004.25455
1850.0000 -163.17635 -154.71400 8.46235 2.77046 -154.44446 981.20798
1855.0000 -163.40872 -155.93007 7.47865 2.70464 -155.54099 896.93933
1860.0000 -163.79244 -155.54104 8.25140 2.72094 -155.26945 960.15938
1865.0000 -164.33807 -156.67954 7.65853 2.66537 -156.19515 889.22952
1870.0000 -164.81183 -155.54551 9.26632 2.65021 -156.44780 893.00521
1875.0000 -165.69014 -157.82846 7.86168 2.64390 -156.55286 897.93760
1880.0000 -163.95935 -155.60977 8.34958 2.63637 -156.67837 878.79988
1885.0000 -163.79539 -154.43488 9.36051 2.73751 -154.99341 989.61787
1890.0000 -162.64135 -153.20928 9.43207 2.75053 -154.77638 973.88541
1895.0000 -162.93357 -155.07990 7.85367 2.80485 -153.87139 989.57509
1900.0000 -163.53430 -156.20222 7.33208 2.71339 -155.39510 902.87136
1905.0000 -164.46034 -156.31311 8.14723 2.73660 -155.00843 956.99431
1910.0000 -162.89127 -155.11858 7.77269 2.76551 -154.52691 970.60994
1915.0000 -163.42263 -155.52578 7.89685 2.72396 -155.21900 958.03874
1920.0000 -162.23358 -154.40359 7.82999 2.74656 -154.84259 946.75843
1925.0000 -162.87870 -153.36796 9.51074 2.80442 -153.87870 980.61181
1930.0000 -162.13059 -153.57129 8.55930 2.79581 -154.02210 1008.94990
1935.0000 -163.46876 -155.75745 7.71131 2.75137 -154.76242 958.69692
1940.0000 -163.48217 -155.29770 8.18448 2.70682 -155.50471 924.68733
1945.0000 -163.58805 -155.29678 8.29127 2.69857 -155.64199 927.47832
1950.0000 -162.16163 -154.81597 7.34567 2.69106 -155.76716 928.87426
1955.0000 -162.68110 -154.14150 8.53960 2.77895 -154.30294 995.24978
1960.0000 -162.11922 -152.40327 9.71595 2.89380 -152.38954 1072.48188
1965.0000 -161.67684 -153.14150 8.53535 2.86079 -152.93943 1036.10490
1970.0000 -162.33574 -153.87116 8.46458 2.82714 -153.50018 1024.07642
1975.0000 -163.77683 -156.20206 7.57477 2.73422 -155.04815 933.25344
1980.0000 -163.75430 -155.41931 8.33500 2.66821 -156.14787 922.87027
1985.0000 -163.07615 -153.71673 9.35942 2.76875 -154.47288 972.27445
1990.0000 -162.82908 -153.19111 9.63797 2.79531 -154.03042 986.65730
1995.0000 -165.06776 -156.27363 8.79414 2.78063 -154.27498 986.00069
2000.0000 -165.50021 -157.38533 8.11488 2.63471 -156.70590 871.98456
FREEZING PROCESS: loop number 9 T-loop= 916.00000000000000
main_MD> interactions number 9 at Temperature= 916.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.27078 1.69153 0.74311
force_rgl> df(natom) -1.17820 -0.67284 3.47093
2005.0000 -165.23436 -156.67817 8.55619 2.58908 -157.46609 861.63006
2010.0000 -163.38416 -155.43813 7.94603 2.71075 -155.43923 933.26202
2015.0000 -163.24436 -155.66656 7.57781 2.68346 -155.89388 946.05911
2020.0000 -164.23015 -157.54062 6.68953 2.67398 -156.05177 912.92278
2025.0000 -163.41580 -156.71977 6.69602 2.59749 -157.32613 847.67156
2030.0000 -163.63045 -155.57160 8.05885 2.63864 -156.64052 864.48085
2035.0000 -162.22847 -154.53782 7.69065 2.73299 -155.06861 928.97225
2040.0000 -162.71043 -154.86537 7.84506 2.76133 -154.59648 984.32160
2045.0000 -165.07068 -156.27086 8.79981 2.76811 -154.48346 974.89967
2050.0000 -162.65099 -154.29505 8.35594 2.73754 -154.99279 922.56814
2055.0000 -164.80571 -156.12848 8.67723 2.75837 -154.64574 958.46836
2060.0000 -164.08309 -155.96518 8.11790 2.67937 -155.96195 896.46368
2065.0000 -163.38046 -154.95616 8.42429 2.70191 -155.58637 933.83454
2070.0000 -162.90787 -153.85727 9.05060 2.71928 -155.29697 921.40530
2075.0000 -162.45055 -154.54441 7.90614 2.72053 -155.27615 946.34327
2080.0000 -164.39266 -157.12132 7.27134 2.70591 -155.51972 921.39981
2085.0000 -164.98536 -157.10552 7.87984 2.57938 -157.62771 849.19333
2090.0000 -163.00053 -156.06725 6.93328 2.64457 -156.54173 888.09438
2095.0000 -166.07443 -158.03543 8.03900 2.61897 -156.96820 892.11185
2100.0000 -165.34337 -158.21572 7.12764 2.56407 -157.88280 826.53893
2105.0000 -165.93031 -157.63550 8.29482 2.54898 -158.13418 844.75633
2110.0000 -163.37820 -155.38587 7.99233 2.62206 -156.91669 891.61970
2115.0000 -165.33125 -157.58729 7.74395 2.64421 -156.54764 898.05627
2120.0000 -164.22217 -155.02399 9.19818 2.62414 -156.88209 880.75578
2125.0000 -160.89228 -153.15635 7.73593 2.75431 -154.71339 983.98164
2130.0000 -161.23437 -153.54808 7.68629 2.74025 -154.94770 966.82016
2135.0000 -163.60006 -153.90438 9.69568 2.83969 -153.29105 1031.51140
2140.0000 -163.96795 -154.78785 9.18011 2.70680 -155.50498 929.47467
2145.0000 -163.50141 -155.24984 8.25157 2.73815 -154.98264 958.41609
2150.0000 -164.04521 -155.04514 9.00007 2.69417 -155.71535 936.36611
2155.0000 -161.92960 -154.30984 7.61976 2.76710 -154.50041 969.59231
2160.0000 -162.51230 -154.19307 8.31923 2.75225 -154.74783 963.56245
2165.0000 -164.05410 -155.63330 8.42080 2.71997 -155.28560 944.28579
2170.0000 -161.36988 -152.80427 8.56561 2.82827 -153.48124 997.21670
2175.0000 -162.65118 -153.07386 9.57733 2.83693 -153.33708 1010.48899
2180.0000 -163.45660 -154.42635 9.03025 2.84036 -153.27991 1002.09656
2185.0000 -165.67697 -156.46753 9.20944 2.68561 -155.85795 909.27773
2190.0000 -164.71422 -156.48965 8.22457 2.63644 -156.67711 886.94092
2195.0000 -163.80587 -155.41776 8.38811 2.69030 -155.77984 932.31734
2200.0000 -162.87617 -155.34491 7.53127 2.74248 -154.91046 955.30167
2205.0000 -165.07767 -157.17235 7.90532 2.60794 -157.15199 865.76187
2210.0000 -162.70790 -154.23458 8.47332 2.66137 -156.26190 925.80271
2215.0000 -163.88189 -156.72351 7.15838 2.68548 -155.86021 901.46908
2220.0000 -165.39634 -157.13201 8.26433 2.58392 -157.55206 849.45219
2225.0000 -164.98547 -156.90769 8.07778 2.63575 -156.68857 892.96877
2230.0000 -165.02259 -157.85636 7.16623 2.59173 -157.42203 865.98813
2235.0000 -164.69330 -156.01804 8.67526 2.64362 -156.55752 886.75925
2240.0000 -163.81258 -155.58306 8.22952 2.67089 -156.10319 912.81789
2245.0000 -163.86203 -156.96503 6.89700 2.67500 -156.03481 898.68746
2250.0000 -164.56142 -156.57875 7.98267 2.63961 -156.62440 857.01346
FREEZING PROCESS: loop number 10 T-loop= 891.00000000000000
main_MD> interactions number 10 at Temperature= 891.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.10653 -0.68571 -4.04742
force_rgl> df(natom) 0.91583 3.62856 0.84072
2255.0000 -163.75217 -156.60963 7.14254 2.63369 -156.72298 884.41327
2260.0000 -164.40784 -156.24700 8.16084 2.59693 -157.33536 848.49037
2265.0000 -164.11777 -155.72852 8.38925 2.70871 -155.47313 932.89084
2270.0000 -164.17048 -156.48362 7.68686 2.66692 -156.16935 885.51900
2275.0000 -164.74137 -155.69021 9.05116 2.63099 -156.76792 898.38092
2280.0000 -163.84799 -155.62035 8.22764 2.67929 -155.96322 910.16716
2285.0000 -165.37328 -155.89542 9.47786 2.66621 -156.18117 950.13552
2290.0000 -164.77625 -157.66961 7.10664 2.60867 -157.13976 834.42343
2295.0000 -164.40538 -157.43332 6.97206 2.61310 -157.06598 854.33880
2300.0000 -164.96520 -156.79331 8.17189 2.61782 -156.98741 865.19533
2305.0000 -163.96119 -154.63646 9.32473 2.66117 -156.26511 892.79488
2310.0000 -162.70884 -156.19809 6.51074 2.72960 -155.12514 926.51765
2315.0000 -164.10107 -155.99859 8.10247 2.66815 -156.14892 857.43072
2320.0000 -162.14108 -153.79300 8.34808 2.74999 -154.78537 975.64339
2325.0000 -163.65076 -156.48637 7.16439 2.64489 -156.53633 881.28048
2330.0000 -163.17285 -156.04810 7.12475 2.63078 -156.77143 910.63257
2335.0000 -165.08752 -157.21068 7.87684 2.62179 -156.92122 891.33696
2340.0000 -165.87321 -157.24057 8.63264 2.60164 -157.25695 837.40274
2345.0000 -163.97381 -157.50365 6.47016 2.56100 -157.93400 812.37994
2350.0000 -162.92449 -154.91933 8.00516 2.70376 -155.55560 932.74708
2355.0000 -164.40216 -156.00871 8.39344 2.71192 -155.41972 956.23623
2360.0000 -163.88633 -156.67921 7.20712 2.60038 -157.27786 861.33963
2365.0000 -164.70231 -156.70100 8.00131 2.67440 -156.04477 898.69592
2370.0000 -163.93232 -155.53582 8.39649 2.65661 -156.34115 873.34218
2375.0000 -163.89263 -157.14781 6.74482 2.64571 -156.52272 897.88502
2380.0000 -165.36687 -157.87251 7.49436 2.58982 -157.45386 858.79457
2385.0000 -164.73782 -156.81783 7.91998 2.59952 -157.29230 863.13536
2390.0000 -164.88817 -157.14113 7.74704 2.64565 -156.52377 881.41294
2395.0000 -163.46520 -156.17107 7.29413 2.65924 -156.29729 900.14665
2400.0000 -164.99865 -156.44399 8.55466 2.63746 -156.66023 892.82123
2405.0000 -164.08417 -155.85804 8.22613 2.65001 -156.45103 877.33686
2410.0000 -163.72105 -155.71036 8.01069 2.66094 -156.26893 917.95934
2415.0000 -162.46240 -154.13858 8.32382 2.70263 -155.57442 942.99344
2420.0000 -163.97272 -156.20020 7.77252 2.70009 -155.61682 925.22034
2425.0000 -165.14889 -157.77991 7.36898 2.62892 -156.80251 895.87227
2430.0000 -165.26921 -157.10099 8.16822 2.60200 -157.25084 890.24029
2435.0000 -165.55426 -158.03511 7.51916 2.61829 -156.97955 884.11421
2440.0000 -165.10656 -157.68582 7.42074 2.59318 -157.39781 865.26482
2445.0000 -165.11176 -157.56861 7.54315 2.59113 -157.43193 871.78125
2450.0000 -164.03151 -156.79659 7.23493 2.63375 -156.72196 869.60842
2455.0000 -165.56300 -157.88902 7.67399 2.56606 -157.84961 827.08751
2460.0000 -164.38775 -157.16449 7.22326 2.60571 -157.18917 837.34661
2465.0000 -164.01907 -156.47131 7.54776 2.66229 -156.24648 874.34338
2470.0000 -164.07600 -157.03948 7.03651 2.63257 -156.74160 879.66228
2475.0000 -163.86365 -155.27719 8.58646 2.64761 -156.49104 878.09387
2480.0000 -164.39651 -155.62543 8.77108 2.72992 -155.11972 966.41975
2485.0000 -162.58191 -154.02543 8.55648 2.77294 -154.40305 957.42605
2490.0000 -164.84588 -156.77646 8.06942 2.68430 -155.87976 950.08554
2495.0000 -165.01714 -156.68404 8.33311 2.61160 -157.09099 881.79886
2500.0000 -165.79183 -157.78573 8.00610 2.61917 -156.96492 851.70783
FREEZING PROCESS: loop number 11 T-loop= 866.00000000000000
main_MD> interactions number 11 at Temperature= 866.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.80297 2.45227 -2.57501
force_rgl> df(natom) -0.28748 -0.45827 -2.35735
2505.0000 -164.91288 -157.66125 7.25163 2.55337 -158.06115 841.46868
2510.0000 -164.38545 -156.50265 7.88280 2.62227 -156.91328 859.98878
2515.0000 -166.09145 -158.36875 7.72271 2.57950 -157.62585 853.21267
2520.0000 -165.12611 -157.03001 8.09610 2.58591 -157.51906 853.42786
2525.0000 -164.54675 -157.50255 7.04419 2.58521 -157.53070 874.99566
2530.0000 -164.59297 -156.66588 7.92709 2.58050 -157.60906 867.44560
2535.0000 -164.70295 -157.17694 7.52601 2.64776 -156.48863 888.39138
2540.0000 -163.41095 -155.62805 7.78290 2.70046 -155.61065 940.73776
2545.0000 -165.22966 -157.56201 7.66765 2.66031 -156.27944 918.59671
2550.0000 -165.46527 -157.36045 8.10482 2.56181 -157.92056 818.92789
2555.0000 -163.90551 -156.48888 7.41664 2.66147 -156.26023 897.54417
2560.0000 -163.14748 -153.81548 9.33200 2.76403 -154.55157 972.97232
2565.0000 -164.34733 -155.57045 8.77688 2.73478 -155.03876 938.95767
2570.0000 -164.85047 -157.53475 7.31571 2.59520 -157.36428 863.12931
2575.0000 -163.91021 -157.37453 6.53567 2.60373 -157.22209 864.20013
2580.0000 -164.59417 -158.22871 6.36546 2.53317 -158.39754 822.65358
2585.0000 -164.61878 -157.87019 6.74860 2.58367 -157.55628 844.99203
2590.0000 -164.85298 -156.14741 8.70557 2.60280 -157.23756 846.67807
2595.0000 -164.38809 -157.25398 7.13410 2.64161 -156.59103 881.03173
2600.0000 -165.17025 -156.78935 8.38090 2.67866 -155.97380 894.84020
2605.0000 -165.22286 -157.10762 8.11525 2.54230 -158.24553 823.58014
2610.0000 -164.08577 -156.63432 7.45145 2.66087 -156.27022 897.15806
2615.0000 -164.11641 -155.79461 8.32180 2.60876 -157.13831 887.73237
2620.0000 -164.47676 -156.58559 7.89117 2.64373 -156.55575 912.95363
2625.0000 -164.82113 -157.49425 7.32688 2.57847 -157.64289 830.50581
2630.0000 -164.91881 -157.67160 7.24721 2.59927 -157.29646 866.66522
2635.0000 -165.15843 -157.72470 7.43374 2.62434 -156.87867 842.64326
2640.0000 -165.37595 -157.29584 8.08011 2.60800 -157.15104 866.19114
2645.0000 -164.34989 -155.62437 8.72552 2.63911 -156.63264 861.31279
2650.0000 -164.35864 -154.30052 10.05812 2.77499 -154.36884 971.15560
2655.0000 -164.48527 -156.03575 8.44952 2.68037 -155.94521 926.47784
2660.0000 -164.90118 -155.49152 9.40966 2.65698 -156.33494 876.42809
2665.0000 -165.07511 -157.74446 7.33064 2.66246 -156.24369 930.07975
2670.0000 -163.92525 -155.93888 7.98636 2.63653 -156.67559 871.81682
2675.0000 -162.22695 -153.68557 8.54138 2.73773 -154.98969 952.18128
2680.0000 -164.25012 -156.43080 7.81933 2.75170 -154.75701 959.27127
2685.0000 -164.75135 -158.00518 6.74617 2.59833 -157.31200 875.62152
2690.0000 -166.28711 -157.86634 8.42077 2.58655 -157.50830 848.25140
2695.0000 -165.99357 -159.14496 6.84861 2.57109 -157.76590 855.09309
2700.0000 -165.15911 -157.73383 7.42528 2.51859 -158.64055 788.58324
2705.0000 -163.72962 -156.43243 7.29720 2.62046 -156.94339 877.54042
2710.0000 -165.08799 -157.54539 7.54260 2.59976 -157.28818 865.02306
2715.0000 -165.12598 -157.33948 7.78650 2.60708 -157.16636 861.01512
2720.0000 -165.01521 -158.27445 6.74077 2.58248 -157.57613 842.57199
2725.0000 -164.75520 -157.53247 7.22273 2.56506 -157.86641 826.28967
2730.0000 -164.18787 -156.39794 7.78993 2.59701 -157.33411 829.09294
2735.0000 -164.00127 -155.95718 8.04409 2.65818 -156.31496 906.91956
2740.0000 -164.62145 -156.87399 7.74746 2.65676 -156.33869 899.06679
2745.0000 -165.72141 -157.98584 7.73556 2.56471 -157.87222 841.46044
2750.0000 -165.05289 -157.99024 7.06265 2.55984 -157.95323 852.16821
FREEZING PROCESS: loop number 12 T-loop= 841.00000000000000
main_MD> interactions number 12 at Temperature= 841.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.28641 1.00873 4.15909
force_rgl> df(natom) 2.57622 -1.59956 -4.18361
2755.0000 -164.94742 -157.15510 7.79232 2.60315 -157.23174 867.71739
2760.0000 -164.86049 -157.18057 7.67992 2.60703 -157.16717 873.01774
2765.0000 -163.97839 -156.17967 7.79872 2.63007 -156.78327 860.71543
2770.0000 -165.00106 -157.41866 7.58240 2.60228 -157.24619 876.59403
2775.0000 -165.31149 -158.07429 7.23720 2.54076 -158.27109 823.62781
2780.0000 -165.45558 -157.18321 8.27237 2.57680 -157.67067 845.28748
2785.0000 -165.09494 -157.59435 7.50059 2.56421 -157.88052 837.19074
2790.0000 -166.00097 -159.41622 6.58475 2.53111 -158.43201 828.20034
2795.0000 -166.39348 -158.86658 7.52690 2.47180 -159.42007 764.86224
2800.0000 -163.14150 -156.71270 6.42880 2.58535 -157.52839 849.67759
2805.0000 -166.21054 -158.53537 7.67517 2.56197 -157.91788 788.30063
2810.0000 -164.61975 -156.95443 7.66532 2.55492 -158.03521 842.90776
2815.0000 -163.07477 -154.79755 8.27723 2.70166 -155.59063 935.53803
2820.0000 -162.62844 -154.03351 8.59493 2.79530 -154.03055 954.74275
2825.0000 -165.47014 -157.16586 8.30428 2.70483 -155.53772 895.93126
2830.0000 -166.30340 -158.31499 7.98841 2.56585 -157.85315 827.88641
2835.0000 -166.11307 -159.32191 6.79116 2.53540 -158.36050 843.35903
2840.0000 -164.96731 -157.87285 7.09446 2.52674 -158.50474 837.12545
2845.0000 -164.77058 -157.75340 7.01719 2.62369 -156.88960 871.01395
2850.0000 -164.63970 -157.84040 6.79929 2.56914 -157.79843 835.03412
2855.0000 -165.71911 -158.72699 6.99212 2.55573 -158.02173 819.43818
2860.0000 -162.38888 -155.38568 7.00320 2.59855 -157.30838 807.80958
2865.0000 -164.05882 -155.97570 8.08312 2.66749 -156.15986 894.34895
2870.0000 -163.84747 -156.11274 7.73472 2.63345 -156.72693 873.78101
2875.0000 -166.02424 -157.89066 8.13358 2.60673 -157.17213 869.58394
2880.0000 -165.11193 -157.30897 7.80296 2.59217 -157.41477 849.52342
2885.0000 -165.21445 -157.82277 7.39168 2.55659 -158.00739 831.71067
2890.0000 -165.60083 -158.43338 7.16744 2.53346 -158.39272 849.98182
2895.0000 -164.70067 -156.88390 7.81677 2.55647 -158.00940 864.41291
2900.0000 -165.02854 -157.16622 7.86232 2.63140 -156.76107 878.41981
2905.0000 -165.60049 -159.05517 6.54532 2.54321 -158.23036 816.29918
2910.0000 -165.46628 -157.11035 8.35593 2.50956 -158.79099 790.87848
2915.0000 -164.92686 -158.27751 6.64935 2.56407 -157.88277 826.53726
2920.0000 -164.20367 -156.98648 7.21719 2.56218 -157.91425 790.58298
2925.0000 -165.59074 -157.46913 8.12161 2.67760 -155.99149 904.52355
2930.0000 -165.93390 -158.97865 6.95525 2.52381 -158.55354 825.58394
2935.0000 -165.47751 -158.29997 7.17753 2.52077 -158.60419 802.98366
2940.0000 -166.37239 -159.86953 6.50286 2.51352 -158.72503 817.08600
2945.0000 -166.72685 -158.77453 7.95232 2.52378 -158.55407 823.79884
2950.0000 -166.37934 -158.05886 8.32048 2.50780 -158.82021 787.55496
2955.0000 -164.68661 -156.93630 7.75031 2.63927 -156.63002 896.13850
2960.0000 -164.29233 -155.68314 8.60919 2.67345 -156.06064 907.72130
2965.0000 -165.86468 -158.73285 7.13183 2.58269 -157.57258 861.62495
2970.0000 -165.25340 -158.07226 7.18114 2.53094 -158.43472 820.43055
2975.0000 -166.55226 -158.58303 7.96924 2.51433 -158.71155 763.11013
2980.0000 -165.41508 -158.59525 6.81983 2.50246 -158.90923 794.30064
2985.0000 -165.59126 -158.41995 7.17131 2.53911 -158.29870 821.49555
2990.0000 -164.78187 -157.64219 7.13968 2.55715 -157.99804 813.49326
2995.0000 -164.78710 -158.61334 6.17376 2.54245 -158.24298 818.53906
3000.0000 -165.25759 -158.74974 6.50785 2.50399 -158.88375 800.08646
FREEZING PROCESS: loop number 13 T-loop= 816.00000000000000
main_MD> interactions number 13 at Temperature= 816.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.74208 2.46213 -0.03672
force_rgl> df(natom) 2.09607 1.40822 -1.98390
3005.0000 -165.63292 -158.83556 6.79736 2.52326 -158.56268 791.58069
3010.0000 -166.05493 -158.55914 7.49579 2.50708 -158.83221 790.77632
3015.0000 -166.00762 -158.99822 7.00941 2.49266 -159.07257 794.43626
3020.0000 -166.52808 -159.79250 6.73559 2.47766 -159.32239 787.77385
3025.0000 -166.50799 -158.34705 8.16094 2.53179 -158.42054 796.61871
3030.0000 -167.87287 -160.18908 7.68379 2.50161 -158.92345 797.34689
3035.0000 -164.61903 -158.87050 5.74853 2.46536 -159.52733 775.88837
3040.0000 -164.71041 -157.72445 6.98596 2.53349 -158.39235 796.09198
3045.0000 -165.51862 -157.24307 8.27555 2.54666 -158.17293 799.99311
3050.0000 -164.58555 -157.27601 7.30955 2.61020 -157.11433 845.24857
3055.0000 -167.27173 -160.00743 7.26430 2.57551 -157.69230 846.45361
3060.0000 -166.71218 -160.77750 5.93468 2.39032 -160.77743 731.74623
3065.0000 -166.60446 -160.49614 6.10832 2.37491 -161.03419 700.23598
3070.0000 -167.63672 -159.50616 8.13055 2.42106 -160.26530 744.55782
3075.0000 -166.97843 -159.49362 7.48481 2.50365 -158.88937 815.94781
3080.0000 -165.84923 -158.94758 6.90166 2.46667 -159.50548 743.15146
3085.0000 -164.98484 -157.93725 7.04759 2.49636 -159.01084 772.22066
3090.0000 -164.67780 -158.22385 6.45395 2.51817 -158.64745 803.16797
3095.0000 -165.25458 -157.44289 7.81168 2.58236 -157.57804 830.98870
3100.0000 -164.03400 -157.26626 6.76774 2.54952 -158.12516 838.79977
3105.0000 -164.63724 -158.09909 6.53815 2.54665 -158.17299 835.38290
3110.0000 -164.10677 -157.21306 6.89371 2.54188 -158.25245 825.66212
3115.0000 -166.53707 -159.67117 6.86591 2.54651 -158.17534 831.40157
3120.0000 -164.86418 -159.12318 5.74100 2.49973 -158.95472 759.67722
3125.0000 -166.99066 -158.62660 8.36406 2.54535 -158.19464 837.99054
3130.0000 -166.03130 -158.97859 7.05271 2.51980 -158.62042 798.18642
3135.0000 -165.51841 -158.62803 6.89038 2.51114 -158.76458 788.75214
3140.0000 -164.93985 -158.16095 6.77890 2.53442 -158.37682 819.03291
3145.0000 -164.87713 -157.51699 7.36013 2.52833 -158.47825 822.49022
3150.0000 -164.93267 -156.41305 8.51963 2.58714 -157.49850 845.58040
3155.0000 -164.60305 -157.00973 7.59332 2.64059 -156.60806 915.38568
3160.0000 -166.90471 -158.68349 8.22122 2.57265 -157.73982 832.93653
3165.0000 -165.90370 -158.90622 6.99747 2.52325 -158.56284 807.57144
3170.0000 -164.64585 -157.33221 7.31364 2.52071 -158.60525 820.02098
3175.0000 -165.09377 -157.35432 7.73946 2.54934 -158.12816 808.12735
3180.0000 -165.92806 -158.65755 7.27051 2.52376 -158.55438 821.22125
3185.0000 -166.16437 -158.13638 8.02799 2.51255 -158.74117 778.61513
3190.0000 -165.15663 -157.65969 7.49694 2.62273 -156.90561 869.66371
3195.0000 -163.93848 -156.97444 6.96404 2.57062 -157.77371 842.25454
3200.0000 -165.00444 -157.32580 7.67864 2.60616 -157.18164 864.23315
3205.0000 -166.20440 -158.94147 7.26293 2.58072 -157.60544 843.67237
3210.0000 -166.22525 -158.04632 8.17893 2.52286 -158.56942 832.14260
3215.0000 -165.94724 -157.66154 8.28570 2.57955 -157.62494 861.28561
3220.0000 -165.22228 -156.34379 8.87848 2.53945 -158.29297 838.40366
3225.0000 -165.80941 -159.23055 6.57885 2.53074 -158.43814 821.22682
3230.0000 -164.48178 -156.78005 7.70173 2.54740 -158.16063 838.46618
3235.0000 -165.74901 -158.82356 6.92545 2.53782 -158.32014 800.82302
3240.0000 -165.46653 -158.56631 6.90023 2.50630 -158.84532 814.16104
3245.0000 -166.43364 -158.71679 7.71685 2.53929 -158.29572 832.31286
3250.0000 -166.14609 -159.40624 6.73986 2.50369 -158.88880 800.85465
FREEZING PROCESS: loop number 14 T-loop= 791.00000000000000
main_MD> interactions number 14 at Temperature= 791.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.85317 1.75295 -2.22605
force_rgl> df(natom) 2.63996 3.12120 0.70270
3255.0000 -164.96234 -158.32647 6.63588 2.51603 -158.68319 769.39141
3260.0000 -165.45775 -159.40264 6.05511 2.50780 -158.82033 783.43929
3265.0000 -165.71887 -159.28213 6.43674 2.48587 -159.18564 806.59037
3270.0000 -165.83760 -160.85334 4.98426 2.45123 -159.76279 747.14762
3275.0000 -165.73876 -157.87607 7.86269 2.46131 -159.59478 749.25920
3280.0000 -165.73551 -157.28622 8.44929 2.61068 -157.10634 857.66938
3285.0000 -165.51865 -158.46652 7.05213 2.57017 -157.78120 830.06999
3290.0000 -166.12646 -158.94616 7.18030 2.54451 -158.20864 823.33862
3295.0000 -166.67054 -159.27978 7.39076 2.48581 -159.18670 787.76779
3300.0000 -166.77363 -160.30117 6.47246 2.47835 -159.31086 786.38763
3305.0000 -167.95452 -161.29793 6.65659 2.41542 -160.35928 732.32987
3310.0000 -167.15782 -161.21792 5.93990 2.35945 -161.29181 710.26776
3315.0000 -165.72372 -159.51959 6.20413 2.38358 -160.88985 707.31178
3320.0000 -167.22605 -159.03960 8.18645 2.47317 -159.39726 793.06397
3325.0000 -167.11585 -161.81529 5.30055 2.37645 -161.00858 723.08707
3330.0000 -166.43940 -160.94631 5.49309 2.36434 -161.21033 698.57423
3335.0000 -167.67702 -161.16143 6.51559 2.37694 -161.00032 698.90446
3340.0000 -166.87958 -160.61589 6.26369 2.40132 -160.59421 722.76646
3345.0000 -165.12639 -158.63649 6.48990 2.46427 -159.54544 775.87532
3350.0000 -164.23850 -156.86572 7.37278 2.52244 -158.57634 822.47986
3355.0000 -164.76572 -157.92548 6.84024 2.59217 -157.41473 865.78343
3360.0000 -165.23858 -157.71830 7.52028 2.57712 -157.66535 809.31908
3365.0000 -166.35086 -158.93064 7.42022 2.52338 -158.56076 818.77901
3370.0000 -164.43367 -158.27141 6.16226 2.54709 -158.16570 835.39744
3375.0000 -166.90689 -159.23864 7.66825 2.54499 -158.20072 809.42981
3380.0000 -164.29005 -158.17435 6.11569 2.50663 -158.83981 791.64220
3385.0000 -165.03395 -158.24975 6.78420 2.54452 -158.20854 819.57727
3390.0000 -165.42330 -158.47329 6.95001 2.56512 -157.86538 838.18797
3395.0000 -164.03650 -157.41215 6.62436 2.52931 -158.46200 799.66611
3400.0000 -166.40434 -159.89684 6.50750 2.53219 -158.41387 802.67187
3405.0000 -165.01467 -159.14924 5.86543 2.47742 -159.32640 759.49803
3410.0000 -166.28578 -159.71678 6.56900 2.44856 -159.80720 715.49404
3415.0000 -165.96731 -159.41490 6.55240 2.42530 -160.19468 740.95735
3420.0000 -164.26426 -157.29858 6.96568 2.50824 -158.81296 762.39951
3425.0000 -164.20278 -157.15820 7.04458 2.59721 -157.33070 833.57835
3430.0000 -164.94888 -157.84086 7.10803 2.57302 -157.73375 851.87114
3435.0000 -164.93093 -157.44384 7.48709 2.57708 -157.66604 812.81553
3440.0000 -164.53862 -157.99017 6.54846 2.58598 -157.51778 844.35494
3445.0000 -166.10657 -158.98040 7.12617 2.55437 -158.04448 818.62573
3450.0000 -166.46311 -160.31345 6.14966 2.45787 -159.65208 748.51944
3455.0000 -165.03953 -158.85456 6.18496 2.49923 -158.96314 795.86002
3460.0000 -165.44042 -159.44826 5.99216 2.50034 -158.94449 786.89177
3465.0000 -165.92077 -159.15978 6.76100 2.44098 -159.93357 746.93508
3470.0000 -165.73181 -158.71786 7.01395 2.47769 -159.32196 745.63022
3475.0000 -164.66281 -159.34627 5.31655 2.50035 -158.94442 761.53913
3480.0000 -166.56586 -160.17542 6.39044 2.51811 -158.64847 804.28491
3485.0000 -165.51171 -158.67369 6.83802 2.51042 -158.77659 782.26259
3490.0000 -166.96356 -158.91652 8.04704 2.51136 -158.76092 818.49251
3495.0000 -166.57245 -159.08062 7.49183 2.52495 -158.53462 826.58048
3500.0000 -165.51020 -158.37386 7.13635 2.51256 -158.74097 778.81716
FREEZING PROCESS: loop number 15 T-loop= 766.00000000000000
main_MD> interactions number 15 at Temperature= 766.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.67741 -2.58568 -1.02476
force_rgl> df(natom) -0.51267 -3.41381 0.49937
3505.0000 -166.81141 -159.77882 7.03259 2.52150 -158.59207 800.03012
3510.0000 -165.57772 -159.45105 6.12668 2.44430 -159.87823 764.13923
3515.0000 -167.06039 -159.89050 7.16988 2.45830 -159.64498 776.82337
3520.0000 -167.91266 -162.03304 5.87963 2.41021 -160.44619 733.26652
3525.0000 -167.92939 -161.98802 5.94138 2.32877 -161.80297 667.23745
3530.0000 -166.40197 -160.03644 6.36552 2.40552 -160.52422 719.17265
3535.0000 -167.39420 -160.71579 6.67841 2.40769 -160.48810 742.21593
3540.0000 -165.89439 -159.77651 6.11788 2.41022 -160.44602 722.05714
3545.0000 -167.61922 -161.47039 6.14883 2.40029 -160.61136 722.56819
3550.0000 -168.22219 -161.85392 6.36827 2.32858 -161.80603 696.04365
3555.0000 -165.57205 -158.34142 7.23063 2.40396 -160.55032 754.08317
3560.0000 -165.89233 -158.56103 7.33129 2.50999 -158.78385 818.64563
3565.0000 -166.62997 -159.06270 7.56727 2.53714 -158.33141 824.10108
3570.0000 -165.96556 -160.13673 5.82882 2.45336 -159.72719 763.64881
3575.0000 -167.10374 -160.76293 6.34081 2.35888 -161.30128 689.30730
3580.0000 -165.70233 -159.66700 6.03533 2.40369 -160.55481 734.08749
3585.0000 -165.92741 -158.65329 7.27412 2.52020 -158.61377 808.08365
3590.0000 -165.89675 -159.42348 6.47327 2.48649 -159.17524 806.35418
3595.0000 -166.47339 -159.68865 6.78474 2.47993 -159.28451 803.50346
3600.0000 -167.30882 -160.20380 7.10502 2.46556 -159.52398 782.86388
3605.0000 -165.43052 -158.52075 6.90976 2.46452 -159.54128 792.13188
3610.0000 -166.40226 -158.60585 7.79641 2.55661 -158.00718 850.51521
3615.0000 -165.92005 -158.64740 7.27265 2.56987 -157.78621 837.98936
3620.0000 -166.40916 -160.30828 6.10089 2.50962 -158.78991 786.36456
3625.0000 -166.11382 -159.24708 6.86675 2.47135 -159.42745 784.91407
3630.0000 -165.24157 -157.76257 7.47899 2.51216 -158.74769 799.44313
3635.0000 -166.55059 -159.27271 7.27788 2.50911 -158.79844 788.22627
3640.0000 -167.45101 -160.88166 6.56935 2.43734 -159.99415 729.45879
3645.0000 -167.43497 -160.53725 6.89772 2.39852 -160.64094 717.69296
3650.0000 -165.15546 -158.43625 6.71921 2.42126 -160.26195 746.81554
3655.0000 -166.35165 -159.44642 6.90523 2.48874 -159.13788 774.02599
3660.0000 -166.56791 -159.36648 7.20143 2.51414 -158.71462 780.13848
3665.0000 -166.52737 -159.33886 7.18851 2.46461 -159.53978 768.86844
3670.0000 -165.83426 -158.35077 7.48349 2.51260 -158.74032 798.80799
3675.0000 -166.08327 -159.46343 6.61984 2.53155 -158.42459 788.40511
3680.0000 -166.72909 -160.14009 6.58900 2.44340 -159.89323 769.01198
3685.0000 -165.98601 -158.80184 7.18417 2.45081 -159.76979 772.93545
3690.0000 -166.29205 -158.79179 7.50026 2.51472 -158.70504 817.16020
3695.0000 -164.91027 -158.53210 6.37817 2.46035 -159.61085 766.63352
3700.0000 -166.23816 -159.87311 6.36505 2.47376 -159.38747 755.94361
3705.0000 -165.80555 -159.66306 6.14250 2.48252 -159.24146 767.56856
3710.0000 -166.23113 -160.38397 5.84716 2.44456 -159.87383 760.53874
3715.0000 -165.72598 -159.58542 6.14055 2.43331 -160.06125 777.66496
3720.0000 -166.18595 -160.50085 5.68511 2.42773 -160.15424 759.98673
3725.0000 -165.16295 -159.43151 5.73144 2.41648 -160.34173 728.85786
3730.0000 -165.39636 -158.51361 6.88274 2.49319 -159.06366 782.85265
3735.0000 -166.48284 -159.96399 6.51885 2.45701 -159.66642 731.92499
3740.0000 -166.36761 -160.04705 6.32055 2.42637 -160.17688 743.68935
3745.0000 -167.44768 -159.60218 7.84550 2.47465 -159.37249 774.53446
3750.0000 -166.84403 -160.33613 6.50791 2.42749 -160.15821 762.71607
FREEZING PROCESS: loop number 16 T-loop= 741.00000000000000
main_MD> interactions number 16 at Temperature= 741.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.91107 -0.21156 -0.75178
force_rgl> df(natom) 0.21869 4.92920 1.77224
3755.0000 -165.93276 -159.84066 6.09209 2.41758 -160.32328 737.23812
3760.0000 -167.46868 -160.23101 7.23767 2.40522 -160.52929 738.85995
3765.0000 -167.27794 -160.49073 6.78721 2.42131 -160.26114 730.76812
3770.0000 -167.65382 -160.71712 6.93670 2.35409 -161.38105 701.50373
3775.0000 -166.88780 -160.01931 6.86848 2.43879 -159.96997 732.38727
3780.0000 -166.80666 -160.11636 6.69030 2.41025 -160.44542 733.86680
3785.0000 -166.13962 -159.25300 6.88662 2.48396 -159.21751 794.02613
3790.0000 -167.50782 -159.98666 7.52117 2.46620 -159.51332 781.60919
3795.0000 -168.36417 -161.77884 6.58533 2.38062 -160.93903 707.87114
3800.0000 -168.26982 -161.90863 6.36119 2.37275 -161.07023 720.99990
3805.0000 -167.08758 -160.56454 6.52304 2.39116 -160.76350 734.63869
3810.0000 -167.99130 -161.14714 6.84416 2.33919 -161.62927 697.93141
3815.0000 -165.60521 -159.11304 6.49216 2.43134 -160.09413 767.09457
3820.0000 -167.20985 -159.59599 7.61386 2.48500 -159.20016 791.79775
3825.0000 -165.64190 -158.80617 6.83573 2.50309 -158.89873 787.92184
3830.0000 -165.38626 -158.97213 6.41413 2.45052 -159.77457 763.43816
3835.0000 -166.94814 -161.15273 5.79542 2.42230 -160.24475 762.85115
3840.0000 -167.82560 -161.86313 5.96248 2.36342 -161.22565 698.71819
3845.0000 -167.30855 -160.96709 6.34146 2.36458 -161.20628 717.20962
3850.0000 -166.05560 -159.87504 6.18057 2.43059 -160.10657 758.52048
3855.0000 -167.34294 -160.12447 7.21847 2.43777 -159.98690 733.12146
3860.0000 -166.46228 -160.06126 6.40102 2.45255 -159.74079 776.95332
3865.0000 -165.50984 -159.48381 6.02603 2.46177 -159.58719 773.45431
3870.0000 -165.99614 -159.96858 6.02756 2.48443 -159.20961 751.60668
3875.0000 -167.23363 -161.46960 5.76403 2.41345 -160.39216 733.95258
3880.0000 -167.47450 -160.93462 6.53988 2.40364 -160.55563 742.36719
3885.0000 -166.33232 -160.31126 6.02106 2.38569 -160.85458 707.39741
3890.0000 -167.23530 -160.98900 6.24630 2.41979 -160.28656 727.90093
3895.0000 -165.61876 -160.07864 5.54012 2.42569 -160.18821 728.38112
3900.0000 -167.51664 -160.84935 6.66730 2.39999 -160.61632 684.22932
3905.0000 -166.56154 -160.90537 5.65616 2.39045 -160.77540 719.10288
3910.0000 -168.23966 -162.02367 6.21598 2.36323 -161.22885 714.15730
3915.0000 -167.68495 -161.16711 6.51784 2.30798 -162.14924 670.19229
3920.0000 -167.40374 -161.68683 5.71690 2.36354 -161.22362 712.50067
3925.0000 -167.19322 -160.06420 7.12903 2.39419 -160.71297 718.29929
3930.0000 -166.59015 -159.89424 6.69591 2.45883 -159.63605 787.88157
3935.0000 -167.14222 -160.22706 6.91516 2.42203 -160.24922 737.33346
3940.0000 -165.77963 -159.55170 6.22792 2.44889 -159.80171 743.01691
3945.0000 -165.90286 -159.61653 6.28633 2.42024 -160.27896 727.33900
3950.0000 -167.84968 -160.16666 7.68302 2.43452 -160.04118 783.21891
3955.0000 -166.84653 -159.82366 7.02288 2.42877 -160.13694 743.70412
3960.0000 -167.19888 -159.70773 7.49115 2.45859 -159.64012 790.83832
3965.0000 -167.45230 -161.73331 5.71900 2.41110 -160.43128 739.97692
3970.0000 -167.01582 -161.02164 5.99418 2.38230 -160.91116 688.21002
3975.0000 -165.91208 -159.04922 6.86287 2.41681 -160.33620 741.33493
3980.0000 -166.38582 -159.37742 7.00840 2.50715 -158.83112 805.49893
3985.0000 -166.41025 -158.87080 7.53945 2.49083 -159.10294 792.47944
3990.0000 -166.48537 -159.86169 6.62368 2.44673 -159.83764 767.51485
3995.0000 -167.15843 -159.57222 7.58621 2.48760 -159.15673 784.01239
4000.0000 -166.85887 -160.72106 6.13781 2.42677 -160.17019 747.15437
FREEZING PROCESS: loop number 17 T-loop= 716.00000000000000
main_MD> interactions number 17 at Temperature= 716.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.63073 -2.32314 1.44324
force_rgl> df(natom) -0.62699 1.62503 2.41755
4005.0000 -165.73007 -160.69538 5.03469 2.37919 -160.96299 720.25001
4010.0000 -167.76926 -161.09473 6.67453 2.37597 -161.01648 692.98936
4015.0000 -167.55600 -160.71634 6.83966 2.38141 -160.92588 706.23491
4020.0000 -168.01457 -161.18223 6.83235 2.41406 -160.38193 704.36127
4025.0000 -166.54484 -160.35738 6.18746 2.37476 -161.03667 704.21709
4030.0000 -167.90764 -161.87870 6.02894 2.40240 -160.57619 702.00426
4035.0000 -167.54583 -161.47812 6.06770 2.32933 -161.79352 664.44841
4040.0000 -164.55908 -157.81979 6.73929 2.48607 -159.18226 757.86850
4045.0000 -165.80901 -158.81524 6.99378 2.50691 -158.83516 794.54817
4050.0000 -165.30960 -159.34042 5.96918 2.49455 -159.04103 747.02810
4055.0000 -167.51274 -160.56702 6.94572 2.42334 -160.22736 747.51384
4060.0000 -167.31568 -160.04318 7.27250 2.41996 -160.28372 769.07655
4065.0000 -167.32858 -161.54154 5.78704 2.42588 -160.18502 754.64969
4070.0000 -167.03251 -161.72511 5.30740 2.35997 -161.28307 690.86249
4075.0000 -167.16230 -161.24649 5.91581 2.35722 -161.32896 703.72965
4080.0000 -167.90064 -160.63596 7.26468 2.40394 -160.55063 753.53466
4085.0000 -167.43765 -161.14871 6.28895 2.34105 -161.59826 712.15669
4090.0000 -169.44377 -163.14667 6.29709 2.27650 -162.67367 636.17239
4095.0000 -167.84973 -161.47592 6.37381 2.32761 -161.82227 673.25573
4100.0000 -167.07533 -161.15653 5.91881 2.35645 -161.34168 675.69548
4105.0000 -166.46529 -159.85239 6.61290 2.44133 -159.92768 749.57616
4110.0000 -166.72823 -159.65467 7.07356 2.43137 -160.09355 728.28287
4115.0000 -167.30030 -160.79994 6.50036 2.41675 -160.33711 739.94652
4120.0000 -166.00715 -159.30918 6.69797 2.41840 -160.30960 723.48569
4125.0000 -166.45473 -159.99504 6.45969 2.46880 -159.47009 779.80934
4130.0000 -166.55869 -159.47495 7.08374 2.45581 -159.68647 784.15015
4135.0000 -167.44742 -160.95846 6.48896 2.41357 -160.39010 737.28731
4140.0000 -166.95616 -160.63205 6.32411 2.40291 -160.56775 735.40112
4145.0000 -166.89160 -161.15412 5.73748 2.42206 -160.24870 736.91395
4150.0000 -167.52817 -161.29702 6.23115 2.33622 -161.67882 678.42634
4155.0000 -167.92663 -162.05812 5.86850 2.34801 -161.48233 675.15173
4160.0000 -167.85909 -161.27844 6.58065 2.33757 -161.65627 699.75598
4165.0000 -167.33791 -161.77726 5.56065 2.36873 -161.13723 719.84754
4170.0000 -167.63895 -162.36987 5.26908 2.34430 -161.54420 687.05505
4175.0000 -166.66110 -160.66751 5.99358 2.33216 -161.74649 673.24055
4180.0000 -166.63356 -160.09841 6.53516 2.41054 -160.44062 728.28440
4185.0000 -166.97327 -160.77024 6.20304 2.39839 -160.64307 705.41443
4190.0000 -167.81375 -160.29714 7.51661 2.39396 -160.71688 730.38467
4195.0000 -167.49976 -161.23739 6.26237 2.37241 -161.07592 723.05247
4200.0000 -166.43795 -159.65842 6.77953 2.42561 -160.18960 744.86771
4205.0000 -168.17028 -159.95345 8.21683 2.47952 -159.29141 776.66348
4210.0000 -167.74190 -160.81465 6.92725 2.40588 -160.51834 734.45343
4215.0000 -167.49769 -160.81525 6.68244 2.40996 -160.45033 721.48399
4220.0000 -166.43664 -160.54105 5.89559 2.38838 -160.80976 719.60544
4225.0000 -167.97808 -162.05871 5.91937 2.35809 -161.31451 711.58117
4230.0000 -166.49412 -159.73918 6.75494 2.43597 -160.01704 747.82881
4235.0000 -167.11197 -161.04034 6.07163 2.44245 -159.90900 743.85885
4240.0000 -167.14881 -160.62379 6.52501 2.40487 -160.53502 709.75488
4245.0000 -165.56456 -159.79482 5.76975 2.42684 -160.16914 747.57790
4250.0000 -167.56078 -160.07508 7.48570 2.41655 -160.34057 772.32792
FREEZING PROCESS: loop number 18 T-loop= 691.00000000000000
main_MD> interactions number 18 at Temperature= 691.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 6.74420 1.08749 -2.56706
force_rgl> df(natom) 0.37829 -2.38195 0.64732
4255.0000 -169.02166 -162.78177 6.23989 2.33008 -161.78104 671.31971
4260.0000 -167.17316 -161.15124 6.02193 2.29414 -162.37976 653.56860
4265.0000 -166.54592 -159.96496 6.58096 2.40588 -160.51826 720.67825
4270.0000 -167.39495 -160.81165 6.58330 2.41198 -160.41666 735.79965
4275.0000 -168.03569 -161.94228 6.09341 2.33804 -161.64845 697.34635
4280.0000 -166.94973 -161.46987 5.47986 2.36623 -161.17881 691.90404
4285.0000 -167.60497 -162.36797 5.23700 2.31899 -161.96579 661.65252
4290.0000 -167.24782 -160.44897 6.79886 2.39452 -160.70747 740.75456
4295.0000 -167.42623 -160.92108 6.50515 2.41241 -160.40949 729.20165
4300.0000 -166.74854 -160.62561 6.12293 2.38436 -160.87671 714.66562
4305.0000 -166.73541 -160.59038 6.14503 2.44215 -159.91404 760.41204
4310.0000 -166.61329 -160.04827 6.56502 2.38795 -160.81698 720.46684
4315.0000 -167.87585 -161.12264 6.75321 2.40178 -160.58664 720.14623
4320.0000 -166.73761 -161.58199 5.15562 2.35428 -161.37797 679.86177
4325.0000 -167.48590 -161.31751 6.16839 2.36011 -161.28072 699.16654
4330.0000 -167.10710 -162.21575 4.89136 2.38817 -160.81336 703.63931
4335.0000 -167.85281 -160.82681 7.02600 2.31137 -162.09279 662.94093
4340.0000 -167.63313 -161.86446 5.76867 2.34697 -161.49975 685.57481
4345.0000 -167.06364 -160.96879 6.09485 2.36155 -161.25677 660.56673
4350.0000 -166.87173 -161.11753 5.75420 2.37161 -161.08915 708.17420
4355.0000 -167.21006 -160.27640 6.93366 2.39062 -160.77251 729.81330
4360.0000 -165.04903 -158.97436 6.07467 2.46920 -159.46342 752.90305
4365.0000 -167.12757 -161.88430 5.24328 2.43334 -160.06072 737.67468
4370.0000 -168.19906 -162.67262 5.52645 2.29898 -162.29927 642.25993
4375.0000 -168.56355 -162.87081 5.69275 2.28508 -162.53084 656.81328
4380.0000 -167.72850 -161.69307 6.03542 2.33626 -161.67816 672.65719
4385.0000 -167.23095 -161.59359 5.63736 2.32473 -161.87014 666.04953
4390.0000 -167.62021 -161.19246 6.42775 2.34792 -161.48388 685.92727
4395.0000 -168.17036 -161.05443 7.11592 2.34542 -161.52544 698.91414
4400.0000 -167.34854 -160.61415 6.73439 2.37933 -160.96056 713.50678
4405.0000 -168.17486 -162.85924 5.31561 2.35025 -161.44505 694.99692
4410.0000 -169.01047 -162.99760 6.01287 2.28584 -162.51803 655.75404
4415.0000 -168.48854 -162.09776 6.39078 2.26846 -162.80761 625.80479
4420.0000 -166.95539 -160.46750 6.48789 2.37094 -161.10038 727.78984
4425.0000 -168.06343 -162.34559 5.71784 2.37747 -160.99158 733.49574
4430.0000 -166.79167 -160.14158 6.65009 2.33316 -161.72979 684.72680
4435.0000 -166.97262 -159.35170 7.62091 2.44688 -159.83523 749.96426
4440.0000 -166.72634 -160.29113 6.43521 2.41880 -160.30293 710.73837
4445.0000 -166.64969 -161.09812 5.55157 2.40773 -160.48742 728.40337
4450.0000 -169.27954 -162.74380 6.53574 2.30929 -162.12743 685.53192
4455.0000 -168.80026 -162.36991 6.43035 2.27241 -162.74186 652.03524
4460.0000 -168.41653 -162.11952 6.29701 2.28483 -162.53501 694.18916
4465.0000 -168.05442 -163.19011 4.86431 2.26056 -162.93926 678.27383
4470.0000 -168.75971 -163.09362 5.66609 2.26990 -162.78372 645.96218
4475.0000 -168.56672 -162.55927 6.00745 2.30570 -162.18727 650.45036
4480.0000 -168.01741 -161.37226 6.64515 2.32946 -161.79135 696.15876
4485.0000 -166.98529 -160.11126 6.87402 2.39894 -160.63396 729.83155
4490.0000 -167.67202 -161.10130 6.57072 2.40462 -160.53924 729.46322
4495.0000 -167.23273 -161.29970 5.93303 2.34594 -161.51681 707.81662
4500.0000 -168.30319 -162.86085 5.44235 2.28930 -162.46053 636.70431
FREEZING PROCESS: loop number 19 T-loop= 666.00000000000000
main_MD> interactions number 19 at Temperature= 666.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.63738 -0.27542 1.21669
force_rgl> df(natom) 0.91812 -7.71843 -1.05822
4505.0000 -170.15682 -163.53684 6.61998 2.24617 -163.17907 620.60535
4510.0000 -168.64817 -163.06276 5.58541 2.24586 -163.18424 607.86708
4515.0000 -167.58413 -160.89508 6.68905 2.33131 -161.76063 669.41462
4520.0000 -167.50870 -161.60863 5.90007 2.39691 -160.66777 730.02358
4525.0000 -168.16503 -161.82351 6.34152 2.31240 -162.07567 660.63736
4530.0000 -169.31428 -163.74139 5.57289 2.26928 -162.79404 650.19800
4535.0000 -169.33575 -163.20046 6.13529 2.22682 -163.50142 620.30949
4540.0000 -168.79077 -163.10059 5.69018 2.22072 -163.60306 604.35646
4545.0000 -167.71229 -162.01774 5.69456 2.27278 -162.73574 634.64941
4550.0000 -169.17194 -163.52513 5.64681 2.25189 -163.08369 632.49648
4555.0000 -167.49695 -161.69681 5.80014 2.26953 -162.78984 627.78760
4560.0000 -168.53278 -162.10911 6.42367 2.29196 -162.41610 636.03174
4565.0000 -167.53704 -161.49360 6.04344 2.34100 -161.59910 694.76483
4570.0000 -167.06579 -161.29459 5.77120 2.35249 -161.40772 713.02440
4575.0000 -168.13843 -161.95567 6.18276 2.31651 -162.00710 666.40439
4580.0000 -167.36362 -162.42067 4.94295 2.32450 -161.87411 678.76499
4585.0000 -167.99099 -161.38499 6.60599 2.34053 -161.60696 689.99271
4590.0000 -167.63995 -161.48902 6.15093 2.33830 -161.64411 683.74146
4595.0000 -168.15959 -161.87362 6.28596 2.32320 -161.89567 683.34897
4600.0000 -168.99698 -163.48914 5.50784 2.28431 -162.54363 675.54134
4605.0000 -169.43325 -163.56799 5.86526 2.22250 -163.57341 614.60478
4610.0000 -167.55228 -161.30605 6.24623 2.27767 -162.65428 649.05384
4615.0000 -165.97133 -161.11764 4.85369 2.41735 -160.32719 735.14255
4620.0000 -167.29476 -161.93565 5.35911 2.36100 -161.26604 691.04246
4625.0000 -166.84524 -160.22674 6.61850 2.34029 -161.61102 663.02077
4630.0000 -167.63641 -161.45697 6.17944 2.35049 -161.44109 689.48796
4635.0000 -168.30209 -163.05011 5.25198 2.30555 -162.18975 683.63006
4640.0000 -168.98614 -162.72073 6.26540 2.27915 -162.62956 660.17003
4645.0000 -168.48239 -162.35360 6.12879 2.25353 -163.05638 636.30637
4650.0000 -169.12460 -163.27258 5.85202 2.25371 -163.05348 643.75253
4655.0000 -168.86079 -162.38161 6.47917 2.28790 -162.48376 669.96165
4660.0000 -167.37750 -161.29904 6.07846 2.32442 -161.87544 659.45829
4665.0000 -167.44044 -161.29500 6.14545 2.35569 -161.35434 700.24059
4670.0000 -167.90282 -161.74310 6.15972 2.33594 -161.68343 699.82982
4675.0000 -166.91611 -160.03827 6.87785 2.38533 -160.86062 702.96356
4680.0000 -168.37227 -162.09711 6.27516 2.34880 -161.46927 680.53372
4685.0000 -167.99864 -162.11824 5.88040 2.27058 -162.77231 658.59835
4690.0000 -167.08544 -161.30547 5.77997 2.29312 -162.39684 658.09692
4695.0000 -167.89396 -161.75934 6.13462 2.35482 -161.36889 700.82702
4700.0000 -167.78847 -162.04923 5.73924 2.35346 -161.39155 678.82444
4705.0000 -169.01434 -163.26090 5.75344 2.28279 -162.56893 632.43467
4710.0000 -168.99083 -163.21097 5.77986 2.25874 -162.96960 643.64985
4715.0000 -168.80869 -162.97414 5.83455 2.26837 -162.80915 651.58278
4720.0000 -169.15310 -163.83528 5.31782 2.26563 -162.85485 651.74104
4725.0000 -168.52802 -164.24114 4.28688 2.19406 -164.04718 583.54231
4730.0000 -168.85040 -163.40510 5.44530 2.23744 -163.32445 618.47434
4735.0000 -169.01723 -163.02395 5.99329 2.25595 -163.01614 656.04612
4740.0000 -166.92474 -161.51516 5.40959 2.27225 -162.74459 639.45201
4745.0000 -166.93292 -161.71718 5.21574 2.32295 -161.89982 671.10183
4750.0000 -167.48748 -161.76783 5.71966 2.33971 -161.62071 690.33052
FREEZING PROCESS: loop number 20 T-loop= 641.00000000000000
main_MD> interactions number 20 at Temperature= 641.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.45120 2.59531 -0.29442
force_rgl> df(natom) -0.76478 -0.03407 0.76745
4755.0000 -167.92873 -161.79633 6.13240 2.33682 -161.66888 681.76205
4760.0000 -167.48759 -160.84757 6.64003 2.40427 -160.54502 743.30594
4765.0000 -168.73171 -162.28894 6.44277 2.34713 -161.49702 687.50766
4770.0000 -168.13340 -162.90962 5.22378 2.30164 -162.25496 648.65730
4775.0000 -167.63325 -161.67814 5.95512 2.24805 -163.14775 596.45863
4780.0000 -167.77446 -161.24837 6.52609 2.36531 -161.19422 692.80185
4785.0000 -168.18558 -161.29102 6.89456 2.33717 -161.66299 684.38703
4790.0000 -166.32883 -161.10745 5.22138 2.33283 -161.73527 660.08223
4795.0000 -168.04944 -160.71299 7.33645 2.39532 -160.69422 711.84858
4800.0000 -167.61506 -161.77775 5.83731 2.33797 -161.64960 677.36074
4805.0000 -168.91749 -163.42283 5.49467 2.29243 -162.40832 670.23976
4810.0000 -168.63801 -162.17725 6.46076 2.26738 -162.82574 644.48701
4815.0000 -168.85798 -161.91832 6.93967 2.31619 -162.01254 688.25266
4820.0000 -168.46135 -163.60518 4.85618 2.25062 -163.10487 637.16545
4825.0000 -168.43562 -162.71790 5.71773 2.26355 -162.88944 634.88184
4830.0000 -167.76144 -161.34533 6.41611 2.31780 -161.98572 672.74292
4835.0000 -168.68382 -163.14334 5.54048 2.30489 -162.20071 675.65830
4840.0000 -169.90763 -164.67704 5.23059 2.19916 -163.96225 607.93649
4845.0000 -169.78675 -164.04322 5.74352 2.17663 -164.33749 567.50636
4850.0000 -168.51939 -163.03924 5.48015 2.24293 -163.23291 612.04129
4855.0000 -167.99595 -161.44938 6.54657 2.27568 -162.68737 640.89344
4860.0000 -168.05520 -162.49538 5.55982 2.29844 -162.30819 657.48908
4865.0000 -167.84970 -162.33253 5.51717 2.27588 -162.68404 633.54268
4870.0000 -168.20500 -163.02425 5.18075 2.28501 -162.53195 632.46928
4875.0000 -169.59597 -164.59383 5.00214 2.21259 -163.73845 583.71943
4880.0000 -168.66479 -164.04532 4.61948 2.20289 -163.90006 570.26435
4885.0000 -167.46436 -162.62607 4.83829 2.25965 -162.95442 655.24693
4890.0000 -169.60975 -163.75517 5.85459 2.22942 -163.45815 614.96530
4895.0000 -168.84315 -163.32065 5.52251 2.23114 -163.42947 597.62359
4900.0000 -168.88509 -162.88231 6.00278 2.22778 -163.48534 646.37429
4905.0000 -170.52532 -165.40648 5.11883 2.17463 -164.37090 578.73727
4910.0000 -169.25646 -163.73631 5.52014 2.16755 -164.48881 577.94487
4915.0000 -169.69702 -164.29896 5.39806 2.20577 -163.85209 593.02708
4920.0000 -168.72752 -162.19718 6.53035 2.25855 -162.97274 623.15931
4925.0000 -169.03101 -162.63425 6.39676 2.29412 -162.38023 657.21273
4930.0000 -168.60011 -163.14494 5.45517 2.24158 -163.25550 643.46131
4935.0000 -168.38244 -161.94562 6.43682 2.27840 -162.64207 669.00494
4940.0000 -168.29373 -161.08121 7.21252 2.34458 -161.53953 702.84016
4945.0000 -168.11141 -162.27393 5.83748 2.31696 -161.99962 709.32282
4950.0000 -167.08869 -162.32522 4.76347 2.30419 -162.21248 653.18562
4955.0000 -167.61495 -162.40575 5.20919 2.31632 -162.01025 693.16332
4960.0000 -169.15774 -163.94945 5.20829 2.22866 -163.47075 613.02414
4965.0000 -169.87133 -164.75244 5.11889 2.16282 -164.56758 566.25761
4970.0000 -169.68834 -164.81554 4.87280 2.18006 -164.28033 596.04732
4975.0000 -168.12313 -163.49161 4.63152 2.19007 -164.11366 596.47474
4980.0000 -169.51336 -163.80607 5.70729 2.21411 -163.71311 595.67983
4985.0000 -168.75562 -163.66189 5.09373 2.20441 -163.87478 600.53835
4990.0000 -169.19718 -163.80434 5.39283 2.23354 -163.38949 642.29293
4995.0000 -169.35341 -162.87112 6.48229 2.24230 -163.24349 649.23416
5000.0000 -168.53706 -162.95897 5.57809 2.24248 -163.24047 639.68301
FREEZING PROCESS: loop number 21 T-loop= 616.00000000000000
main_MD> interactions number 21 at Temperature= 616.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.04675 0.10715 0.10663
force_rgl> df(natom) 0.17080 1.62961 -2.17881
5005.0000 -168.69828 -163.17810 5.52018 2.30522 -162.19519 697.77022
5010.0000 -169.41922 -163.07113 6.34809 2.25242 -163.07485 646.46379
5015.0000 -169.47916 -162.77605 6.70312 2.23304 -163.39772 628.77822
5020.0000 -168.36995 -162.20139 6.16856 2.28040 -162.60882 656.13100
5025.0000 -168.53363 -162.97695 5.55667 2.31543 -162.02512 713.20854
5030.0000 -169.94544 -164.91161 5.03383 2.17749 -164.32318 609.38846
5035.0000 -168.05170 -161.99929 6.05241 2.23701 -163.33166 607.37896
5040.0000 -168.14252 -163.13452 5.00800 2.28075 -162.60289 660.00262
5045.0000 -167.93029 -162.52788 5.40241 2.27841 -162.64183 659.63847
5050.0000 -169.94541 -165.09772 4.84769 2.21805 -163.64749 628.53631
5055.0000 -169.89677 -164.72432 5.17245 2.15424 -164.71064 588.79015
5060.0000 -168.58724 -163.18839 5.39886 2.17628 -164.34331 594.79382
5065.0000 -169.22220 -163.42819 5.79401 2.25058 -163.10562 630.62458
5070.0000 -169.60181 -163.86318 5.73863 2.22725 -163.49425 646.11800
5075.0000 -169.66033 -163.55972 6.10061 2.22425 -163.54412 646.85173
5080.0000 -168.12715 -162.83827 5.28888 2.24520 -163.19515 646.41909
5085.0000 -168.34184 -162.10602 6.23582 2.29630 -162.34379 684.28609
5090.0000 -168.81023 -163.52039 5.28984 2.27760 -162.65534 650.42431
5095.0000 -169.61516 -163.95225 5.66290 2.21034 -163.77592 613.87264
5100.0000 -168.97461 -162.73678 6.23783 2.24207 -163.24739 644.04427
5105.0000 -169.08547 -163.64766 5.43781 2.21494 -163.69933 593.56190
5110.0000 -169.07699 -163.57803 5.49896 2.18711 -164.16292 593.32462
5115.0000 -168.38483 -163.11081 5.27403 2.22775 -163.48592 621.31453
5120.0000 -168.98802 -163.30428 5.68374 2.23696 -163.33251 628.83119
5125.0000 -168.42953 -163.09021 5.33932 2.23949 -163.29030 620.45170
5130.0000 -168.65145 -163.00611 5.64534 2.23768 -163.32039 618.66073
5135.0000 -168.85169 -162.85585 5.99584 2.29481 -162.36871 669.18564
5140.0000 -169.46861 -164.33947 5.12914 2.24476 -163.20250 620.20751
5145.0000 -169.89566 -164.46520 5.43046 2.16663 -164.50416 552.20346
5150.0000 -169.68998 -164.34560 5.34437 2.20055 -163.93896 593.01320
5155.0000 -169.20535 -163.66050 5.54485 2.23366 -163.38750 630.04661
5160.0000 -169.53269 -165.03995 4.49274 2.17828 -164.31009 571.58591
5165.0000 -168.86025 -163.70679 5.15345 2.19827 -163.97708 577.65817
5170.0000 -168.98101 -163.23140 5.74962 2.23539 -163.35864 610.40302
5175.0000 -167.89361 -162.98208 4.91153 2.25004 -163.11461 627.94958
5180.0000 -168.86946 -163.10210 5.76736 2.24459 -163.20539 643.24046
5185.0000 -168.33644 -162.72158 5.61487 2.24099 -163.26539 628.32749
5190.0000 -168.36497 -161.28294 7.08203 2.33044 -161.77501 697.55558
5195.0000 -169.19339 -162.91441 6.27898 2.32132 -161.92700 698.52814
5200.0000 -169.31697 -164.02075 5.29622 2.24394 -163.21618 640.22894
5205.0000 -168.68888 -163.65028 5.03860 2.19349 -164.05659 596.22732
5210.0000 -169.08969 -163.89757 5.19212 2.24174 -163.25281 633.35593
5215.0000 -169.17303 -163.85966 5.31337 2.18077 -164.26860 575.74198
5220.0000 -168.99083 -163.15763 5.83320 2.21359 -163.72185 580.30429
5225.0000 -170.60123 -164.81075 5.79048 2.20984 -163.78435 583.70018
5230.0000 -170.37244 -164.90352 5.46892 2.12893 -165.13225 556.61532
5235.0000 -169.85439 -165.17780 4.67659 2.14345 -164.89024 572.07372
5240.0000 -168.69694 -163.60965 5.08729 2.20522 -163.86127 617.90287
5245.0000 -168.51728 -162.76858 5.74869 2.24758 -163.15549 638.60396
5250.0000 -168.69123 -163.81836 4.87287 2.22102 -163.59795 589.60486
FREEZING PROCESS: loop number 22 T-loop= 591.00000000000000
main_MD> interactions number 22 at Temperature= 591.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.88159 -3.11402 1.66725
force_rgl> df(natom) 1.90277 3.00174 -0.50737
5255.0000 -169.29901 -163.80611 5.49290 2.17927 -164.29357 585.40438
5260.0000 -169.40987 -164.22565 5.18422 2.18800 -164.14816 584.25869
5265.0000 -169.10065 -164.42691 4.67374 2.16640 -164.50797 554.76970
5270.0000 -169.40820 -163.63601 5.77219 2.21243 -163.74111 610.98898
5275.0000 -169.02773 -163.32571 5.70203 2.21736 -163.65902 598.05006
5280.0000 -169.06330 -163.44476 5.61854 2.19537 -164.02541 589.25939
5285.0000 -170.21254 -164.55408 5.65846 2.19943 -163.95773 587.80065
5290.0000 -169.51856 -164.23027 5.28829 2.18464 -164.20410 586.20426
5295.0000 -168.96473 -164.38554 4.57919 2.16237 -164.57520 594.47271
5300.0000 -169.34979 -163.91787 5.43193 2.17603 -164.34760 582.33399
5305.0000 -169.51658 -164.03105 5.48553 2.18615 -164.17888 593.77788
5310.0000 -169.07589 -163.70028 5.37561 2.17555 -164.35547 579.86470
5315.0000 -169.35664 -164.69646 4.66017 2.17401 -164.38113 587.36972
5320.0000 -169.40377 -164.49087 4.91290 2.15054 -164.77227 562.08969
5325.0000 -169.60080 -164.19494 5.40586 2.19155 -164.08901 585.38695
5330.0000 -168.87451 -163.73759 5.13692 2.22009 -163.61351 619.60185
5335.0000 -169.00034 -164.02733 4.97301 2.18089 -164.26662 569.05577
5340.0000 -168.88046 -163.77884 5.10162 2.22457 -163.53880 581.73166
5345.0000 -167.82547 -162.94352 4.88194 2.22879 -163.46850 586.34688
5350.0000 -169.15951 -164.56079 4.59872 2.22638 -163.50867 629.62931
5355.0000 -169.15904 -163.87414 5.28490 2.19367 -164.05370 593.93842
5360.0000 -167.74207 -163.25384 4.48823 2.21119 -163.76181 578.01892
5365.0000 -169.30103 -163.77459 5.52643 2.25450 -163.04028 629.22968
5370.0000 -169.54524 -164.46492 5.08032 2.19295 -164.06557 584.53921
5375.0000 -169.52360 -163.83678 5.68682 2.18897 -164.13203 600.16025
5380.0000 -169.79199 -164.82072 4.97127 2.17732 -164.32610 585.75031
5385.0000 -168.19883 -164.12455 4.07427 2.17274 -164.40232 558.66788
5390.0000 -169.39588 -164.74667 4.64921 2.17230 -164.40964 586.42071
5395.0000 -169.53081 -164.95107 4.57974 2.17142 -164.42429 561.52243
5400.0000 -169.83935 -164.79957 5.03977 2.14430 -164.87620 561.81343
5405.0000 -168.92808 -163.87047 5.05761 2.15339 -164.72464 558.40121
5410.0000 -169.72904 -164.39204 5.33700 2.17631 -164.34287 589.18152
5415.0000 -170.34147 -164.09823 6.24325 2.13376 -165.05181 567.24999
5420.0000 -170.52475 -165.77936 4.74539 2.13187 -165.08318 559.80748
5425.0000 -169.87157 -165.06541 4.80616 2.13323 -165.06060 541.74483
5430.0000 -169.85187 -164.16814 5.68373 2.12864 -165.13710 544.44267
5435.0000 -167.58941 -162.34527 5.24414 2.24954 -163.12287 624.47802
5440.0000 -167.92638 -162.77092 5.15547 2.30742 -162.15865 669.08571
5445.0000 -168.73160 -163.05968 5.67192 2.25989 -162.95052 634.11452
5450.0000 -167.96728 -162.20594 5.76134 2.25526 -163.02755 620.49566
5455.0000 -169.75442 -163.82420 5.93022 2.26869 -162.80386 652.20050
5460.0000 -170.13176 -164.79887 5.33289 2.16133 -164.59237 583.14305
5465.0000 -168.80153 -164.44063 4.36091 2.13449 -165.03958 551.15996
5470.0000 -170.17380 -164.64277 5.53103 2.18134 -164.25903 601.26959
5475.0000 -170.43193 -164.56267 5.86926 2.18657 -164.17189 596.89639
5480.0000 -169.19063 -163.79925 5.39139 2.15203 -164.74744 579.50294
5485.0000 -168.96039 -163.65190 5.30850 2.18233 -164.24261 583.84715
5490.0000 -169.81879 -164.69431 5.12448 2.19233 -164.07594 576.62528
5495.0000 -168.76460 -163.90445 4.86015 2.15354 -164.72229 534.03429
5500.0000 -169.74465 -164.85059 4.89406 2.17351 -164.38951 554.41406
FREEZING PROCESS: loop number 23 T-loop= 566.00000000000000
main_MD> interactions number 23 at Temperature= 566.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.74478 0.10233 1.17549
force_rgl> df(natom) 2.49731 -0.72047 -0.77482
5505.0000 -170.05242 -165.27231 4.78012 2.12740 -165.15766 522.26147
5510.0000 -170.70659 -166.26720 4.43939 2.09725 -165.66001 539.51450
5515.0000 -169.42073 -163.90597 5.51475 2.12185 -165.25012 569.79968
5520.0000 -169.53613 -164.55585 4.98028 2.19468 -164.03680 612.96595
5525.0000 -169.49060 -163.56664 5.92397 2.20957 -163.78877 619.21195
5530.0000 -170.72517 -165.64720 5.07796 2.18061 -164.27126 612.43841
5535.0000 -170.21575 -165.47479 4.74096 2.10450 -165.53920 523.29698
5540.0000 -170.42757 -165.81508 4.61250 2.11909 -165.29611 553.60863
5545.0000 -171.23108 -166.45370 4.77738 2.05234 -166.40821 519.11267
5550.0000 -171.83382 -166.32073 5.51308 2.04080 -166.60041 531.20522
5555.0000 -171.55893 -166.50079 5.05814 2.05694 -166.33149 546.56641
5560.0000 -170.83642 -166.14061 4.69580 2.04306 -166.56280 529.76035
5565.0000 -170.45347 -165.44965 5.00382 2.09362 -165.72050 564.30290
5570.0000 -170.90302 -166.92762 3.97540 2.09562 -165.68716 558.29920
5575.0000 -170.17811 -165.00180 5.17631 2.06656 -166.17125 543.91092
5580.0000 -170.24953 -164.83580 5.41373 2.17848 -164.30666 612.21316
5585.0000 -169.63716 -164.26808 5.36908 2.17439 -164.37480 586.67771
5590.0000 -170.11654 -164.33764 5.77890 2.19694 -163.99917 584.15447
5595.0000 -169.87830 -165.24112 4.63718 2.14904 -164.79722 563.84750
5600.0000 -170.91309 -165.40783 5.50526 2.12372 -165.21897 558.92075
5605.0000 -170.50417 -164.84655 5.65762 2.11404 -165.38026 559.23623
5610.0000 -170.31524 -165.43662 4.87863 2.09371 -165.71899 552.51443
5615.0000 -170.98413 -166.09562 4.88850 2.07896 -165.96469 552.75414
5620.0000 -169.54274 -164.47241 5.07034 2.10681 -165.50081 569.87888
5625.0000 -169.81061 -164.33339 5.47722 2.15391 -164.71613 573.03012
5630.0000 -169.30022 -163.99010 5.31012 2.18747 -164.15702 598.93823
5635.0000 -169.31133 -164.59627 4.71506 2.14791 -164.81596 585.54552
5640.0000 -169.13834 -164.25511 4.88323 2.17376 -164.38544 582.40172
5645.0000 -169.90369 -165.53580 4.36789 2.17633 -164.34257 576.17339
5650.0000 -169.66580 -164.99500 4.67080 2.13071 -165.10264 544.39236
5655.0000 -170.83176 -165.58354 5.24822 2.10492 -165.53216 526.96768
5660.0000 -170.01920 -165.04386 4.97534 2.11155 -165.42171 531.16081
5665.0000 -169.97683 -164.83126 5.14557 2.13390 -165.04939 560.74985
5670.0000 -169.64424 -164.67101 4.97323 2.12651 -165.17253 563.56460
5675.0000 -169.37937 -164.20402 5.17535 2.16631 -164.50939 583.54508
5680.0000 -170.25969 -164.82389 5.43581 2.14271 -164.90257 563.70453
5685.0000 -171.08279 -166.20306 4.87973 2.09365 -165.72006 548.29957
5690.0000 -170.93544 -166.22412 4.71132 2.00502 -167.19652 490.50867
5695.0000 -170.37105 -166.12386 4.24719 2.04586 -166.51618 526.11769
5700.0000 -170.09262 -165.80358 4.28904 2.07571 -166.01888 519.53323
5705.0000 -168.82371 -163.73826 5.08545 2.16614 -164.51230 579.02461
5710.0000 -170.18084 -165.45367 4.72718 2.13691 -164.99931 572.24440
5715.0000 -170.74180 -166.07604 4.66576 2.09813 -165.64530 562.93992
5720.0000 -170.13778 -165.89528 4.24250 2.08108 -165.92943 540.59499
5725.0000 -170.35262 -164.95103 5.40158 2.11202 -165.41391 537.30611
5730.0000 -169.71358 -165.48875 4.22483 2.13536 -165.02516 528.72373
5735.0000 -170.03126 -165.79201 4.23925 2.10667 -165.50303 503.51137
5740.0000 -169.84965 -164.56672 5.28293 2.11798 -165.31472 522.06251
5745.0000 -170.45424 -165.87797 4.57628 2.16121 -164.59447 581.01376
5750.0000 -170.81191 -165.71085 5.10106 2.06325 -166.22638 527.06921
FREEZING PROCESS: loop number 24 T-loop= 541.00000000000000
main_MD> interactions number 24 at Temperature= 541.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.74996 1.02002 -0.74199
force_rgl> df(natom) -0.01206 1.88806 0.12752
5755.0000 -170.41862 -166.56911 3.84951 2.09917 -165.62799 528.38111
5760.0000 -172.15592 -166.49072 5.66520 2.04608 -166.51242 503.46265
5765.0000 -171.29251 -166.38245 4.91006 2.02013 -166.94479 517.70632
5770.0000 -171.58282 -167.06905 4.51377 2.01599 -167.01380 506.06272
5775.0000 -171.58647 -166.98655 4.59992 2.03216 -166.74440 513.16107
5780.0000 -170.73116 -166.18947 4.54169 2.04373 -166.55162 504.62128
5785.0000 -170.60857 -165.63842 4.97014 2.06321 -166.22716 499.72819
5790.0000 -170.67492 -166.00820 4.66671 2.06686 -166.16625 520.18200
5795.0000 -169.71058 -164.73627 4.97431 2.12733 -165.15884 572.62269
5800.0000 -170.73876 -164.87516 5.86359 2.14985 -164.78375 602.27951
5805.0000 -170.59590 -164.97460 5.62130 2.12665 -165.17026 552.54540
5810.0000 -171.44530 -166.68793 4.75736 2.06990 -166.11570 522.99949
5815.0000 -169.69707 -165.16179 4.53527 2.06268 -166.23589 528.84335
5820.0000 -171.44164 -166.90521 4.53643 2.06981 -166.11711 522.21774
5825.0000 -170.65477 -166.76795 3.88682 2.05529 -166.35906 525.02818
5830.0000 -170.62983 -166.08535 4.54448 2.07484 -166.03335 535.57202
5835.0000 -170.38323 -166.77153 3.61170 2.04237 -166.57437 509.30153
5840.0000 -170.25809 -165.34239 4.91570 2.06858 -166.13763 516.70874
5845.0000 -170.47446 -165.83762 4.63684 2.10141 -165.59064 533.45147
5850.0000 -171.05337 -164.87205 6.18133 2.09747 -165.65628 518.69889
5855.0000 -170.55930 -165.68192 4.87738 2.09606 -165.67983 531.29872
5860.0000 -169.74606 -164.94662 4.79944 2.12432 -165.20910 553.65503
5865.0000 -170.34344 -165.45681 4.88663 2.12970 -165.11936 552.64912
5870.0000 -170.77929 -165.80236 4.97693 2.08601 -165.84723 533.21236
5875.0000 -170.15395 -165.94953 4.20442 2.07894 -165.96508 519.59036
5880.0000 -169.91396 -166.12764 3.78631 2.06439 -166.20745 520.79601
5885.0000 -170.32506 -165.12398 5.20108 2.09501 -165.69738 533.29581
5890.0000 -170.76052 -165.72945 5.03107 2.11611 -165.34583 554.77627
5895.0000 -170.86723 -167.25994 3.60728 2.06295 -166.23150 514.90284
5900.0000 -170.87686 -166.66386 4.21299 1.99418 -167.37710 458.00436
5905.0000 -169.95164 -165.13962 4.81202 2.08656 -165.83809 536.08636
5910.0000 -169.72380 -165.10914 4.61466 2.10625 -165.51010 545.99975
5915.0000 -170.37041 -165.55636 4.81405 2.11464 -165.37022 553.83899
5920.0000 -170.45897 -165.28398 5.17499 2.11533 -165.35886 563.19794
5925.0000 -170.74023 -165.92869 4.81153 2.09062 -165.77039 529.53516
5930.0000 -170.56138 -165.11516 5.44622 2.14394 -164.88221 597.13290
5935.0000 -169.80056 -165.13824 4.66231 2.12305 -165.23016 579.81965
5940.0000 -170.43982 -166.48680 3.95301 2.08013 -165.94515 549.80049
5945.0000 -170.86956 -165.74142 5.12814 2.08647 -165.83954 544.02946
5950.0000 -170.18026 -164.94728 5.23298 2.11008 -165.44627 555.76935
5955.0000 -169.51772 -164.53244 4.98527 2.17557 -164.35518 569.55393
5960.0000 -168.80855 -164.42796 4.38059 2.16357 -164.55511 544.75686
5965.0000 -170.88521 -165.59572 5.28950 2.14893 -164.79899 540.89346
5970.0000 -170.91965 -166.30579 4.61385 2.08277 -165.90126 513.98543
5975.0000 -170.84457 -167.16979 3.67478 2.02261 -166.90353 479.68792
5980.0000 -170.35001 -165.55684 4.79317 2.09123 -165.76023 534.10172
5985.0000 -170.63316 -166.09695 4.53621 2.11480 -165.36769 550.05725
5990.0000 -170.94947 -165.97164 4.97784 2.08158 -165.92102 515.51814
5995.0000 -170.18105 -166.02014 4.16091 2.10027 -165.60962 533.06940
6000.0000 -170.98082 -166.46996 4.51087 2.06769 -166.15242 505.29727
FREEZING PROCESS: loop number 25 T-loop= 516.00000000000000
main_MD> interactions number 25 at Temperature= 516.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.31593 -1.41869 -0.09655
force_rgl> df(natom) 0.03806 0.52540 0.35447
6005.0000 -170.64825 -165.45118 5.19708 2.09767 -165.65308 527.25125
6010.0000 -169.17663 -164.42891 4.74773 2.13621 -165.01095 564.68957
6015.0000 -170.58329 -165.01166 5.57162 2.15854 -164.63886 575.59812
6020.0000 -170.23178 -165.64914 4.58264 2.12184 -165.25039 543.31816
6025.0000 -169.92752 -165.06772 4.85980 2.10272 -165.56890 521.54618
6030.0000 -170.62527 -165.39587 5.22939 2.10897 -165.46479 518.83134
6035.0000 -171.21197 -165.11984 6.09213 2.10866 -165.46997 548.60717
6040.0000 -170.22769 -164.76785 5.45983 2.13390 -165.04946 552.72216
6045.0000 -170.80634 -165.10843 5.69792 2.13214 -165.07866 555.90767
6050.0000 -170.38252 -165.81166 4.57086 2.12494 -165.19870 561.43788
6055.0000 -170.42623 -165.73589 4.69034 2.08790 -165.81573 527.36691
6060.0000 -170.09970 -165.43557 4.66413 2.10679 -165.50113 531.97141
6065.0000 -169.40238 -165.38224 4.02014 2.11760 -165.32101 558.92224
6070.0000 -171.37080 -166.92432 4.44649 2.04483 -166.53332 509.75094
6075.0000 -170.73324 -165.84378 4.88946 2.07063 -166.10343 537.45453
6080.0000 -170.64947 -166.22584 4.42363 2.03639 -166.67390 504.53250
6085.0000 -171.37673 -166.56159 4.81514 2.06001 -166.28045 514.77098
6090.0000 -170.62266 -166.61917 4.00349 2.03398 -166.71408 481.40720
6095.0000 -171.02196 -165.06137 5.96059 2.08910 -165.79580 539.91185
6100.0000 -170.27570 -165.43956 4.83614 2.11212 -165.41230 563.02925
6105.0000 -170.63652 -166.56933 4.06719 2.05638 -166.34083 532.26590
6110.0000 -170.73384 -166.57301 4.16083 2.04091 -166.59860 508.67893
6115.0000 -171.36241 -166.92286 4.43955 1.99853 -167.30473 489.21204
6120.0000 -171.78792 -167.62574 4.16218 2.01314 -167.06126 512.27045
6125.0000 -171.03773 -167.15534 3.88239 1.99554 -167.35456 491.40454
6130.0000 -171.10767 -167.23440 3.87326 2.01893 -166.96487 507.09766
6135.0000 -172.20928 -167.42224 4.78704 2.02713 -166.82824 512.55931
6140.0000 -172.22456 -168.17033 4.05422 1.96012 -167.94456 466.48318
6145.0000 -171.35651 -166.19921 5.15731 2.00672 -167.16821 486.81332
6150.0000 -170.86622 -166.69514 4.17108 2.04828 -166.47580 539.26370
6155.0000 -170.89081 -166.16949 4.72132 2.05234 -166.40825 532.94476
6160.0000 -171.25007 -166.96756 4.28251 2.03516 -166.69440 511.94253
6165.0000 -171.94097 -167.50013 4.44084 2.02961 -166.78681 509.22246
6170.0000 -170.98919 -166.73279 4.25640 1.98097 -167.59718 466.32111
6175.0000 -169.93448 -166.14371 3.79077 2.03333 -166.72483 513.59593
6180.0000 -171.16060 -166.22263 4.93797 2.04934 -166.45812 507.98485
6185.0000 -169.11567 -165.42381 3.69186 2.10017 -165.61128 528.11592
6190.0000 -169.98036 -165.87146 4.10889 2.06753 -166.15517 522.75561
6195.0000 -170.98133 -166.24616 4.73517 2.07559 -166.02089 537.93089
6200.0000 -171.65373 -166.65966 4.99407 2.06398 -166.21428 517.88554
6205.0000 -170.52174 -165.90649 4.61525 2.07724 -165.99332 525.01057
6210.0000 -170.97517 -167.72076 3.25442 2.04125 -166.59295 498.22306
6215.0000 -171.38574 -167.87773 3.50802 1.98889 -167.46532 474.69923
6220.0000 -171.43720 -166.95198 4.48523 2.01305 -167.06282 494.63400
6225.0000 -170.74604 -166.58219 4.16386 2.03493 -166.69829 518.45907
6230.0000 -171.32681 -167.00843 4.31839 2.02852 -166.80509 502.02116
6235.0000 -170.53721 -166.72129 3.81592 2.03556 -166.68769 528.30154
6240.0000 -170.24491 -165.85083 4.39407 2.05053 -166.43831 517.41412
6245.0000 -170.47935 -165.84089 4.63846 2.10693 -165.49880 564.77394
6250.0000 -170.59376 -165.87232 4.72144 2.09418 -165.71113 532.46583
FREEZING PROCESS: loop number 26 T-loop= 491.00000000000000
main_MD> interactions number 26 at Temperature= 491.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.20928 -0.71909 0.03933
force_rgl> df(natom) -0.55766 -1.34801 1.27849
6255.0000 -170.37258 -166.83431 3.53826 2.05843 -166.30673 496.94368
6260.0000 -170.71052 -167.07255 3.63798 2.04136 -166.59116 481.19712
6265.0000 -171.26749 -167.37121 3.89628 2.00602 -167.17988 465.20195
6270.0000 -171.54352 -166.77707 4.76645 2.00987 -167.11581 481.16275
6275.0000 -170.90160 -167.34923 3.55237 2.00420 -167.21028 479.73867
6280.0000 -171.08302 -166.90578 4.17724 2.03329 -166.72552 504.57528
6285.0000 -170.88009 -166.89099 3.98910 2.00944 -167.12288 462.92476
6290.0000 -170.74752 -165.92146 4.82606 2.06214 -166.24491 515.00367
6295.0000 -169.85611 -165.47913 4.37698 2.06798 -166.14757 498.89635
6300.0000 -169.62352 -165.65928 3.96424 2.10880 -165.46763 530.75136
6305.0000 -170.18868 -166.19467 3.99401 2.07934 -165.95832 490.71437
6310.0000 -170.99494 -166.66801 4.32693 2.05322 -166.39356 482.22212
6315.0000 -170.34700 -166.50453 3.84246 2.01230 -167.07524 440.83206
6320.0000 -170.43280 -166.76003 3.67277 2.05272 -166.40192 476.66243
6325.0000 -171.29319 -166.92332 4.36987 2.03719 -166.66057 475.91947
6330.0000 -170.85157 -166.45012 4.40145 2.01998 -166.94737 493.16011
6335.0000 -171.00537 -166.93491 4.07046 2.04827 -166.47608 509.54397
6340.0000 -171.07176 -167.02742 4.04434 2.03489 -166.69897 494.68704
6345.0000 -171.55559 -167.28403 4.27157 1.99941 -167.29000 471.63011
6350.0000 -172.03388 -167.68997 4.34391 1.99080 -167.43350 478.04701
6355.0000 -171.94823 -167.70201 4.24622 1.97804 -167.64609 470.10132
6360.0000 -171.59997 -167.62980 3.97017 1.97107 -167.76221 474.15453
6365.0000 -172.02277 -167.94635 4.07643 1.96330 -167.89165 443.12823
6370.0000 -170.86790 -166.58775 4.28015 2.01810 -166.97870 490.15278
6375.0000 -170.35540 -166.26799 4.08741 2.05008 -166.44577 498.76685
6380.0000 -170.00459 -165.47277 4.53182 2.06425 -166.20975 493.46558
6385.0000 -170.35289 -166.52447 3.82841 2.08292 -165.89879 516.07155
6390.0000 -170.48589 -166.36428 4.12161 2.01854 -166.97132 460.45392
6395.0000 -170.51802 -165.61749 4.90053 2.05956 -166.28790 477.32059
6400.0000 -171.77832 -167.64922 4.12910 2.03272 -166.73511 495.84116
6405.0000 -171.97651 -167.47332 4.50320 1.97572 -167.68470 466.18095
6410.0000 -171.49014 -167.24225 4.24789 1.99973 -167.28473 470.56994
6415.0000 -171.13372 -166.70901 4.42471 2.02024 -166.94296 490.41144
6420.0000 -170.55181 -165.93663 4.61518 2.04281 -166.56704 509.42754
6425.0000 -170.80067 -166.16884 4.63182 2.07130 -166.09240 527.01142
6430.0000 -171.22510 -167.48029 3.74480 2.02668 -166.83574 474.55567
6435.0000 -171.55852 -167.35794 4.20058 1.99860 -167.30354 480.68659
6440.0000 -171.98428 -167.92431 4.05997 1.98979 -167.45033 472.06501
6445.0000 -171.38284 -167.42263 3.96020 1.97399 -167.71358 473.20967
6450.0000 -172.48117 -167.87904 4.60213 1.97770 -167.65175 489.80134
6455.0000 -172.21224 -168.21971 3.99253 1.95325 -168.05911 483.32622
6460.0000 -171.85090 -167.68115 4.16974 1.95711 -167.99475 479.78826
6465.0000 -171.98713 -167.29770 4.68943 1.98047 -167.60547 502.45998
6470.0000 -171.70680 -167.47356 4.23324 1.99970 -167.28526 496.31825
6475.0000 -171.46557 -167.12634 4.33923 2.01094 -167.09792 500.80288
6480.0000 -171.35755 -167.32700 4.03056 2.02623 -166.84317 513.48222
6485.0000 -171.65998 -167.29132 4.36866 1.98281 -167.56655 496.61602
6490.0000 -172.15601 -167.80055 4.35546 1.97714 -167.66099 497.55186
6495.0000 -172.39944 -168.90474 3.49469 1.92529 -168.52484 453.64824
6500.0000 -172.47060 -167.82286 4.64774 1.91850 -168.63799 446.29707
FREEZING PROCESS: loop number 27 T-loop= 466.00000000000000
main_MD> interactions number 27 at Temperature= 466.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.43175 -3.02693 1.57930
force_rgl> df(natom) -2.78718 -0.02378 1.91125
6505.0000 -172.72396 -168.09705 4.62691 1.97104 -167.76265 479.25100
6510.0000 -171.04485 -167.03205 4.01280 1.99301 -167.39666 498.01294
6515.0000 -172.12468 -168.20099 3.92369 1.96778 -167.81700 463.12698
6520.0000 -171.99611 -167.35284 4.64327 2.00832 -167.14152 478.94177
6525.0000 -171.37327 -167.12236 4.25091 1.99608 -167.34552 464.63571
6530.0000 -172.10089 -168.37329 3.72760 1.97405 -167.71256 460.02491
6535.0000 -171.97832 -168.48376 3.49457 1.93595 -168.34722 439.60266
6540.0000 -172.97611 -169.08959 3.88652 1.90353 -168.88734 407.57028
6545.0000 -171.47898 -167.74378 3.73520 1.94714 -168.16086 454.11899
6550.0000 -170.58957 -166.43852 4.15105 2.01720 -166.99368 487.11958
6555.0000 -172.18122 -167.37568 4.80554 1.99278 -167.40039 484.77887
6560.0000 -170.37083 -166.79534 3.57549 2.01087 -167.09907 485.39941
6565.0000 -172.21118 -167.97766 4.23352 1.99177 -167.41726 489.71521
6570.0000 -171.71284 -167.94535 3.76749 1.93191 -168.41456 452.62017
6575.0000 -172.48206 -168.09228 4.38978 1.95256 -168.07060 465.64152
6580.0000 -172.01111 -168.05804 3.95307 1.93211 -168.41120 446.44604
6585.0000 -172.27897 -168.16972 4.10925 1.95311 -168.06140 453.21860
6590.0000 -172.53521 -168.11133 4.42388 1.95467 -168.03543 450.71931
6595.0000 -172.43365 -168.39853 4.03512 1.94814 -168.14420 444.36582
6600.0000 -171.85493 -167.06244 4.79249 1.97087 -167.76555 455.76146
6605.0000 -171.43841 -167.23767 4.20074 2.04587 -166.51598 513.05855
6610.0000 -171.99095 -168.37732 3.61362 1.97292 -167.73131 452.92619
6615.0000 -171.76228 -167.56904 4.19324 1.94586 -168.18213 428.19620
6620.0000 -170.60815 -167.02364 3.58451 1.98182 -167.58311 463.59119
6625.0000 -172.10649 -166.65764 5.44886 2.01221 -167.07672 477.94971
6630.0000 -171.71741 -168.29458 3.42282 2.00016 -167.27760 472.23739
6635.0000 -171.95302 -168.35767 3.59535 1.94842 -168.13945 437.27743
6640.0000 -171.80229 -168.25899 3.54330 1.95804 -167.97930 453.76611
6645.0000 -171.70289 -167.67708 4.02581 1.95648 -168.00514 433.92422
6650.0000 -172.29778 -167.41163 4.88614 1.98476 -167.53402 469.28419
6655.0000 -171.74134 -167.11702 4.62433 1.99241 -167.40657 489.07788
6660.0000 -171.76971 -167.46633 4.30337 1.99290 -167.39843 475.60967
6665.0000 -171.29587 -167.28118 4.01469 1.99670 -167.33516 492.37882
6670.0000 -171.97039 -167.90464 4.06575 1.98884 -167.46610 482.22824
6675.0000 -171.66185 -167.62922 4.03263 1.96596 -167.84733 450.79603
6680.0000 -172.05416 -167.71438 4.33978 1.98934 -167.45773 481.21544
6685.0000 -171.51774 -167.45333 4.06441 1.98258 -167.57047 467.92788
6690.0000 -172.59201 -168.26777 4.32424 1.95089 -168.09827 450.69741
6695.0000 -172.38627 -167.76810 4.61817 1.93810 -168.31135 451.92405
6700.0000 -172.33032 -168.44587 3.88445 1.97195 -167.74742 488.44629
6705.0000 -172.66117 -168.18777 4.47340 1.91816 -168.64357 440.90364
6710.0000 -173.01721 -168.98333 4.03387 1.90036 -168.94019 420.98236
6715.0000 -172.55463 -168.62244 3.93219 1.91692 -168.66422 433.46946
6720.0000 -172.91149 -169.63827 3.27322 1.91549 -168.68816 435.37602
6725.0000 -171.99153 -168.49742 3.49411 1.89079 -169.09959 411.04131
6730.0000 -171.92134 -168.57496 3.34638 1.91183 -168.74904 419.43830
6735.0000 -172.33821 -168.48778 3.85043 1.92481 -168.53288 436.68616
6740.0000 -171.96083 -168.40615 3.55468 1.91649 -168.67148 425.46064
6745.0000 -172.78014 -169.08760 3.69254 1.89952 -168.95421 412.26658
6750.0000 -171.89073 -167.77263 4.11810 1.91817 -168.64348 430.92041
FREEZING PROCESS: loop number 28 T-loop= 441.00000000000000
main_MD> interactions number 28 at Temperature= 441.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.47242 -0.56979 1.21935
force_rgl> df(natom) -2.90158 -0.19660 0.12566
6755.0000 -172.64199 -168.60952 4.03247 1.94278 -168.23343 441.73749
6760.0000 -171.79554 -167.81544 3.98010 1.95566 -168.01885 451.64193
6765.0000 -171.95870 -167.48732 4.47138 1.97957 -167.62048 479.65661
6770.0000 -172.64071 -168.41241 4.22830 1.96576 -167.85064 472.76761
6775.0000 -172.84715 -169.01656 3.83059 1.92914 -168.46073 446.29358
6780.0000 -172.14349 -168.24668 3.89681 1.93513 -168.36089 437.21970
6785.0000 -172.06029 -168.39079 3.66950 1.93652 -168.33776 444.33297
6790.0000 -172.33601 -168.46705 3.86896 1.92835 -168.47385 432.22120
6795.0000 -173.17045 -169.89224 3.27821 1.90072 -168.93425 415.18087
6800.0000 -172.39726 -168.75996 3.63730 1.90917 -168.79341 423.79234
6805.0000 -172.46115 -168.55430 3.90685 1.91182 -168.74921 435.44008
6810.0000 -172.81703 -169.03009 3.78694 1.91839 -168.63972 427.92977
6815.0000 -172.60358 -169.05094 3.55264 1.88687 -169.16499 413.14866
6820.0000 -173.08430 -169.28601 3.79829 1.86603 -169.51216 391.83422
6825.0000 -173.10488 -169.41645 3.68843 1.88247 -169.23819 403.27430
6830.0000 -172.61869 -168.92489 3.69380 1.88349 -169.22119 408.10190
6835.0000 -172.60913 -168.42991 4.17922 1.89077 -169.09987 412.81777
6840.0000 -172.19816 -168.34962 3.84854 1.93733 -168.32425 449.34192
6845.0000 -172.54145 -168.95806 3.58339 1.90033 -168.94061 424.69185
6850.0000 -172.11991 -168.77204 3.34786 1.88759 -169.15291 415.11791
6855.0000 -172.08441 -167.82182 4.26259 1.89861 -168.96938 417.73342
6860.0000 -171.92781 -167.83831 4.08950 1.95170 -168.08478 455.58112
6865.0000 -171.88267 -167.79959 4.08308 1.96924 -167.79270 470.94779
6870.0000 -171.81369 -167.67529 4.13840 1.97675 -167.66754 465.42325
6875.0000 -172.20158 -167.97757 4.22402 1.95791 -167.98135 436.00855
6880.0000 -172.60078 -168.91225 3.68853 1.93393 -168.38083 430.04268
6885.0000 -172.40260 -168.82955 3.57306 1.91341 -168.72271 415.71788
6890.0000 -172.86041 -170.25478 2.60563 1.87164 -169.41870 386.93026
6895.0000 -172.95864 -169.89787 3.06077 1.83890 -169.96417 360.04119
6900.0000 -173.20578 -169.48053 3.72524 1.87142 -169.42232 389.18367
6905.0000 -172.21208 -168.67529 3.53679 1.88300 -169.22945 395.07119
6910.0000 -172.33465 -168.56591 3.76874 1.90930 -168.79121 411.28188
6915.0000 -171.94360 -168.62313 3.32047 1.92060 -168.60294 412.21968
6920.0000 -172.28666 -167.68473 4.60193 1.94184 -168.24911 426.23682
6925.0000 -172.02854 -167.63287 4.39567 2.00113 -167.26140 485.77789
6930.0000 -171.91293 -167.90574 4.00718 1.97256 -167.73736 438.47186
6935.0000 -171.96002 -168.23190 3.72813 1.96999 -167.78015 427.25243
6940.0000 -171.00825 -167.29411 3.71414 1.98806 -167.47908 453.07811
6945.0000 -172.17788 -168.76348 3.41440 1.97232 -167.74129 443.72170
6950.0000 -172.34695 -168.61971 3.72723 1.91970 -168.61796 409.03400
6955.0000 -172.27388 -168.61643 3.65745 1.94340 -168.22315 431.86902
6960.0000 -171.89351 -168.07096 3.82255 1.95048 -168.10518 434.51926
6965.0000 -173.00939 -169.34403 3.66536 1.90758 -168.81982 406.41700
6970.0000 -172.28338 -168.56959 3.71380 1.88304 -169.22876 384.28950
6975.0000 -171.92209 -168.18672 3.73537 1.91991 -168.61450 414.90318
6980.0000 -172.31814 -168.62711 3.69103 1.93244 -168.40571 439.08603
6985.0000 -172.28809 -168.28758 4.00051 1.93036 -168.44031 427.47799
6990.0000 -173.29344 -169.04390 4.24954 1.89141 -169.08928 399.86517
6995.0000 -172.65915 -168.84056 3.81859 1.90271 -168.90105 433.72877
7000.0000 -172.51085 -168.36254 4.14831 1.90381 -168.88265 429.97463
FREEZING PROCESS: loop number 29 T-loop= 416.00000000000000
main_MD> interactions number 29 at Temperature= 416.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.06823 0.54623 -1.02425
force_rgl> df(natom) -5.18169 2.58526 1.25854
7005.0000 -172.72799 -169.17199 3.55600 1.94159 -168.25334 460.22579
7010.0000 -172.93382 -169.00656 3.92726 1.87886 -169.29842 405.87435
7015.0000 -173.63422 -170.23208 3.40214 1.85690 -169.66422 391.93809
7020.0000 -172.24775 -169.22820 3.01955 1.84612 -169.84389 385.79559
7025.0000 -173.14021 -169.44711 3.69310 1.85729 -169.65769 386.78647
7030.0000 -173.01145 -169.73927 3.27218 1.86091 -169.59742 398.05889
7035.0000 -172.49177 -168.39741 4.09436 1.88424 -169.20880 414.10700
7040.0000 -173.03281 -168.64311 4.38970 1.91805 -168.64548 427.06061
7045.0000 -173.07105 -169.21042 3.86064 1.90757 -168.82000 414.57862
7050.0000 -173.52654 -169.74276 3.78378 1.86187 -169.58143 414.65801
7055.0000 -173.25494 -169.39459 3.86035 1.85930 -169.62429 415.11333
7060.0000 -173.21807 -169.52689 3.69118 1.88901 -169.12919 435.63609
7065.0000 -173.95332 -170.62965 3.32366 1.83596 -170.01308 392.89156
7070.0000 -173.68909 -170.33269 3.35639 1.81403 -170.37842 375.94687
7075.0000 -173.72638 -169.74427 3.98211 1.83395 -170.04664 388.85876
7080.0000 -173.66658 -169.81102 3.85556 1.83590 -170.01407 386.24295
7085.0000 -173.47189 -170.01573 3.45616 1.85854 -169.63691 411.30833
7090.0000 -173.26102 -169.45669 3.80433 1.84633 -169.84027 400.08111
7095.0000 -173.38677 -170.28225 3.10452 1.83264 -170.06832 388.17403
7100.0000 -172.99669 -169.25920 3.73749 1.85770 -169.65085 411.17886
7105.0000 -173.29804 -168.94227 4.35577 1.87108 -169.42798 421.52723
7110.0000 -172.56391 -168.76031 3.80360 1.89657 -169.00325 447.93651
7115.0000 -172.25026 -167.93496 4.31530 1.93529 -168.35822 464.84674
7120.0000 -172.40842 -168.40479 4.00363 1.96461 -167.86971 490.19042
7125.0000 -173.03608 -168.85671 4.17937 1.91637 -168.67352 459.58805
7130.0000 -172.99820 -169.87788 3.12032 1.87041 -169.43917 417.36220
7135.0000 -173.51435 -169.56008 3.95427 1.84104 -169.92844 391.82493
7140.0000 -173.22689 -169.50164 3.72524 1.87537 -169.35657 426.36361
7145.0000 -173.15770 -169.54692 3.61078 1.86025 -169.60845 411.11655
7150.0000 -173.54658 -169.91422 3.63236 1.84660 -169.83584 397.95000
7155.0000 -173.91040 -170.46583 3.44458 1.86695 -169.49670 406.37534
7160.0000 -172.78562 -169.10270 3.68293 1.84281 -169.89897 394.93633
7165.0000 -172.88614 -169.50032 3.38583 1.89267 -169.06821 434.43279
7170.0000 -173.09606 -170.37106 2.72500 1.85130 -169.75755 409.50569
7175.0000 -173.47621 -169.91561 3.56060 1.85452 -169.70387 410.41263
7180.0000 -173.46100 -169.88158 3.57942 1.83910 -169.96072 394.57229
7185.0000 -173.24159 -170.01810 3.22349 1.85319 -169.72601 410.17135
7190.0000 -173.27086 -169.91965 3.35121 1.84965 -169.78494 402.00640
7195.0000 -173.10207 -169.26501 3.83706 1.87594 -169.34699 416.80628
7200.0000 -172.64108 -168.54155 4.09953 1.90530 -168.85787 432.88542
7205.0000 -173.54892 -170.00075 3.54816 1.87737 -169.32320 424.48293
7210.0000 -173.07842 -169.86681 3.21161 1.84614 -169.84346 395.80344
7215.0000 -173.83634 -170.17286 3.66348 1.85201 -169.74574 409.23712
7220.0000 -173.03470 -169.56270 3.47200 1.84043 -169.93860 396.59099
7225.0000 -172.91573 -169.43763 3.47810 1.87027 -169.44155 412.79541
7230.0000 -173.26350 -169.52259 3.74092 1.87172 -169.41739 419.16011
7235.0000 -173.65572 -169.84840 3.80732 1.87619 -169.34287 424.25012
7240.0000 -173.62085 -170.28969 3.33116 1.84450 -169.87083 397.51589
7245.0000 -173.20779 -169.56148 3.64630 1.82314 -170.22665 377.86637
7250.0000 -173.74428 -170.17836 3.56592 1.86071 -169.60071 413.82913
FREEZING PROCESS: loop number 30 T-loop= 391.00000000000000
main_MD> interactions number 30 at Temperature= 391.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.01922 1.40568 0.85732
force_rgl> df(natom) 0.50858 0.07718 4.38176
7255.0000 -174.28829 -170.86209 3.42620 1.81084 -170.43158 365.90739
7260.0000 -173.73752 -170.11468 3.62283 1.79934 -170.62309 358.69906
7265.0000 -173.79505 -169.90602 3.88903 1.83543 -170.02193 393.84353
7270.0000 -173.55680 -170.24461 3.31219 1.82638 -170.17261 379.95527
7275.0000 -173.61489 -170.36526 3.24963 1.79488 -170.69748 353.11276
7280.0000 -173.43562 -170.09438 3.34124 1.80855 -170.46976 366.66028
7285.0000 -173.72227 -169.43217 4.29010 1.83198 -170.07937 388.02945
7290.0000 -173.59583 -170.15079 3.44504 1.84799 -169.81264 401.40318
7295.0000 -173.26747 -169.58200 3.68548 1.84568 -169.85117 397.49840
7300.0000 -173.93095 -169.99756 3.93339 1.85528 -169.69115 405.02352
7305.0000 -173.18448 -169.22458 3.95990 1.83475 -170.03320 394.66112
7310.0000 -173.11850 -169.65860 3.45990 1.86607 -169.51138 413.05471
7315.0000 -173.25053 -170.24570 3.00483 1.82239 -170.23920 373.79985
7320.0000 -173.11250 -169.62046 3.49203 1.83871 -169.96720 392.20759
7325.0000 -172.83863 -169.39424 3.44439 1.87200 -169.41264 417.56215
7330.0000 -173.09978 -169.96486 3.13491 1.84713 -169.82704 404.77099
7335.0000 -173.60585 -170.46523 3.14061 1.83285 -170.06490 386.32124
7340.0000 -173.55508 -170.00982 3.54525 1.81429 -170.37411 371.24017
7345.0000 -173.78452 -170.27396 3.51056 1.82726 -170.15799 385.63338
7350.0000 -173.84895 -170.50557 3.34338 1.84857 -169.80294 400.82788
7355.0000 -173.98060 -170.79468 3.18592 1.80709 -170.49406 364.31452
7360.0000 -173.77409 -170.66865 3.10545 1.78131 -170.92346 343.70617
7365.0000 -173.31383 -169.72090 3.59293 1.80436 -170.53945 363.02251
7370.0000 -173.62580 -170.37467 3.25113 1.82666 -170.16802 380.22014
7375.0000 -172.94981 -169.65563 3.29418 1.82301 -170.22890 378.50057
7380.0000 -173.54023 -170.75969 2.78054 1.81813 -170.31006 374.38472
7385.0000 -173.58796 -170.68219 2.90577 1.81275 -170.39980 372.53022
7390.0000 -173.35516 -170.29367 3.06150 1.79977 -170.61592 359.42245
7395.0000 -173.40703 -169.75969 3.64734 1.83050 -170.10399 386.46297
7400.0000 -173.61820 -170.15817 3.46003 1.84125 -169.92502 393.19013
7405.0000 -173.80860 -169.69233 4.11626 1.85432 -169.70721 405.15394
7410.0000 -173.55524 -169.98054 3.57469 1.87391 -169.38088 419.55852
7415.0000 -173.32808 -170.29924 3.02884 1.83164 -170.08500 381.14150
7420.0000 -173.38595 -169.11521 4.27074 1.86075 -169.60000 414.13409
7425.0000 -173.29864 -169.90004 3.39860 1.87562 -169.35234 425.60354
7430.0000 -172.77236 -169.19250 3.57986 1.86773 -169.48373 418.80332
7435.0000 -173.50248 -169.77687 3.72561 1.86134 -169.59033 412.66211
7440.0000 -172.92920 -169.35235 3.57685 1.84840 -169.80584 403.70450
7445.0000 -173.70772 -169.56097 4.14675 1.85793 -169.64706 409.16266
7450.0000 -172.91711 -169.28733 3.62978 1.86891 -169.46406 410.45792
7455.0000 -173.02929 -169.31935 3.70994 1.87613 -169.34393 422.20104
7460.0000 -173.66271 -169.85009 3.81262 1.86886 -169.46503 418.28543
7465.0000 -173.56353 -170.47839 3.08514 1.82143 -170.25517 379.70956
7470.0000 -173.80858 -170.14147 3.66710 1.83608 -170.01104 389.59772
7475.0000 -173.55022 -170.51386 3.03636 1.81344 -170.38821 373.93805
7480.0000 -173.22305 -169.74456 3.47850 1.84386 -169.88139 402.93178
7485.0000 -172.88919 -169.83442 3.05477 1.85243 -169.73869 397.46106
7490.0000 -173.71506 -169.62794 4.08713 1.84609 -169.84433 402.96414
7495.0000 -173.34047 -169.69413 3.64633 1.86105 -169.59503 408.87498
7500.0000 -173.01243 -169.80561 3.20682 1.87601 -169.34587 422.73840
FREEZING PROCESS: loop number 31 T-loop= 366.00000000000000
main_MD> interactions number 31 at Temperature= 366.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.00069 -0.19876 -0.49924
force_rgl> df(natom) -1.00854 -0.23096 -3.41706
7505.0000 -173.42559 -170.49493 2.93066 1.83180 -170.08240 380.16111
7510.0000 -173.44535 -170.03021 3.41514 1.82234 -170.24006 377.57217
7515.0000 -173.86987 -170.24763 3.62224 1.82642 -170.17205 387.38545
7520.0000 -174.22898 -170.40219 3.82678 1.80376 -170.54959 363.81114
7525.0000 -173.79456 -170.34670 3.44786 1.82710 -170.16076 375.33607
7530.0000 -173.22328 -169.84744 3.37585 1.85398 -169.71292 386.11851
7535.0000 -173.74170 -170.27794 3.46376 1.82263 -170.23514 364.81040
7540.0000 -173.67407 -170.81178 2.86229 1.82184 -170.24828 361.90982
7545.0000 -173.69877 -170.40751 3.29126 1.80253 -170.57006 341.07773
7550.0000 -173.09248 -169.60120 3.49128 1.84045 -169.93825 372.91029
7555.0000 -172.74011 -169.36934 3.37077 1.84846 -169.80475 381.36606
7560.0000 -173.04999 -169.99040 3.05959 1.81958 -170.28591 363.92594
7565.0000 -173.13697 -169.65450 3.48247 1.83965 -169.95157 381.26730
7570.0000 -173.81586 -170.41990 3.39596 1.83666 -170.00139 378.37955
7575.0000 -173.40128 -170.03107 3.37021 1.83292 -170.06373 379.62701
7580.0000 -173.23489 -169.94667 3.28822 1.83909 -169.96099 363.85462
7585.0000 -173.52140 -170.35459 3.16680 1.82803 -170.14515 351.66692
7590.0000 -173.15606 -170.25169 2.90437 1.81319 -170.39243 338.33027
7595.0000 -172.75424 -169.81887 2.93537 1.83775 -169.98320 352.42625
7600.0000 -173.93182 -170.81976 3.11206 1.81999 -170.27918 366.30657
7605.0000 -173.92436 -170.70875 3.21561 1.79596 -170.67948 362.05776
7610.0000 -174.39728 -171.48929 2.90798 1.77559 -171.01879 342.18415
7615.0000 -173.66530 -170.66257 3.00273 1.77073 -171.09976 343.82267
7620.0000 -173.82211 -170.54142 3.28069 1.81182 -170.41527 372.87025
7625.0000 -174.14368 -170.79655 3.34713 1.78904 -170.79481 359.85280
7630.0000 -173.51010 -170.89476 2.61535 1.77955 -170.95281 346.59769
7635.0000 -173.79130 -170.85835 2.93294 1.78208 -170.91066 350.16322
7640.0000 -173.89947 -170.94357 2.95590 1.77145 -171.08775 343.68410
7645.0000 -174.13258 -171.13038 3.00220 1.77058 -171.10233 339.61223
7650.0000 -173.92953 -171.01531 2.91423 1.75928 -171.29054 331.21388
7655.0000 -173.38766 -169.81324 3.57442 1.81875 -170.29983 378.03647
7660.0000 -173.81677 -170.58141 3.23536 1.81283 -170.39842 373.08718
7665.0000 -173.34547 -170.55603 2.78945 1.78993 -170.77991 356.01521
7670.0000 -174.12456 -170.78611 3.33845 1.80220 -170.57545 365.26814
7675.0000 -173.70879 -170.97882 2.72998 1.78181 -170.91520 348.09958
7680.0000 -174.40067 -171.00571 3.39495 1.77150 -171.08697 339.12220
7685.0000 -174.15293 -170.42528 3.72764 1.78786 -170.81449 358.51664
7690.0000 -173.62995 -170.29547 3.33448 1.80345 -170.55465 367.08775
7695.0000 -174.32262 -171.27653 3.04609 1.79867 -170.63429 363.92867
7700.0000 -173.71465 -170.64095 3.07370 1.76238 -171.23889 335.02163
7705.0000 -174.19309 -170.51283 3.68026 1.80276 -170.56612 368.89533
7710.0000 -174.13217 -170.62210 3.51007 1.79309 -170.72732 361.06906
7715.0000 -174.03066 -171.04756 2.98310 1.78053 -170.93649 348.61273
7720.0000 -173.20007 -170.39759 2.80248 1.80415 -170.54301 365.64415
7725.0000 -174.17876 -170.95961 3.21915 1.78846 -170.80440 361.20398
7730.0000 -173.74160 -171.13220 2.60940 1.76758 -171.15234 335.44832
7735.0000 -173.72599 -170.89395 2.83204 1.78771 -170.81688 353.39936
7740.0000 -173.03731 -169.97507 3.06224 1.81653 -170.33672 379.56288
7745.0000 -173.01989 -169.42305 3.59684 1.83018 -170.10930 391.55923
7750.0000 -173.53776 -169.95969 3.57807 1.84332 -169.89045 398.62151
FREEZING PROCESS: loop number 32 T-loop= 341.00000000000000
main_MD> interactions number 32 at Temperature= 341.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.02525 -0.48029 0.10392
force_rgl> df(natom) 1.31309 -1.42757 0.62258
7755.0000 -173.76921 -170.66228 3.10693 1.81239 -170.40570 376.27048
7760.0000 -174.51232 -171.61102 2.90131 1.77687 -170.99759 343.93511
7765.0000 -174.32602 -171.94472 2.38130 1.73178 -171.74863 306.15033
7770.0000 -174.03737 -171.21774 2.81963 1.76326 -171.22425 331.20020
7775.0000 -174.05668 -170.93543 3.12125 1.78356 -170.88613 350.21034
7780.0000 -173.92223 -171.52365 2.39858 1.76192 -171.24665 335.91013
7785.0000 -174.04428 -171.17780 2.86648 1.75236 -171.40583 321.93803
7790.0000 -174.21174 -171.17653 3.03522 1.77630 -171.00697 341.77072
7795.0000 -174.66874 -171.57933 3.08941 1.76885 -171.13115 338.64144
7800.0000 -174.08832 -171.31718 2.77115 1.74430 -171.54020 316.41718
7805.0000 -174.25002 -171.52508 2.72493 1.74152 -171.58640 312.35472
7810.0000 -174.44839 -170.94560 3.50279 1.78317 -170.89250 352.21022
7815.0000 -173.97822 -170.89511 3.08311 1.77954 -170.95308 348.85410
7820.0000 -174.14170 -171.31668 2.82502 1.75619 -171.34204 327.50022
7825.0000 -174.54928 -171.55665 2.99263 1.74942 -171.45481 321.25396
7830.0000 -174.26306 -171.68215 2.58090 1.74805 -171.47773 318.68048
7835.0000 -173.94559 -171.29179 2.65380 1.74515 -171.52600 318.96896
7840.0000 -174.60784 -170.92864 3.67920 1.77309 -171.06056 342.14036
7845.0000 -173.85790 -171.02549 2.83241 1.78338 -170.88900 351.33130
7850.0000 -174.20918 -171.33014 2.87904 1.75087 -171.43070 322.30986
7855.0000 -173.76812 -170.93646 2.83165 1.75833 -171.30641 326.14299
7860.0000 -174.29512 -170.87976 3.41536 1.78795 -170.81284 352.41809
7865.0000 -174.03290 -171.02693 3.00598 1.78463 -170.86815 352.15550
7870.0000 -173.34989 -170.25198 3.09790 1.80679 -170.49910 367.95353
7875.0000 -173.87605 -171.08566 2.79039 1.79059 -170.76891 356.35046
7880.0000 -174.34584 -171.20443 3.14141 1.77711 -170.99344 344.17536
7885.0000 -173.63733 -170.65737 2.97997 1.77786 -170.98099 345.76903
7890.0000 -174.36065 -171.39830 2.96235 1.77175 -171.08276 339.41804
7895.0000 -174.08978 -171.01396 3.07582 1.78257 -170.90260 348.29468
7900.0000 -174.55474 -172.30073 2.25401 1.73904 -171.62768 310.46073
7905.0000 -174.21974 -171.58236 2.63738 1.72137 -171.92214 296.83444
7910.0000 -174.33856 -171.71051 2.62805 1.72708 -171.82693 299.16277
7915.0000 -174.22284 -171.16050 3.06234 1.76692 -171.16334 335.47426
7920.0000 -173.92820 -171.13191 2.79629 1.75737 -171.32244 325.39932
7925.0000 -174.51112 -171.94274 2.56837 1.74152 -171.58647 312.60666
7930.0000 -174.46117 -171.70288 2.75828 1.72837 -171.80555 300.56251
7935.0000 -174.11920 -171.29140 2.82779 1.74033 -171.60620 311.88132
7940.0000 -174.07243 -171.09419 2.97824 1.77141 -171.08848 339.60798
7945.0000 -173.98923 -170.83889 3.15034 1.75784 -171.31450 325.59668
7950.0000 -173.50483 -170.55031 2.95452 1.79343 -170.72168 359.79961
7955.0000 -174.56182 -171.85815 2.70367 1.77095 -171.09621 341.50444
7960.0000 -174.08425 -170.71626 3.36799 1.77848 -170.97076 344.06506
7965.0000 -174.17883 -171.03392 3.14491 1.77907 -170.96078 347.92283
7970.0000 -173.84544 -170.64679 3.19865 1.80703 -170.49502 371.70494
7975.0000 -174.58565 -171.69369 2.89196 1.77763 -170.98480 343.15882
7980.0000 -174.33864 -171.43873 2.89992 1.75577 -171.34899 323.62624
7985.0000 -174.28937 -170.99861 3.29076 1.75922 -171.29161 328.69729
7990.0000 -173.71833 -171.04215 2.67618 1.78435 -170.87296 351.37002
7995.0000 -174.47846 -171.32926 3.14920 1.77298 -171.06227 343.76832
8000.0000 -174.47269 -171.62430 2.84839 1.76072 -171.26652 331.03157
FREEZING PROCESS: loop number 33 T-loop= 316.00000000000000
main_MD> interactions number 33 at Temperature= 316.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.38139 -0.06070 0.27324
force_rgl> df(natom) -0.11421 -0.05192 -1.24799
8005.0000 -174.42161 -171.87168 2.54993 1.73654 -171.66934 308.38510
8010.0000 -174.70670 -172.08385 2.62286 1.70847 -172.13708 282.99902
8015.0000 -174.53302 -171.64672 2.88630 1.72566 -171.85066 301.36014
8020.0000 -173.88218 -171.34864 2.53355 1.75802 -171.31163 328.64652
8025.0000 -174.24597 -171.57473 2.67124 1.75250 -171.40354 323.81728
8030.0000 -173.95378 -171.03624 2.91754 1.74135 -171.58934 312.07365
8035.0000 -174.14633 -171.33036 2.81598 1.74641 -171.50489 318.89672
8040.0000 -174.23411 -171.64984 2.58428 1.73666 -171.66748 309.66824
8045.0000 -174.62493 -172.01640 2.60853 1.72805 -171.81090 300.99074
8050.0000 -174.62031 -172.02949 2.59082 1.71774 -171.98262 289.09074
8055.0000 -174.54934 -172.24746 2.30187 1.71889 -171.96339 294.20597
8060.0000 -174.30668 -171.28323 3.02345 1.73352 -171.71969 307.88389
8065.0000 -174.42270 -171.74314 2.67956 1.74056 -171.60239 311.94237
8070.0000 -174.37708 -171.85174 2.52533 1.73051 -171.76986 303.19487
8075.0000 -174.35465 -172.06102 2.29363 1.71973 -171.94938 295.13016
8080.0000 -174.62784 -171.77840 2.84944 1.72146 -171.92069 297.25703
8085.0000 -174.65732 -171.68563 2.97169 1.73085 -171.76425 302.40677
8090.0000 -174.22195 -171.68223 2.53972 1.73889 -171.63018 309.75600
8095.0000 -174.10515 -171.52183 2.58332 1.73621 -171.67482 306.43148
8100.0000 -174.36634 -171.72210 2.64424 1.72260 -171.90169 297.41221
8105.0000 -174.13098 -171.54907 2.58190 1.73703 -171.66121 307.78517
8110.0000 -174.33290 -171.92928 2.40362 1.73548 -171.68714 309.68723
8115.0000 -174.43827 -171.51899 2.91929 1.72782 -171.81461 299.84060
8120.0000 -174.56290 -171.82190 2.74099 1.74037 -171.60557 312.84153
8125.0000 -174.68001 -171.68929 2.99071 1.73995 -171.61256 310.65505
8130.0000 -174.00077 -170.87137 3.12941 1.74151 -171.58655 314.24677
8135.0000 -174.04298 -170.94208 3.10090 1.79394 -170.71313 365.13754
8140.0000 -174.25517 -171.10674 3.14842 1.76570 -171.18354 336.33065
8145.0000 -173.85850 -170.70609 3.15241 1.78436 -170.87277 349.85948
8150.0000 -174.13855 -171.43890 2.69965 1.76205 -171.24448 326.38338
8155.0000 -174.34936 -171.29836 3.05100 1.74787 -171.48063 314.30967
8160.0000 -173.95831 -171.50201 2.45630 1.75037 -171.43896 317.56579
8165.0000 -174.34992 -172.10832 2.24161 1.72599 -171.84514 298.93813
8170.0000 -174.93497 -171.98804 2.94693 1.71504 -172.02754 290.38275
8175.0000 -174.49628 -171.83964 2.65664 1.74594 -171.51286 318.32432
8180.0000 -174.38047 -172.07823 2.30224 1.70366 -172.21710 275.98223
8185.0000 -174.66783 -172.11489 2.55294 1.71896 -171.96235 292.22130
8190.0000 -173.75581 -170.75193 3.00388 1.74985 -171.44761 317.55495
8195.0000 -173.87864 -170.87614 3.00249 1.79213 -170.74329 352.77082
8200.0000 -174.15403 -171.17858 2.97545 1.77267 -171.06742 337.69072
8205.0000 -174.05703 -170.99762 3.05941 1.78334 -170.88968 346.18219
8210.0000 -174.12890 -171.19160 2.93730 1.78184 -170.91479 347.35928
8215.0000 -174.21265 -171.44844 2.76420 1.74523 -171.52469 312.39605
8220.0000 -174.34418 -171.76984 2.57434 1.73525 -171.69090 310.04184
8225.0000 -174.40964 -171.64997 2.75967 1.74110 -171.59345 310.74836
8230.0000 -174.45668 -171.85503 2.60165 1.74965 -171.45093 315.14961
8235.0000 -174.58295 -171.87397 2.70898 1.72657 -171.83558 296.75394
8240.0000 -174.36420 -171.43105 2.93315 1.74480 -171.53175 317.43248
8245.0000 -174.25749 -171.75892 2.49858 1.74811 -171.47668 316.76962
8250.0000 -174.45649 -171.61719 2.83930 1.73384 -171.71435 304.43963
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 14 [min], 1.8525539 [s].
main_MD> Deallocating global variables
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