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nanoparticlesims/growth_Melting_Silver_ICO_2451/freezeSims/run_72/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_72.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 = 72 ntipo2 = 0
read_input> Finish reading input
main_MD> Allocating global variables
main_MD> Number of outputs that will be created: 1750
main_MD> Size of nv and nvoiz: 72 7200
main_MD> Size of nv and nvoiz: 72 7200
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 = 72
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> 6.2418430701418809E-002 -6.1262225896553467E-002 -0.13402361825487771 initial drift of cluster / NP1 for coalescence
init> 0.34722441826129535 0.36437341265425366 0.31915565238169041 scaling for velocity /for coalescence NP1
init.f90 > facguy = 3.6927931846365892E-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) 2.60442 0.67601 -0.26718
force_rgl> df(natom) 1.11737 3.62390 -2.77861
preparo> THERMALIZATION PROCESS AT 1183.4211071371728
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -157.05898029785621 12.969041561303165 -170.02802185915937 6.7698309779262028E-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 35
FREEZING PROCESS: loop number 1 T-loop= 1158.0000000000000
main_MD> interactions number 1 at Temperature= 1158.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.05038 0.60086 -0.63271
force_rgl> df(natom) 0.99910 0.59751 1.83370
5.0000 -168.43550 -158.59930 9.83620 3.18921 -157.20431 1243.29886
10.0000 -169.37134 -160.39145 8.97989 3.03183 -159.92808 1116.09983
15.0000 -169.96482 -159.51161 10.45321 3.07515 -159.17848 1156.62458
20.0000 -172.34339 -161.79599 10.54739 3.02708 -160.01040 1114.62968
25.0000 -170.30911 -160.66272 9.64639 2.94887 -161.36391 1076.48131
30.0000 -170.88303 -160.52910 10.35394 3.01707 -160.18366 1122.58642
35.0000 -172.49068 -162.86608 9.62460 2.98507 -160.73736 1092.51849
40.0000 -169.02289 -159.13371 9.88918 3.00254 -160.43512 1101.49960
45.0000 -168.44647 -157.91348 10.53299 3.14832 -157.91208 1184.15559
50.0000 -168.51324 -158.00070 10.51254 3.19904 -157.03416 1232.30437
55.0000 -168.25222 -156.96428 11.28794 3.18628 -157.25506 1218.39796
60.0000 -170.05183 -161.17073 8.88110 3.14839 -157.91086 1227.68503
65.0000 -172.33202 -161.85490 10.47711 2.93318 -161.63549 1064.65373
70.0000 -168.19713 -156.31159 11.88553 3.07863 -159.11815 1153.50872
75.0000 -169.69631 -158.25796 11.43834 3.09108 -158.90274 1194.27108
80.0000 -167.56535 -158.42778 9.13757 3.18228 -157.32421 1228.46237
85.0000 -167.88186 -157.73095 10.15091 3.17395 -157.46849 1222.36648
90.0000 -171.22647 -160.93025 10.29622 3.05415 -159.54183 1175.07207
95.0000 -172.17430 -161.31010 10.86420 3.02695 -160.01252 1114.08730
100.0000 -170.57192 -160.24249 10.32943 3.04115 -159.76683 1170.20126
105.0000 -171.51550 -159.67030 11.84521 2.94661 -161.40304 1099.76688
110.0000 -166.30854 -155.11385 11.19469 3.24118 -156.30494 1278.21061
115.0000 -169.07923 -159.25545 9.82377 3.10631 -158.63907 1170.68704
120.0000 -167.71155 -156.13607 11.57548 3.10758 -158.61711 1163.75364
125.0000 -167.96898 -157.54893 10.42005 3.28285 -155.58368 1307.28155
130.0000 -167.57085 -155.80069 11.77015 3.26425 -155.90557 1269.56672
135.0000 -169.02906 -157.35335 11.67571 3.20187 -156.98518 1223.76206
140.0000 -169.22077 -157.62853 11.59223 3.08573 -158.99530 1159.19502
145.0000 -171.96687 -162.80406 9.16281 3.01807 -160.16624 1137.97658
150.0000 -170.83020 -161.51841 9.31178 2.91061 -162.02611 1044.60530
155.0000 -170.87848 -160.40261 10.47586 3.07723 -159.14236 1182.85249
160.0000 -172.57931 -160.38309 12.19622 3.02427 -160.05902 1108.37918
165.0000 -165.97023 -155.39637 10.57386 3.20090 -157.00209 1252.36922
170.0000 -164.83816 -154.60340 10.23476 3.22976 -156.50252 1254.51679
175.0000 -170.17072 -159.36366 10.80706 3.14480 -157.97304 1194.11305
180.0000 -167.84392 -156.69103 11.15289 3.14943 -157.89279 1189.53260
185.0000 -168.91023 -159.27713 9.63310 3.08158 -159.06705 1149.56609
190.0000 -169.35484 -161.29484 8.06000 2.98192 -160.79201 1073.60805
195.0000 -169.58117 -159.70702 9.87415 3.01525 -160.21501 1105.35824
200.0000 -171.34952 -160.03037 11.31915 3.08876 -158.94279 1153.92911
205.0000 -168.15051 -157.14034 11.01017 3.11275 -158.52760 1229.84777
210.0000 -167.61809 -158.02759 9.59050 3.21739 -156.71669 1228.14618
215.0000 -170.74660 -158.48633 12.26027 3.08443 -159.01782 1205.36764
220.0000 -171.04564 -160.95146 10.09418 3.03644 -159.84838 1171.20224
225.0000 -171.14508 -159.79322 11.35186 2.94755 -161.38670 1091.63395
230.0000 -169.66549 -159.21526 10.45023 3.02195 -160.09907 1153.17004
235.0000 -171.91535 -160.57031 11.34504 3.09386 -158.85461 1172.55578
240.0000 -167.74425 -157.51888 10.22537 3.10924 -158.58834 1180.35084
245.0000 -169.73998 -159.06292 10.67706 3.11884 -158.42225 1180.69372
250.0000 -170.23260 -160.11056 10.12204 3.14638 -157.94564 1197.56193
FREEZING PROCESS: loop number 2 T-loop= 1133.0000000000000
main_MD> interactions number 2 at Temperature= 1133.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.45416 -2.07418 -0.98835
force_rgl> df(natom) 0.16067 0.15480 2.23400
255.0000 -169.43083 -158.33377 11.09706 3.11409 -158.50444 1210.79317
260.0000 -168.59982 -159.21348 9.38634 3.12576 -158.30242 1186.16239
265.0000 -170.58261 -159.89651 10.68609 3.00134 -160.45584 1121.83072
270.0000 -169.74083 -159.11865 10.62217 3.11659 -158.46126 1183.17624
275.0000 -168.92858 -158.63175 10.29683 3.10260 -158.70331 1190.13995
280.0000 -169.26319 -156.75559 12.50759 3.16307 -157.65668 1229.40276
285.0000 -166.84140 -156.48626 10.35514 3.24940 -156.16259 1282.32804
290.0000 -168.78182 -157.87729 10.90454 3.20592 -156.91522 1205.89900
295.0000 -169.42857 -157.99601 11.43256 3.14178 -158.02523 1202.94081
300.0000 -170.19505 -158.95743 11.23762 3.12004 -158.40157 1194.37708
305.0000 -171.34555 -158.97539 12.37017 3.04690 -159.66732 1123.45416
310.0000 -171.76287 -161.32508 10.43779 3.01715 -160.18216 1102.27611
315.0000 -170.42925 -157.81464 12.61461 3.08236 -159.05365 1141.57794
320.0000 -170.23562 -158.16963 12.06599 3.18648 -157.25161 1220.97811
325.0000 -169.36496 -159.10065 10.26431 3.07941 -159.10458 1165.23898
330.0000 -170.14338 -158.99248 11.15090 3.03892 -159.80543 1122.48297
335.0000 -168.42029 -157.78148 10.63880 3.13010 -158.22738 1155.47644
340.0000 -169.05637 -159.57308 9.48330 3.12603 -158.29789 1181.60816
345.0000 -171.35626 -160.06995 11.28631 3.05100 -159.59638 1152.07458
350.0000 -170.75486 -160.31370 10.44116 3.03260 -159.91489 1139.02672
355.0000 -167.65610 -157.68609 9.97001 3.07315 -159.21309 1164.47757
360.0000 -170.55353 -161.29869 9.25484 3.04837 -159.64195 1147.95583
365.0000 -170.10041 -158.19606 11.90436 2.95066 -161.33293 1096.66758
370.0000 -168.64503 -158.44969 10.19534 3.14465 -157.97558 1195.46343
375.0000 -172.41319 -162.59585 9.81734 3.00498 -160.39282 1122.04980
380.0000 -171.17429 -159.98063 11.19366 2.95438 -161.26864 1082.94772
385.0000 -170.75444 -160.34027 10.41416 3.03010 -159.95801 1133.70275
390.0000 -169.46234 -159.65594 9.80640 3.04600 -159.68290 1089.51396
395.0000 -171.32501 -159.02790 12.29712 3.04322 -159.73104 1110.50837
400.0000 -167.57107 -157.47614 10.09493 3.18472 -157.28211 1237.95918
405.0000 -169.40612 -157.74944 11.65668 3.15408 -157.81237 1189.44222
410.0000 -165.85675 -154.20186 11.65489 3.26498 -155.89295 1295.57216
415.0000 -170.29952 -159.10526 11.19426 3.21034 -156.83866 1222.05822
420.0000 -171.53782 -161.16827 10.36955 3.02711 -160.00989 1138.62634
425.0000 -171.69182 -160.73495 10.95687 3.00163 -160.45089 1106.54685
430.0000 -169.91986 -158.71280 11.20706 3.05285 -159.56432 1148.85000
435.0000 -168.90477 -158.03043 10.87435 3.11394 -158.50703 1218.73584
440.0000 -169.94309 -159.12531 10.81778 3.05350 -159.55303 1133.32203
445.0000 -168.62727 -157.79900 10.82826 3.10351 -158.68756 1184.28276
450.0000 -170.18732 -158.69488 11.49244 3.09719 -158.79693 1161.74299
455.0000 -169.82277 -159.68238 10.14039 3.09276 -158.87358 1185.91737
460.0000 -168.02639 -157.41730 10.60909 3.15595 -157.77990 1172.63435
465.0000 -170.72863 -157.57574 13.15289 3.24243 -156.28321 1270.32532
470.0000 -170.74597 -159.00134 11.74464 3.07627 -159.15907 1169.48959
475.0000 -171.22197 -161.20274 10.01923 3.05844 -159.46759 1136.13195
480.0000 -170.39975 -160.63492 9.76483 2.98438 -160.74933 1088.73008
485.0000 -170.24737 -160.31578 9.93160 2.97506 -160.91059 1077.16158
490.0000 -174.33272 -162.67175 11.66097 2.96917 -161.01267 1101.89142
495.0000 -173.03604 -162.89716 10.13889 2.91024 -162.03245 1081.02500
500.0000 -169.06509 -160.19000 8.87509 2.94567 -161.41931 1071.40196
FREEZING PROCESS: loop number 3 T-loop= 1108.0000000000000
main_MD> interactions number 3 at Temperature= 1108.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.18736 1.42115 4.58976
force_rgl> df(natom) 0.03770 -7.51651 1.87153
505.0000 -169.23987 -159.33060 9.90927 3.07949 -159.10327 1128.89119
510.0000 -172.48167 -162.87083 9.61085 3.00471 -160.39743 1111.59256
515.0000 -173.30996 -162.68665 10.62331 2.93023 -161.68659 1067.92312
520.0000 -170.46761 -161.30983 9.15779 2.99248 -160.60921 1092.63130
525.0000 -170.85908 -160.73100 10.12808 2.99944 -160.48875 1104.83082
530.0000 -171.42277 -162.90542 8.51735 2.92011 -161.86159 1024.42588
535.0000 -170.19660 -158.80228 11.39432 3.00757 -160.34796 1085.28439
540.0000 -172.00821 -161.51731 10.49090 3.07140 -159.24333 1139.09147
545.0000 -169.95809 -159.78559 10.17250 3.01078 -160.29248 1109.41046
550.0000 -169.38262 -158.80987 10.57275 3.04824 -159.64417 1151.36825
555.0000 -170.31572 -161.62482 8.69090 3.02989 -159.96177 1146.59089
560.0000 -171.73266 -161.13249 10.60018 2.96924 -161.01145 1092.06610
565.0000 -171.33637 -160.36642 10.96996 2.95881 -161.19189 1103.93017
570.0000 -171.76758 -159.87898 11.88860 2.97325 -160.94205 1055.64985
575.0000 -172.48314 -162.93422 9.54892 2.97294 -160.94734 1081.23017
580.0000 -172.21408 -161.09247 11.12162 2.87729 -162.60278 1024.37302
585.0000 -169.36369 -159.22296 10.14073 3.03322 -159.90401 1126.85030
590.0000 -170.49234 -160.25346 10.23888 3.04678 -159.66943 1140.86704
595.0000 -170.24463 -159.53022 10.71441 3.02217 -160.09529 1140.91172
600.0000 -168.14255 -159.92180 8.22075 2.99328 -160.59527 1120.23321
605.0000 -169.15012 -158.21619 10.93393 3.08934 -158.93276 1178.23076
610.0000 -170.04830 -159.80117 10.24713 3.08766 -158.96187 1171.37220
615.0000 -172.34797 -162.37075 9.97722 2.95619 -161.23717 1061.96272
620.0000 -171.37721 -160.28272 11.09449 2.92882 -161.71095 1034.42211
625.0000 -172.04658 -163.73889 8.30768 2.96282 -161.12247 1060.30791
630.0000 -171.51940 -163.18280 8.33660 2.84945 -163.08465 1029.67707
635.0000 -171.47133 -160.15890 11.31243 2.88293 -162.50516 1049.25017
640.0000 -170.41609 -160.69669 9.71940 2.99429 -160.57782 1114.64345
645.0000 -171.26657 -161.47109 9.79548 2.95644 -161.23297 1076.77942
650.0000 -172.17779 -161.33960 10.83819 3.01473 -160.22406 1115.38953
655.0000 -168.98593 -158.15842 10.82751 3.01262 -160.26061 1094.09301
660.0000 -167.70164 -156.84873 10.85290 3.14056 -158.04632 1193.56242
665.0000 -170.38632 -159.29538 11.09095 3.11550 -158.48010 1200.76203
670.0000 -173.06683 -163.24685 9.81998 2.92186 -161.83145 1071.91279
675.0000 -171.35529 -161.67431 9.68098 2.86376 -162.83685 1031.80687
680.0000 -170.83451 -160.73348 10.10103 2.90017 -162.20685 1038.74367
685.0000 -171.26877 -160.62433 10.64443 2.97725 -160.87267 1088.23805
690.0000 -170.63983 -161.78811 8.85172 2.94182 -161.48596 1049.53369
695.0000 -173.56641 -162.27441 11.29200 2.93563 -161.59311 1066.37761
700.0000 -172.11294 -162.44576 9.66717 2.86871 -162.75131 1060.46364
705.0000 -172.09031 -161.99234 10.09797 2.95036 -161.33812 1113.01944
710.0000 -171.04594 -160.93445 10.11149 2.92202 -161.82867 1053.82963
715.0000 -172.42569 -160.87460 11.55109 2.96905 -161.01469 1112.22627
720.0000 -169.93505 -158.11745 11.81760 3.06757 -159.30964 1174.96682
725.0000 -172.70545 -160.92066 11.78479 2.94817 -161.37599 1092.53959
730.0000 -173.39072 -161.20971 12.18102 2.94135 -161.49412 1085.51260
735.0000 -171.71533 -160.40172 11.31361 3.01916 -160.14747 1148.87427
740.0000 -170.83046 -159.09494 11.73552 3.04686 -159.66806 1147.52326
745.0000 -170.00336 -160.79321 9.21015 3.12134 -158.37890 1165.29194
750.0000 -168.82611 -158.86036 9.96574 3.02921 -159.97348 1126.70052
FREEZING PROCESS: loop number 4 T-loop= 1083.0000000000000
main_MD> interactions number 4 at Temperature= 1083.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.33720 -1.97270 2.58054
force_rgl> df(natom) 4.11000 4.85874 -0.35080
755.0000 -171.44774 -160.26902 11.17872 3.04284 -159.73760 1146.41580
760.0000 -169.66492 -158.82845 10.83647 3.05670 -159.49763 1159.26558
765.0000 -171.34749 -160.26104 11.08645 3.07514 -159.17860 1136.59200
770.0000 -171.47408 -160.35253 11.12155 3.00077 -160.46575 1103.99071
775.0000 -170.76525 -161.91215 8.85309 2.90680 -162.09208 1028.12713
780.0000 -170.29008 -160.32757 9.96251 3.01393 -160.23800 1099.11960
785.0000 -167.91024 -158.60728 9.30296 3.03221 -159.92157 1119.29272
790.0000 -170.42960 -159.09933 11.33027 3.07043 -159.26013 1158.50267
795.0000 -172.73726 -159.69255 13.04470 3.06428 -159.36648 1151.42587
800.0000 -169.70755 -157.81913 11.88842 3.10758 -158.61706 1136.56952
805.0000 -169.37184 -158.33358 11.03826 3.20977 -156.84845 1240.46595
810.0000 -170.19758 -159.32513 10.87245 3.06139 -159.41647 1160.08710
815.0000 -170.48352 -160.57622 9.90730 2.95554 -161.24840 1039.52438
820.0000 -170.49267 -160.14493 10.34774 2.95991 -161.17285 1084.16929
825.0000 -172.65035 -163.37058 9.27978 2.94524 -161.42670 1066.77630
830.0000 -172.58918 -162.19615 10.39303 2.88562 -162.45857 1027.97998
835.0000 -171.35565 -161.86895 9.48670 2.84224 -163.20940 1002.78331
840.0000 -172.83764 -163.41471 9.42294 2.87613 -162.62281 1019.41807
845.0000 -172.36801 -162.96393 9.40408 2.83582 -163.32049 1006.13180
850.0000 -173.35145 -163.16460 10.18685 2.89365 -162.31962 1019.41214
855.0000 -171.94040 -161.74702 10.19339 2.84806 -163.10861 990.72282
860.0000 -172.76045 -163.10421 9.65623 2.88500 -162.46938 1011.86817
865.0000 -171.70850 -162.24899 9.45951 2.86133 -162.87902 1004.83671
870.0000 -171.32729 -161.03081 10.29648 2.92383 -161.79737 1044.60776
875.0000 -169.91521 -159.72246 10.19275 3.01155 -160.27911 1123.15232
880.0000 -170.24078 -159.43672 10.80406 3.08450 -159.01662 1179.26797
885.0000 -170.24454 -160.19163 10.05292 3.11405 -158.50521 1182.63774
890.0000 -172.33565 -161.96399 10.37166 2.96565 -161.07345 1076.96197
895.0000 -170.51660 -160.09125 10.42534 2.94577 -161.41756 1055.47787
900.0000 -172.75570 -158.94775 13.80795 3.05608 -159.50843 1135.71004
905.0000 -170.35025 -161.05065 9.29960 2.98488 -160.74067 1079.30773
910.0000 -171.48536 -161.09485 10.39051 2.96640 -161.06060 1069.91158
915.0000 -171.77366 -162.24627 9.52739 2.96391 -161.10367 1047.77588
920.0000 -170.97769 -159.91628 11.06141 2.92865 -161.71384 1081.16658
925.0000 -170.40479 -161.05791 9.34688 3.01881 -160.15350 1116.25902
930.0000 -173.08021 -163.16872 9.91149 2.87032 -162.72340 1051.56898
935.0000 -171.59606 -162.58883 9.00723 2.84448 -163.17061 993.72006
940.0000 -172.84934 -163.73942 9.10992 2.87387 -162.66187 1029.86209
945.0000 -170.33689 -160.50153 9.83536 2.94385 -161.45077 1047.80565
950.0000 -169.25982 -159.90029 9.35953 2.98221 -160.78695 1080.69883
955.0000 -171.88349 -161.16647 10.71701 3.05177 -159.58312 1165.99514
960.0000 -171.83436 -162.69643 9.13793 2.92122 -161.84253 1035.00726
965.0000 -170.07311 -161.00493 9.06818 2.97273 -160.95105 1072.39506
970.0000 -172.36550 -163.39100 8.97450 2.91984 -161.86640 1042.86343
975.0000 -170.78295 -160.25713 10.52582 2.91595 -161.93363 1064.67540
980.0000 -170.90543 -162.00428 8.90115 2.96460 -161.09166 1090.53025
985.0000 -170.40752 -161.88999 8.51753 2.90440 -162.13348 1004.35744
990.0000 -172.97512 -164.33355 8.64157 2.85365 -163.01197 999.29397
995.0000 -173.23230 -165.26027 7.97202 2.76040 -164.62577 950.09204
1000.0000 -173.16607 -164.45412 8.71195 2.72533 -165.23268 943.87152
FREEZING PROCESS: loop number 5 T-loop= 1058.0000000000000
main_MD> interactions number 5 at Temperature= 1058.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.09109 0.72962 0.46823
force_rgl> df(natom) -4.60857 -1.54816 2.47334
1005.0000 -172.15691 -163.35637 8.80054 2.76528 -164.54128 983.10571
1010.0000 -172.90205 -164.49128 8.41077 2.79870 -163.96295 948.01525
1015.0000 -172.75688 -164.01319 8.74369 2.79300 -164.06155 948.71395
1020.0000 -172.66050 -163.63600 9.02450 2.87207 -162.69307 1068.95169
1025.0000 -171.23560 -162.27010 8.96551 2.79496 -164.02762 962.89425
1030.0000 -172.26542 -162.58463 9.68080 2.92087 -161.84846 1059.58297
1035.0000 -171.97397 -162.20418 9.76978 2.85324 -163.01893 988.60003
1040.0000 -170.33286 -161.34848 8.98438 2.91309 -161.98315 1020.26481
1045.0000 -169.86705 -160.32800 9.53905 3.05375 -159.54882 1169.18345
1050.0000 -170.35962 -161.86180 8.49782 2.95058 -161.33432 1084.43485
1055.0000 -170.17216 -159.26768 10.90448 3.04089 -159.77132 1116.30045
1060.0000 -170.15051 -161.24271 8.90780 2.97198 -160.96393 1089.33730
1065.0000 -170.12226 -161.90522 8.21704 2.97502 -160.91133 1090.53739
1070.0000 -172.93646 -163.01964 9.91682 2.91472 -161.95500 1039.51236
1075.0000 -169.44578 -159.55765 9.88813 2.95472 -161.26274 1092.52777
1080.0000 -173.39057 -163.55828 9.83230 2.95880 -161.19204 1064.32474
1085.0000 -172.05931 -163.26104 8.79826 2.86213 -162.86515 1004.01824
1090.0000 -169.64491 -160.47815 9.16676 2.86220 -162.86394 1002.06863
1095.0000 -168.81315 -159.42930 9.38386 3.01644 -160.19444 1099.25261
1100.0000 -170.40120 -161.22152 9.17968 3.01921 -160.14648 1111.31735
1105.0000 -170.76910 -161.48922 9.27988 2.95033 -161.33866 1072.96624
1110.0000 -172.77191 -162.68874 10.08317 2.91158 -162.00931 1024.38291
1115.0000 -169.38278 -159.59443 9.78835 2.97264 -160.95260 1104.72546
1120.0000 -170.35936 -161.32313 9.03622 3.02724 -160.00755 1089.00290
1125.0000 -172.38875 -163.06058 9.32816 2.85256 -163.03077 994.75983
1130.0000 -171.26659 -162.67283 8.59376 2.84822 -163.10585 1020.23518
1135.0000 -171.26396 -161.12483 10.13914 2.94481 -161.43418 1056.54674
1140.0000 -171.29512 -161.37352 9.92160 3.01663 -160.19113 1103.92776
1145.0000 -172.16693 -163.62239 8.54454 2.86422 -162.82899 990.39871
1150.0000 -172.76426 -163.77373 8.99053 2.83612 -163.31530 988.71382
1155.0000 -171.95400 -164.06417 7.88984 2.83350 -163.36060 1003.17137
1160.0000 -171.92192 -162.31696 9.60496 2.84721 -163.12343 998.67705
1165.0000 -170.97276 -160.10365 10.86911 2.93698 -161.56970 1062.06598
1170.0000 -173.36882 -163.52999 9.83883 2.88162 -162.52784 1013.52437
1175.0000 -173.10545 -162.42825 10.67721 2.90929 -162.04901 1065.57039
1180.0000 -173.07542 -162.59809 10.47733 2.82941 -163.43149 1029.70406
1185.0000 -171.69939 -163.60725 8.09213 2.88533 -162.46366 1079.16082
1190.0000 -172.18136 -162.56910 9.61226 2.84358 -163.18624 994.98400
1195.0000 -171.86469 -161.56012 10.30458 2.92928 -161.70304 1072.95738
1200.0000 -171.08597 -163.46560 7.62037 2.89718 -162.25853 1022.89964
1205.0000 -169.99039 -159.76374 10.22665 2.91679 -161.91916 1013.87605
1210.0000 -167.69997 -157.31917 10.38080 3.15931 -157.72186 1197.75465
1215.0000 -170.64518 -161.54125 9.10393 2.98821 -160.68315 1083.42554
1220.0000 -170.81578 -160.89620 9.91959 2.92132 -161.84080 1053.43123
1225.0000 -170.57631 -159.24605 11.33026 3.03176 -159.92933 1142.79527
1230.0000 -170.77045 -160.07694 10.69351 3.04336 -159.72866 1129.14296
1235.0000 -172.58195 -162.04990 10.53205 2.90908 -162.05261 1061.49799
1240.0000 -172.16808 -162.23801 9.93007 2.94022 -161.51358 1066.45133
1245.0000 -171.22357 -159.48010 11.74347 2.93774 -161.55653 1048.37783
1250.0000 -169.27822 -159.73852 9.53969 2.98807 -160.68555 1094.13863
FREEZING PROCESS: loop number 6 T-loop= 1033.0000000000000
main_MD> interactions number 6 at Temperature= 1033.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.29131 4.12127 4.27313
force_rgl> df(natom) 1.46758 2.79900 2.00506
1255.0000 -170.70706 -161.63616 9.07090 2.96779 -161.03646 1068.71270
1260.0000 -169.30680 -160.68354 8.62326 2.93852 -161.54306 1064.77346
1265.0000 -173.01715 -163.14084 9.87631 2.92281 -161.81487 1083.06546
1270.0000 -171.15312 -160.49678 10.65633 2.84759 -163.11681 1008.00275
1275.0000 -171.09591 -162.80279 8.29312 2.95914 -161.18623 1105.88835
1280.0000 -173.14587 -161.99000 11.15586 2.86039 -162.89519 1026.98309
1285.0000 -171.73207 -163.83809 7.89398 2.77935 -164.29772 976.99930
1290.0000 -172.29851 -162.58431 9.71420 2.82798 -163.45615 1024.18975
1295.0000 -173.41520 -163.46732 9.94788 2.81670 -163.65136 1007.56082
1300.0000 -171.52784 -162.90688 8.62095 2.81315 -163.71274 987.45955
1305.0000 -174.24748 -165.00084 9.24664 2.84679 -163.13064 1011.26261
1310.0000 -171.98597 -162.52412 9.46185 2.82252 -163.55075 993.27653
1315.0000 -172.95632 -164.50020 8.45611 2.85460 -162.99553 1003.38885
1320.0000 -171.62662 -161.97166 9.65496 2.85261 -163.02986 1007.25761
1325.0000 -173.98296 -164.26214 9.72082 2.88551 -162.46052 1041.80204
1330.0000 -169.67274 -159.52878 10.14396 2.93019 -161.68728 1065.10548
1335.0000 -172.00584 -162.08701 9.91883 2.96904 -161.01484 1087.02067
1340.0000 -171.67023 -163.46814 8.20209 2.86220 -162.86389 1039.45817
1345.0000 -174.40686 -165.95254 8.45433 2.77269 -164.41301 977.05234
1350.0000 -172.42896 -161.92094 10.50802 2.85091 -163.05930 1022.58411
1355.0000 -172.66416 -162.83726 9.82689 2.87819 -162.58724 1059.76777
1360.0000 -172.04854 -163.35301 8.69553 2.80285 -163.89107 968.05923
1365.0000 -173.43729 -163.25790 10.17939 2.86945 -162.73842 1028.23012
1370.0000 -172.73799 -162.74506 9.99293 2.84923 -163.08843 988.06295
1375.0000 -171.19084 -162.00971 9.18113 2.88123 -162.53459 1016.07817
1380.0000 -170.94068 -162.32951 8.61117 2.88745 -162.42692 1049.43412
1385.0000 -172.25871 -162.55696 9.70176 2.93502 -161.60369 1086.34374
1390.0000 -173.87366 -165.97397 7.89970 2.79618 -164.00653 970.68965
1395.0000 -172.79383 -163.97890 8.81493 2.80052 -163.93150 993.07234
1400.0000 -173.79940 -165.13859 8.66081 2.73879 -164.99970 910.92616
1405.0000 -171.08128 -161.06897 10.01231 2.78032 -164.28099 987.38638
1410.0000 -170.32338 -160.97792 9.34546 2.98806 -160.68568 1078.82193
1415.0000 -170.27457 -159.05296 11.22161 3.01469 -160.22481 1104.06371
1420.0000 -171.98322 -160.48436 11.49887 3.03842 -159.81411 1110.73855
1425.0000 -171.45404 -160.00964 11.44440 2.97641 -160.88735 1115.05055
1430.0000 -172.79332 -162.60157 10.19175 2.95363 -161.28149 1080.64605
1435.0000 -170.46621 -161.93399 8.53223 2.91982 -161.86666 1030.71770
1440.0000 -172.52965 -162.10289 10.42675 2.92181 -161.83226 1065.06479
1445.0000 -169.92785 -161.11139 8.81645 2.92451 -161.78548 1077.25759
1450.0000 -171.77486 -163.10974 8.66512 2.93915 -161.53217 1086.12849
1455.0000 -172.50019 -162.95960 9.54058 2.85940 -162.91241 1019.31677
1460.0000 -173.66379 -163.39678 10.26701 2.87699 -162.60795 1009.86977
1465.0000 -171.83464 -162.54353 9.29111 2.85405 -163.00503 1009.78723
1470.0000 -171.86751 -161.08290 10.78461 2.95062 -161.33364 1102.44504
1475.0000 -172.28157 -162.91624 9.36533 2.88361 -162.49331 1039.77323
1480.0000 -173.16104 -163.98830 9.17275 2.85078 -163.06163 989.13761
1485.0000 -173.25747 -164.00985 9.24762 2.75982 -164.63579 934.79876
1490.0000 -172.57937 -162.85321 9.72616 2.78988 -164.11556 987.57283
1495.0000 -170.59347 -161.80131 8.79216 2.89758 -162.25156 1043.55538
1500.0000 -172.21266 -162.38141 9.83125 2.90382 -162.14356 1055.14409
FREEZING PROCESS: loop number 7 T-loop= 1008.0000000000000
main_MD> interactions number 7 at Temperature= 1008.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 4.44215 -0.96240 -3.06241
force_rgl> df(natom) -0.88807 -5.19278 -0.04947
1505.0000 -173.99329 -164.73310 9.26019 2.91531 -161.94479 1059.36814
1510.0000 -171.62263 -163.71006 7.91257 2.72104 -165.30706 928.69092
1515.0000 -174.17510 -165.14033 9.03476 2.78814 -164.14561 976.23553
1520.0000 -172.16174 -162.98890 9.17285 2.79571 -164.01465 978.82798
1525.0000 -170.82689 -160.05268 10.77421 2.88039 -162.54917 1023.66975
1530.0000 -171.42421 -162.11625 9.30796 3.01594 -160.20309 1135.47300
1535.0000 -174.64774 -163.69043 10.95731 2.85308 -163.02182 985.92591
1540.0000 -172.96376 -164.85648 8.10728 2.81591 -163.66502 1008.50280
1545.0000 -173.12057 -162.90703 10.21355 2.76584 -164.53165 973.93429
1550.0000 -171.64975 -161.51563 10.13412 2.91239 -161.99528 1037.14049
1555.0000 -170.18211 -159.93544 10.24668 3.01897 -160.15064 1146.18369
1560.0000 -170.85631 -160.68659 10.16972 2.96461 -161.09143 1100.48595
1565.0000 -170.36430 -161.02440 9.33990 2.95448 -161.26686 1072.92299
1570.0000 -172.26573 -162.65438 9.61136 2.88904 -162.39931 1022.75087
1575.0000 -172.16442 -160.90384 11.26059 2.91218 -161.99894 1027.57937
1580.0000 -170.10372 -160.87260 9.23112 3.02404 -160.06287 1113.21306
1585.0000 -173.03159 -163.62990 9.40169 2.89066 -162.37128 1006.05839
1590.0000 -173.95131 -164.48753 9.46379 2.81116 -163.74727 995.87696
1595.0000 -173.25749 -163.12338 10.13410 2.77718 -164.33528 945.47326
1600.0000 -174.47295 -165.69104 8.78191 2.81216 -163.72997 999.65062
1605.0000 -173.66016 -164.31499 9.34517 2.78013 -164.28433 952.36805
1610.0000 -173.90207 -164.06880 9.83327 2.82443 -163.51761 995.98749
1615.0000 -174.42232 -166.26298 8.15935 2.75173 -164.77577 944.15079
1620.0000 -173.63444 -164.49911 9.13533 2.72741 -165.19674 940.14158
1625.0000 -173.40656 -164.62560 8.78096 2.80487 -163.85616 980.77328
1630.0000 -173.47504 -163.22292 10.25212 2.83166 -163.39243 1010.79275
1635.0000 -173.14691 -162.17616 10.97076 2.84753 -163.11783 1029.26324
1640.0000 -172.63143 -163.56664 9.06478 2.86024 -162.89777 1021.31271
1645.0000 -171.77785 -160.64663 11.13122 2.92568 -161.76524 1059.31650
1650.0000 -172.58730 -162.23382 10.35348 2.93633 -161.58099 1085.15389
1655.0000 -172.21487 -161.74144 10.47343 2.87395 -162.66050 1050.94998
1660.0000 -172.66862 -162.57679 10.09184 2.90094 -162.19343 1043.34289
1665.0000 -173.87019 -165.65577 8.21441 2.83526 -163.33023 1000.49942
1670.0000 -171.31746 -162.73205 8.58541 2.76451 -164.55460 939.08346
1675.0000 -172.29259 -162.23121 10.06138 2.91985 -161.86612 1048.02904
1680.0000 -171.16687 -161.73638 9.43049 2.92210 -161.82717 1059.12651
1685.0000 -172.03614 -162.14254 9.89361 2.96425 -161.09773 1081.43496
1690.0000 -171.32067 -162.47731 8.84336 2.89496 -162.29691 1038.51888
1695.0000 -173.59886 -162.62494 10.97392 2.92897 -161.70835 1052.73428
1700.0000 -171.09767 -160.86625 10.23142 2.87087 -162.71394 1005.70256
1705.0000 -170.96783 -161.20789 9.75994 2.92873 -161.71242 1062.53003
1710.0000 -172.87974 -164.26238 8.61736 2.84597 -163.14481 991.72795
1715.0000 -172.06725 -163.36400 8.70325 2.72447 -165.24755 915.99113
1720.0000 -171.59115 -162.10497 9.48618 2.84127 -163.22621 982.01555
1725.0000 -171.35790 -160.69071 10.66719 2.94517 -161.42790 1077.67352
1730.0000 -172.34467 -160.57186 11.77281 2.95082 -161.33015 1111.65628
1735.0000 -171.62099 -162.25744 9.36355 2.99435 -160.57681 1118.47981
1740.0000 -173.76562 -163.35714 10.40848 2.84456 -163.16917 1003.22893
1745.0000 -173.42570 -163.28708 10.13863 2.83855 -163.27323 999.41722
1750.0000 -172.73846 -163.27529 9.46317 2.82523 -163.50375 997.09106
FREEZING PROCESS: loop number 8 T-loop= 983.00000000000000
main_MD> interactions number 8 at Temperature= 983.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.35105 1.48007 0.37095
force_rgl> df(natom) -3.48589 -2.44938 2.78134
1755.0000 -173.99737 -165.83124 8.16613 2.75149 -164.77995 944.90725
1760.0000 -173.15336 -164.01347 9.13989 2.75339 -164.74702 946.68499
1765.0000 -172.02923 -163.13470 8.89453 2.82163 -163.56614 989.10660
1770.0000 -173.79667 -165.31961 8.47706 2.80622 -163.83269 974.88617
1775.0000 -173.87094 -165.12632 8.74462 2.75986 -164.63510 938.25012
1780.0000 -170.92629 -161.50616 9.42013 2.84174 -163.21804 1011.56102
1785.0000 -171.79448 -164.02041 7.77407 2.82838 -163.44920 979.03969
1790.0000 -175.34083 -166.11351 9.22731 2.75427 -164.73192 965.96606
1795.0000 -174.97927 -166.54022 8.43905 2.62989 -166.88455 859.61697
1800.0000 -174.81075 -164.96926 9.84149 2.64732 -166.58278 891.20240
1805.0000 -172.38748 -162.90175 9.48573 2.80170 -163.91102 1006.15596
1810.0000 -173.08351 -162.53132 10.55219 2.93693 -161.57062 1046.41835
1815.0000 -172.46258 -161.67245 10.79013 2.86163 -162.87379 1010.20580
1820.0000 -172.45569 -163.95528 8.50041 2.88128 -162.53362 1014.87156
1825.0000 -171.95550 -162.19416 9.76135 2.85999 -162.90222 1025.39946
1830.0000 -172.50145 -162.38149 10.11996 2.91549 -161.94155 1049.57097
1835.0000 -172.23954 -163.16867 9.07087 2.82224 -163.55554 999.20279
1840.0000 -171.83930 -162.07604 9.76326 2.86784 -162.76636 1027.85870
1845.0000 -174.39916 -164.52955 9.86961 2.89010 -162.38108 1019.07532
1850.0000 -170.51856 -162.48829 8.03027 2.80874 -163.78918 989.08967
1855.0000 -174.17316 -165.83963 8.33354 2.81324 -163.71122 977.52423
1860.0000 -171.96237 -162.79856 9.16382 2.78110 -164.26751 955.99165
1865.0000 -174.44050 -165.65317 8.78733 2.79331 -164.05627 975.00449
1870.0000 -172.41596 -164.20717 8.20880 2.73951 -164.98734 944.09979
1875.0000 -172.57976 -163.15855 9.42121 2.80774 -163.80650 978.58999
1880.0000 -173.63461 -164.23725 9.39735 2.82385 -163.52756 996.77141
1885.0000 -172.24998 -161.59159 10.65839 2.85448 -162.99744 1005.68234
1890.0000 -172.19248 -163.54647 8.64601 2.88855 -162.40786 1030.70276
1895.0000 -172.04736 -162.22495 9.82240 2.85173 -163.04506 996.13882
1900.0000 -171.91813 -161.24306 10.67508 2.98113 -160.80568 1070.14866
1905.0000 -171.58042 -162.57960 9.00082 2.92431 -161.78899 1084.14775
1910.0000 -173.85602 -165.27761 8.57841 2.79269 -164.06693 957.16942
1915.0000 -174.25253 -166.09647 8.15605 2.75398 -164.73691 958.13087
1920.0000 -173.11365 -163.81525 9.29840 2.73386 -165.08503 943.56982
1925.0000 -172.34186 -163.53638 8.80548 2.78665 -164.17148 951.98481
1930.0000 -172.78020 -164.19603 8.58416 2.77437 -164.38402 962.17924
1935.0000 -173.20369 -165.18437 8.01932 2.79961 -163.94722 956.09432
1940.0000 -174.29089 -164.19987 10.09101 2.79255 -164.06940 989.92544
1945.0000 -172.51557 -164.39680 8.11877 2.77476 -164.37719 943.61748
1950.0000 -172.11934 -162.98549 9.13385 2.81793 -163.63005 974.91460
1955.0000 -172.93900 -164.67468 8.26433 2.80334 -163.88260 969.95446
1960.0000 -173.46149 -164.07581 9.38567 2.77996 -164.28731 948.03911
1965.0000 -172.02775 -161.93652 10.09123 2.91416 -161.96463 1041.18412
1970.0000 -170.77498 -161.86122 8.91375 2.89413 -162.31135 1014.32233
1975.0000 -171.70141 -161.51358 10.18783 2.90425 -162.13611 1051.15535
1980.0000 -172.50426 -163.75573 8.74853 2.81499 -163.68097 974.65855
1985.0000 -173.79331 -165.88347 7.90983 2.75671 -164.68969 914.52165
1990.0000 -171.85676 -163.29483 8.56193 2.75342 -164.74650 930.41402
1995.0000 -171.57640 -162.64189 8.93451 2.88286 -162.50644 996.60700
2000.0000 -173.25437 -163.73449 9.51988 2.81774 -163.63335 992.58601
FREEZING PROCESS: loop number 9 T-loop= 958.00000000000000
main_MD> interactions number 9 at Temperature= 958.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.01773 -3.67630 1.24869
force_rgl> df(natom) -2.05233 -1.07926 -2.67611
2005.0000 -170.23113 -161.94054 8.29059 2.86697 -162.78130 1043.32884
2010.0000 -171.81706 -162.74627 9.07080 2.90714 -162.08614 1023.51442
2015.0000 -172.56754 -164.97815 7.58939 2.76180 -164.60162 936.32812
2020.0000 -172.33017 -163.22474 9.10542 2.74444 -164.90204 933.18892
2025.0000 -172.87302 -164.10840 8.76462 2.83260 -163.37624 1019.76765
2030.0000 -172.66782 -164.11567 8.55214 2.78739 -164.15861 980.59325
2035.0000 -172.77733 -161.73674 11.04059 2.84357 -163.18642 1004.08166
2040.0000 -171.86772 -162.77700 9.09071 2.85220 -163.03702 1011.30287
2045.0000 -171.48472 -163.63674 7.84798 2.81767 -163.63456 989.57951
2050.0000 -173.61612 -162.38101 11.23510 2.86551 -162.80660 1049.01198
2055.0000 -171.49345 -162.21244 9.28101 2.87150 -162.70290 1005.09288
2060.0000 -172.83584 -162.71998 10.11586 2.88136 -162.53231 1006.53132
2065.0000 -173.94300 -164.07537 9.86764 2.80418 -163.86803 967.85929
2070.0000 -173.08463 -164.35190 8.73274 2.76137 -164.60894 953.42882
2075.0000 -172.97642 -164.67709 8.29933 2.76981 -164.46283 976.54427
2080.0000 -172.10763 -163.09168 9.01595 2.78609 -164.18112 965.08186
2085.0000 -171.24242 -163.14241 8.10001 2.84690 -163.12874 987.51965
2090.0000 -172.13493 -162.00007 10.13486 2.93293 -161.63971 1049.20528
2095.0000 -174.23378 -164.16519 10.06858 2.88691 -162.43619 1059.54484
2100.0000 -173.65229 -165.40897 8.24331 2.73228 -165.11251 938.01055
2105.0000 -175.06658 -166.17321 8.89338 2.76032 -164.62715 928.12018
2110.0000 -175.25788 -166.51690 8.74098 2.65301 -166.48436 868.61209
2115.0000 -171.05762 -162.63660 8.42102 2.78756 -164.15573 967.63701
2120.0000 -172.54657 -164.55800 7.98856 2.82946 -163.43051 983.80187
2125.0000 -173.78515 -165.76658 8.01857 2.67826 -166.04735 892.74963
2130.0000 -174.59160 -165.47263 9.11897 2.67663 -166.07554 874.84841
2135.0000 -170.35087 -160.77239 9.57848 2.81089 -163.75196 985.81904
2140.0000 -172.89014 -164.04103 8.84911 2.93318 -161.63552 1053.28845
2145.0000 -172.01006 -164.09661 7.91345 2.80758 -163.80929 979.50897
2150.0000 -171.55051 -162.27245 9.27806 2.80080 -163.92653 958.27443
2155.0000 -172.67686 -164.88191 7.79495 2.85174 -163.04499 1013.17153
2160.0000 -174.37909 -165.61717 8.76192 2.70518 -165.58152 934.76824
2165.0000 -173.62863 -165.37328 8.25535 2.68381 -165.95125 893.39611
2170.0000 -174.39720 -165.03986 9.35734 2.70011 -165.66914 920.62608
2175.0000 -173.55852 -165.36079 8.19773 2.67464 -166.11006 917.99356
2180.0000 -175.21969 -166.32998 8.88970 2.73651 -165.03928 934.46495
2185.0000 -174.55215 -166.17637 8.37578 2.73181 -165.12060 926.06168
2190.0000 -173.77867 -164.03945 9.73921 2.74922 -164.81935 965.06586
2195.0000 -174.64294 -166.34443 8.29851 2.72886 -165.17160 914.73209
2200.0000 -173.18888 -164.32919 8.85969 2.72683 -165.20684 914.70624
2205.0000 -171.09591 -161.97431 9.12160 2.83845 -163.27498 995.57819
2210.0000 -174.45926 -164.90205 9.55721 2.81249 -163.72420 990.91851
2215.0000 -173.40709 -162.35466 11.05243 2.77224 -164.42088 969.78310
2220.0000 -172.83880 -163.97570 8.86309 2.84390 -163.18058 993.26018
2225.0000 -172.84139 -165.92170 6.91968 2.78988 -164.11558 937.77195
2230.0000 -171.61242 -162.27970 9.33272 2.80700 -163.81924 956.12495
2235.0000 -173.34379 -165.53870 7.80508 2.82390 -163.52683 968.90000
2240.0000 -173.51478 -165.79903 7.71575 2.70467 -165.59037 920.52959
2245.0000 -174.03350 -166.14808 7.88542 2.74274 -164.93141 942.95761
2250.0000 -175.69356 -166.57460 9.11896 2.68191 -165.98413 859.45478
FREEZING PROCESS: loop number 10 T-loop= 933.00000000000000
main_MD> interactions number 10 at Temperature= 933.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.58694 2.69477 0.45828
force_rgl> df(natom) -0.41821 0.80180 -0.19235
2255.0000 -174.14251 -166.22204 7.92047 2.66029 -166.35830 849.76979
2260.0000 -175.28187 -167.04224 8.23963 2.62022 -167.05194 869.20380
2265.0000 -174.07592 -165.18976 8.88616 2.64549 -166.61458 862.03194
2270.0000 -173.72706 -165.38758 8.33949 2.67265 -166.14452 908.53253
2275.0000 -175.20708 -166.77493 8.43215 2.68132 -165.99436 896.13249
2280.0000 -175.37196 -167.47836 7.89360 2.60344 -167.34230 846.76773
2285.0000 -172.82634 -164.35853 8.46782 2.69172 -165.81449 913.31918
2290.0000 -174.41728 -165.24456 9.17271 2.73414 -165.08030 915.94536
2295.0000 -173.28115 -165.02740 8.25375 2.75891 -164.65158 925.97961
2300.0000 -174.37410 -166.52583 7.84827 2.71958 -165.33218 923.91901
2305.0000 -174.13554 -166.39972 7.73582 2.63365 -166.81949 851.09413
2310.0000 -174.46963 -165.89346 8.57617 2.72579 -165.22481 913.87363
2315.0000 -172.63506 -164.26681 8.36825 2.74309 -164.92542 937.24642
2320.0000 -171.18536 -161.29201 9.89335 2.87655 -162.61563 1032.62435
2325.0000 -171.12674 -162.34502 8.78172 2.91533 -161.94442 1070.16212
2330.0000 -172.89486 -163.24619 9.64867 2.81765 -163.63486 982.72874
2335.0000 -172.25628 -162.98516 9.27112 2.84623 -163.14039 972.93947
2340.0000 -172.71453 -164.62049 8.09404 2.81360 -163.70503 982.89921
2345.0000 -173.70231 -164.35667 9.34563 2.81040 -163.76044 1004.82775
2350.0000 -173.19513 -165.09666 8.09847 2.75953 -164.64077 963.70431
2355.0000 -172.75275 -163.75919 8.99355 2.74188 -164.94633 933.57616
2360.0000 -172.59400 -164.94321 7.65079 2.77255 -164.41545 931.55839
2365.0000 -174.55804 -166.74174 7.81630 2.70349 -165.61067 946.46043
2370.0000 -176.94345 -168.21441 8.72905 2.56485 -168.01012 844.47159
2375.0000 -175.59743 -166.97096 8.62648 2.60068 -167.39003 840.14371
2380.0000 -172.93425 -164.75259 8.18166 2.72356 -165.26329 913.35559
2385.0000 -174.08591 -165.36092 8.72499 2.77127 -164.43760 964.41894
2390.0000 -174.06976 -164.30270 9.76707 2.74007 -164.97767 914.97217
2395.0000 -174.35001 -166.16569 8.18432 2.73275 -165.10431 936.55954
2400.0000 -174.16189 -166.21237 7.94951 2.64300 -166.65755 863.55943
2405.0000 -175.91862 -168.10977 7.80885 2.60294 -167.35087 865.31859
2410.0000 -173.39537 -164.73771 8.65766 2.64779 -166.57470 880.61484
2415.0000 -173.79475 -164.85207 8.94268 2.77849 -164.31267 976.97380
2420.0000 -173.60857 -165.11709 8.49147 2.73115 -165.13202 927.72095
2425.0000 -174.98896 -165.45296 9.53600 2.69272 -165.79711 915.45869
2430.0000 -174.79657 -165.61087 9.18570 2.72682 -165.20703 915.52354
2435.0000 -174.02609 -165.53259 8.49350 2.74874 -164.82757 927.27832
2440.0000 -172.63533 -164.55003 8.08530 2.73864 -165.00242 949.60122
2445.0000 -174.53636 -166.22037 8.31599 2.73116 -165.13186 936.71808
2450.0000 -173.42579 -164.86822 8.55757 2.72329 -165.26804 909.15071
2455.0000 -173.70119 -163.62641 10.07477 2.83306 -163.36831 974.02020
2460.0000 -175.10382 -167.36594 7.73788 2.65734 -166.40942 892.01244
2465.0000 -175.83677 -166.50507 9.33170 2.64151 -166.68347 866.12704
2470.0000 -174.16172 -165.24029 8.92143 2.71845 -165.35173 919.14628
2475.0000 -174.61135 -166.33147 8.27988 2.71775 -165.36394 901.32493
2480.0000 -175.42668 -167.34904 8.07765 2.60938 -167.23950 863.46841
2485.0000 -175.06541 -166.05991 9.00550 2.64329 -166.65259 876.19186
2490.0000 -174.80935 -166.33259 8.47676 2.60956 -167.23636 813.97568
2495.0000 -173.39508 -165.98143 7.41365 2.74457 -164.89972 934.72179
2500.0000 -175.05788 -166.82121 8.23667 2.62263 -167.01018 867.24907
FREEZING PROCESS: loop number 11 T-loop= 908.00000000000000
main_MD> interactions number 11 at Temperature= 908.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.98375 0.40539 -1.48773
force_rgl> df(natom) 0.77813 1.39078 -1.13754
2505.0000 -174.44336 -165.88384 8.55952 2.69655 -165.73088 915.34409
2510.0000 -175.18408 -166.58655 8.59753 2.65867 -166.38640 853.26479
2515.0000 -175.79939 -166.59928 9.20012 2.65131 -166.51371 889.77601
2520.0000 -172.98266 -164.15631 8.82635 2.70272 -165.62411 913.98811
2525.0000 -174.94624 -166.42853 8.51771 2.72860 -165.17618 931.87844
2530.0000 -174.45402 -164.97240 9.48162 2.68234 -165.97678 871.46094
2535.0000 -174.94488 -167.75907 7.18581 2.66681 -166.24552 878.92219
2540.0000 -175.99595 -167.59445 8.40150 2.58561 -167.65081 843.59749
2545.0000 -175.35267 -167.68957 7.66310 2.60112 -167.38234 864.63538
2550.0000 -175.83915 -167.25955 8.57961 2.57115 -167.90105 820.60033
2555.0000 -175.30153 -166.89001 8.41152 2.62937 -166.89345 860.16281
2560.0000 -172.98374 -164.66367 8.32007 2.73646 -165.04014 922.98644
2565.0000 -172.25456 -163.88962 8.36494 2.82455 -163.51554 974.25891
2570.0000 -173.25065 -164.03656 9.21409 2.77428 -164.38550 962.81673
2575.0000 -172.91342 -166.35228 6.56113 2.71050 -165.48934 891.44543
2580.0000 -173.69352 -165.73289 7.96063 2.65224 -166.49772 858.00309
2585.0000 -173.90774 -165.89589 8.01185 2.64634 -166.59988 879.97145
2590.0000 -175.26527 -167.05214 8.21314 2.62834 -166.91131 885.62081
2595.0000 -174.68694 -166.22862 8.45832 2.66722 -166.23840 910.30510
2600.0000 -173.97927 -166.33749 7.64178 2.73717 -165.02782 949.87803
2605.0000 -175.92605 -168.10404 7.82201 2.60927 -167.24143 858.86033
2610.0000 -174.10669 -166.09917 8.00752 2.65383 -166.47024 863.96439
2615.0000 -172.77464 -165.41920 7.35543 2.67515 -166.10116 896.87838
2620.0000 -175.70541 -167.11870 8.58672 2.70318 -165.61604 920.85122
2625.0000 -174.88474 -165.89332 8.99142 2.65201 -166.50170 908.14295
2630.0000 -174.29382 -166.08515 8.20866 2.69419 -165.77164 911.59089
2635.0000 -175.65900 -166.82202 8.83699 2.62615 -166.94930 861.21548
2640.0000 -172.86939 -164.95047 7.91892 2.66255 -166.31925 859.76010
2645.0000 -174.58610 -165.47327 9.11283 2.72399 -165.25585 880.26367
2650.0000 -175.41707 -166.39550 9.02157 2.71015 -165.49549 916.83288
2655.0000 -175.51083 -166.61788 8.89295 2.65824 -166.39390 888.63382
2660.0000 -174.44347 -165.03871 9.40475 2.65423 -166.46319 891.50409
2665.0000 -174.46315 -166.36520 8.09794 2.70342 -165.61189 920.89162
2670.0000 -172.01591 -163.91108 8.10483 2.74798 -164.84072 926.75688
2675.0000 -172.06299 -162.79453 9.26846 2.86476 -162.81954 994.72122
2680.0000 -172.98594 -164.66129 8.32465 2.80226 -163.90133 981.72845
2685.0000 -173.38477 -165.12002 8.26475 2.69419 -165.77172 918.01262
2690.0000 -173.82942 -164.37931 9.45011 2.74583 -164.87786 923.57550
2695.0000 -173.59967 -164.31723 9.28244 2.78334 -164.22867 948.54608
2700.0000 -173.60784 -166.12497 7.48287 2.74853 -164.83127 918.54606
2705.0000 -173.98516 -165.77889 8.20627 2.68898 -165.86181 892.36608
2710.0000 -173.38656 -166.91623 6.47034 2.62259 -167.01092 812.48362
2715.0000 -173.80690 -166.54271 7.26419 2.65238 -166.49535 864.53665
2720.0000 -174.87000 -166.72732 8.14268 2.63903 -166.72624 905.00520
2725.0000 -176.25714 -167.22900 9.02814 2.61864 -167.07922 855.68482
2730.0000 -173.90505 -164.43070 9.47436 2.68108 -165.99861 906.63737
2735.0000 -170.58334 -161.78872 8.79462 2.81888 -163.61372 995.91595
2740.0000 -171.88806 -162.80406 9.08400 2.88700 -162.43467 1007.45116
2745.0000 -172.30022 -164.14150 8.15872 2.80593 -163.83778 991.84141
2750.0000 -172.40719 -163.35237 9.05481 2.83686 -163.30244 1000.31444
FREEZING PROCESS: loop number 12 T-loop= 883.00000000000000
main_MD> interactions number 12 at Temperature= 883.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.39929 0.59070 1.48212
force_rgl> df(natom) -0.38365 -1.75715 2.57883
2755.0000 -174.89380 -164.68272 10.21108 2.78518 -164.19696 972.66213
2760.0000 -175.08206 -165.58014 9.50192 2.72066 -165.31349 934.56782
2765.0000 -174.29018 -166.82295 7.46723 2.65642 -166.42532 868.80400
2770.0000 -171.00200 -163.60097 7.40103 2.74092 -164.96298 932.29020
2775.0000 -173.02502 -163.68513 9.33989 2.81518 -163.67763 976.71234
2780.0000 -173.72250 -165.82808 7.89442 2.80643 -163.82918 963.86416
2785.0000 -174.11960 -165.85221 8.26739 2.72186 -165.29270 909.45199
2790.0000 -174.56937 -167.20120 7.36818 2.65752 -166.40635 857.97263
2795.0000 -175.45523 -166.67510 8.78013 2.65361 -166.47394 874.19343
2800.0000 -174.40656 -166.21250 8.19407 2.66385 -166.29676 868.70606
2805.0000 -175.31041 -164.92554 10.38487 2.72598 -165.22148 938.82822
2810.0000 -175.90017 -168.06459 7.83558 2.64792 -166.57242 897.83706
2815.0000 -175.84874 -168.36859 7.48015 2.61384 -167.16221 859.28115
2820.0000 -174.28776 -166.40428 7.88348 2.57966 -167.75381 825.35474
2825.0000 -174.65261 -166.84480 7.80781 2.67438 -166.11444 894.73378
2830.0000 -173.95570 -166.49899 7.45672 2.68375 -165.95229 907.76148
2835.0000 -175.34376 -167.53181 7.81194 2.61716 -167.10484 854.39093
2840.0000 -176.51182 -169.09629 7.41554 2.55188 -168.23466 820.12167
2845.0000 -176.97362 -168.83672 8.13689 2.49928 -169.14499 798.27068
2850.0000 -174.28365 -167.45714 6.82651 2.58733 -167.62108 847.03826
2855.0000 -175.35203 -166.95304 8.39899 2.66944 -166.20003 909.26968
2860.0000 -174.51838 -167.05335 7.46503 2.64148 -166.68394 863.98651
2865.0000 -174.69738 -166.33955 8.35783 2.66890 -166.20930 894.52416
2870.0000 -175.51124 -167.53087 7.98037 2.60124 -167.38028 832.55607
2875.0000 -175.41141 -166.39350 9.01791 2.63702 -166.76113 854.62534
2880.0000 -174.50681 -166.32579 8.18103 2.64012 -166.70743 857.16451
2885.0000 -175.63304 -166.51765 9.11539 2.66985 -166.19285 873.08622
2890.0000 -173.38199 -166.69169 6.69030 2.64390 -166.64198 886.65615
2895.0000 -173.62104 -166.28469 7.33635 2.66816 -166.22221 862.95639
2900.0000 -174.73425 -164.23001 10.50424 2.76558 -164.53619 943.51479
2905.0000 -175.99023 -166.98120 9.00902 2.69191 -165.81116 936.30556
2910.0000 -175.15684 -167.20777 7.94907 2.64243 -166.66747 843.30483
2915.0000 -174.09696 -166.75878 7.33818 2.60959 -167.23589 878.99182
2920.0000 -176.79287 -168.74183 8.05104 2.61774 -167.09474 862.25204
2925.0000 -175.83596 -168.20972 7.62624 2.53744 -168.48448 819.34740
2930.0000 -174.20169 -165.36270 8.83898 2.62548 -166.96075 873.15662
2935.0000 -173.69498 -166.89571 6.79927 2.71356 -165.43650 889.96381
2940.0000 -174.34695 -165.99181 8.35513 2.65534 -166.44407 840.74967
2945.0000 -173.92395 -165.05088 8.87307 2.70333 -165.61349 907.77789
2950.0000 -175.29419 -167.00193 8.29226 2.68176 -165.98671 900.72480
2955.0000 -175.87858 -166.43778 9.44079 2.68294 -165.96629 906.07800
2960.0000 -173.73630 -166.21479 7.52151 2.68168 -165.98811 892.81184
2965.0000 -172.87024 -164.37631 8.49393 2.78080 -164.27265 981.95656
2970.0000 -173.46835 -166.00549 7.46286 2.72409 -165.25426 919.72028
2975.0000 -175.78888 -168.21935 7.56953 2.62970 -166.88788 843.03101
2980.0000 -175.85954 -167.10661 8.75294 2.59809 -167.43488 835.73188
2985.0000 -174.54700 -166.72328 7.82372 2.65092 -166.52056 872.38272
2990.0000 -174.00283 -165.73606 8.26677 2.66760 -166.23185 882.73647
2995.0000 -173.80113 -164.58541 9.21572 2.71296 -165.44677 926.24054
3000.0000 -173.82072 -166.50515 7.31557 2.66519 -166.27350 894.09198
FREEZING PROCESS: loop number 13 T-loop= 858.00000000000000
main_MD> interactions number 13 at Temperature= 858.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.89878 -0.47929 2.84694
force_rgl> df(natom) 1.90502 -0.09537 1.78186
3005.0000 -175.15069 -167.72770 7.42298 2.64140 -166.68529 851.52322
3010.0000 -173.73798 -166.09708 7.64090 2.63610 -166.77700 841.47463
3015.0000 -174.90617 -166.73633 8.16984 2.61589 -167.12687 832.99772
3020.0000 -174.29622 -166.09257 8.20365 2.66313 -166.30925 869.25057
3025.0000 -174.58194 -166.03484 8.54710 2.66584 -166.26229 873.68301
3030.0000 -176.04894 -168.93097 7.11797 2.55337 -168.20880 807.32683
3035.0000 -176.14787 -168.89923 7.24864 2.48689 -169.35940 753.38698
3040.0000 -172.83969 -165.21799 7.62170 2.61141 -167.20426 855.27778
3045.0000 -174.26936 -165.79461 8.47475 2.72660 -165.21068 927.43109
3050.0000 -174.37755 -167.22654 7.15101 2.59313 -167.52069 843.46328
3055.0000 -173.29404 -165.96482 7.32922 2.65445 -166.45937 858.37152
3060.0000 -174.98387 -166.14759 8.83628 2.67903 -166.03410 897.08296
3065.0000 -174.04350 -166.23201 7.81149 2.66875 -166.21199 877.54223
3070.0000 -174.35276 -167.01088 7.34187 2.63208 -166.84662 858.21627
3075.0000 -174.14458 -166.73161 7.41297 2.64762 -166.57762 852.81997
3080.0000 -174.88165 -166.44729 8.43436 2.65327 -166.47987 869.57078
3085.0000 -174.49486 -167.36685 7.12801 2.62688 -166.93666 888.37286
3090.0000 -174.18871 -165.32812 8.86060 2.68101 -165.99983 907.58948
3095.0000 -173.98604 -165.59705 8.38899 2.67486 -166.10629 883.23768
3100.0000 -175.42132 -166.11007 9.31124 2.73890 -164.99784 938.05645
3105.0000 -174.52104 -166.84912 7.67192 2.63715 -166.75894 863.12999
3110.0000 -175.07315 -166.56436 8.50879 2.61358 -167.16674 854.95379
3115.0000 -173.36467 -166.01227 7.35240 2.66651 -166.25077 892.24310
3120.0000 -173.74627 -166.17619 7.57008 2.63051 -166.87374 857.15350
3125.0000 -174.73194 -166.14411 8.58783 2.65546 -166.44193 847.19969
3130.0000 -174.49971 -165.49538 9.00433 2.68332 -165.95979 867.77661
3135.0000 -175.48428 -167.08233 8.40195 2.68729 -165.89116 897.76706
3140.0000 -173.62509 -165.08552 8.53956 2.67452 -166.11217 858.23409
3145.0000 -174.38462 -167.17213 7.21249 2.69923 -165.68442 891.56823
3150.0000 -173.22909 -164.79502 8.43407 2.72580 -165.22456 921.16121
3155.0000 -175.94799 -166.43754 9.51046 2.67641 -166.07947 895.79580
3160.0000 -174.85170 -165.96261 8.88909 2.66378 -166.29801 906.12195
3165.0000 -176.23201 -166.95511 9.27689 2.64782 -166.57426 879.36020
3170.0000 -175.64767 -167.09445 8.55322 2.64037 -166.70305 885.81787
3175.0000 -174.94934 -167.93709 7.01225 2.57284 -167.87182 820.53270
3180.0000 -174.70654 -166.44845 8.25809 2.65921 -166.37699 887.50197
3185.0000 -174.70381 -166.64647 8.05734 2.66160 -166.33578 852.87482
3190.0000 -174.77629 -166.28321 8.49307 2.67231 -166.15030 880.61382
3195.0000 -175.94917 -167.76182 8.18734 2.67288 -166.14046 887.25654
3200.0000 -176.03315 -167.51961 8.51354 2.57873 -167.76990 834.35890
3205.0000 -172.89126 -164.63606 8.25520 2.71275 -165.45047 905.01081
3210.0000 -174.85198 -165.20897 9.64301 2.69645 -165.73256 908.78302
3215.0000 -173.27015 -165.50105 7.76910 2.73080 -165.13808 928.06857
3220.0000 -174.98636 -167.41770 7.56866 2.66989 -166.19223 901.52773
3225.0000 -176.61281 -168.46241 8.15039 2.58397 -167.67927 847.01739
3230.0000 -173.85128 -166.16819 7.68309 2.64848 -166.56270 860.20457
3235.0000 -173.74312 -166.32784 7.41527 2.67708 -166.06771 876.80249
3240.0000 -174.11877 -165.42011 8.69867 2.71627 -165.38960 903.08611
3245.0000 -173.76224 -165.04320 8.71905 2.71034 -165.49213 898.39587
3250.0000 -173.68701 -163.06907 10.61794 2.78372 -164.22222 992.23185
FREEZING PROCESS: loop number 14 T-loop= 833.00000000000000
main_MD> interactions number 14 at Temperature= 833.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 4.09263 -1.61540 4.01173
force_rgl> df(natom) -1.02629 1.64824 2.86537
3255.0000 -174.75346 -166.62263 8.13083 2.76958 -164.46695 983.48534
3260.0000 -176.22869 -169.61637 6.61232 2.52848 -168.63961 791.45712
3265.0000 -174.91236 -167.42780 7.48456 2.55745 -168.13826 830.20717
3270.0000 -176.07824 -167.98752 8.09072 2.60244 -167.35956 857.57428
3275.0000 -174.62642 -168.59216 6.03425 2.56373 -168.02954 794.99759
3280.0000 -175.71341 -167.58131 8.13210 2.62693 -166.93575 842.45884
3285.0000 -175.50004 -168.56763 6.93241 2.55498 -168.18097 817.95266
3290.0000 -175.65680 -167.19491 8.46189 2.57861 -167.77193 830.94060
3295.0000 -175.94775 -168.54032 7.40743 2.55584 -168.16609 826.07507
3300.0000 -176.72215 -169.74828 6.97387 2.49997 -169.13298 789.11089
3305.0000 -174.97525 -167.55535 7.41990 2.57581 -167.82038 826.54268
3310.0000 -174.73580 -168.13886 6.59694 2.56304 -168.04146 816.14051
3315.0000 -177.00505 -170.46089 6.54417 2.48276 -169.43084 792.17596
3320.0000 -176.46011 -170.00774 6.45236 2.45050 -169.98913 761.03788
3325.0000 -175.36151 -167.61036 7.75116 2.48806 -169.33911 787.53408
3330.0000 -174.37150 -167.98528 6.38622 2.60246 -167.35919 847.54958
3335.0000 -176.18403 -168.73681 7.44722 2.53557 -168.51687 795.82795
3340.0000 -176.50315 -168.60309 7.90005 2.52039 -168.77955 791.05923
3345.0000 -174.39755 -165.25656 9.14099 2.64738 -166.58185 874.45676
3350.0000 -175.19864 -167.39313 7.80551 2.66547 -166.26872 879.90411
3355.0000 -175.52254 -167.75592 7.76662 2.58761 -167.61630 846.02514
3360.0000 -174.03671 -166.18711 7.84960 2.59203 -167.53980 829.28440
3365.0000 -174.91515 -166.55008 8.36507 2.63802 -166.74381 872.83119
3370.0000 -175.13542 -166.83738 8.29805 2.57810 -167.78092 813.58612
3375.0000 -176.44829 -168.70655 7.74174 2.59673 -167.45848 858.90351
3380.0000 -175.22092 -167.50629 7.71464 2.53314 -168.55890 804.68741
3385.0000 -175.10197 -167.99452 7.10745 2.60325 -167.34560 857.49439
3390.0000 -174.66723 -167.12849 7.53874 2.61676 -167.11177 874.48562
3395.0000 -175.76278 -167.56872 8.19405 2.61462 -167.14874 856.97389
3400.0000 -175.90879 -167.35686 8.55193 2.60922 -167.24217 830.90556
3405.0000 -174.29181 -167.10531 7.18650 2.59524 -167.48422 845.24158
3410.0000 -175.91977 -168.41091 7.50887 2.62716 -166.93172 890.17867
3415.0000 -174.56641 -164.93501 9.63140 2.64344 -166.64997 867.29740
3420.0000 -175.21660 -167.05001 8.16658 2.65028 -166.53159 873.77559
3425.0000 -174.91359 -166.65445 8.25914 2.62994 -166.88363 872.86840
3430.0000 -173.55900 -165.26873 8.29027 2.72132 -165.30219 932.64932
3435.0000 -173.32564 -165.16835 8.15729 2.72958 -165.15921 905.65029
3440.0000 -175.17885 -168.21474 6.96411 2.62343 -166.99639 845.57744
3445.0000 -176.67017 -169.31710 7.35307 2.56254 -168.05008 806.75977
3450.0000 -176.29153 -167.56417 8.72737 2.54998 -168.26746 811.64401
3455.0000 -176.32808 -168.82868 7.49940 2.58589 -167.64609 839.59546
3460.0000 -176.37810 -169.51637 6.86173 2.48984 -169.30837 787.51995
3465.0000 -174.82134 -166.75989 8.06145 2.57560 -167.82405 844.03167
3470.0000 -174.76917 -167.49816 7.27101 2.62141 -167.03129 876.08708
3475.0000 -175.50972 -167.41102 8.09870 2.62732 -166.92892 867.70403
3480.0000 -176.77864 -169.31633 7.46231 2.53652 -168.50038 816.45359
3485.0000 -176.96949 -169.75080 7.21869 2.49783 -169.17007 765.23749
3490.0000 -176.36750 -168.97121 7.39629 2.47138 -169.62783 756.84696
3495.0000 -175.23576 -168.26633 6.96943 2.49975 -169.13681 786.31736
3500.0000 -174.35518 -165.79187 8.56331 2.62077 -167.04233 856.94081
FREEZING PROCESS: loop number 15 T-loop= 808.00000000000000
main_MD> interactions number 15 at Temperature= 808.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.73389 2.59032 -0.13561
force_rgl> df(natom) 0.80193 -0.28841 -1.17290
3505.0000 -175.77355 -167.75099 8.02256 2.64478 -166.62674 880.17844
3510.0000 -175.79537 -167.18798 8.60739 2.59256 -167.53056 815.61780
3515.0000 -176.65736 -169.43658 7.22078 2.55664 -168.15221 826.99123
3520.0000 -175.94508 -169.10226 6.84281 2.51865 -168.80979 806.78293
3525.0000 -177.26840 -169.28267 7.98573 2.45393 -169.92976 747.04678
3530.0000 -174.80513 -168.12827 6.67687 2.49873 -169.15453 784.75670
3535.0000 -176.47014 -167.89933 8.57082 2.55758 -168.13597 819.30971
3540.0000 -174.79292 -167.53600 7.25692 2.54414 -168.36860 810.45875
3545.0000 -176.87078 -169.04961 7.82117 2.51599 -168.85578 783.45262
3550.0000 -177.02193 -168.68942 8.33252 2.56342 -168.03486 820.68894
3555.0000 -175.21301 -168.92837 6.28464 2.50641 -169.02153 786.65999
3560.0000 -175.99564 -168.89788 7.09776 2.52905 -168.62972 783.45808
3565.0000 -176.84618 -169.04110 7.80508 2.53342 -168.55406 791.42045
3570.0000 -175.14353 -167.70512 7.43841 2.55830 -168.12349 819.37270
3575.0000 -175.36568 -167.21873 8.14695 2.59589 -167.47294 848.92159
3580.0000 -173.70372 -165.97823 7.72548 2.62887 -166.90208 859.92462
3585.0000 -174.65535 -167.15101 7.50434 2.62746 -166.92663 839.15149
3590.0000 -176.53101 -168.51275 8.01826 2.57222 -167.88266 812.58011
3595.0000 -177.73897 -168.63233 9.10663 2.54051 -168.43138 824.47557
3600.0000 -176.68646 -169.50040 7.18606 2.48971 -169.31059 770.99194
3605.0000 -176.88031 -168.92421 7.95610 2.52437 -168.71077 808.07830
3610.0000 -174.72185 -166.45056 8.27129 2.60778 -167.26723 838.60516
3615.0000 -173.85463 -166.85134 7.00329 2.62045 -167.04792 846.53706
3620.0000 -175.54285 -168.55251 6.99034 2.57954 -167.75588 789.04907
3625.0000 -176.66244 -168.78701 7.87543 2.52540 -168.69295 793.40989
3630.0000 -175.23434 -168.29465 6.93969 2.56374 -168.02930 819.85164
3635.0000 -175.29891 -168.03428 7.26463 2.56685 -167.97546 828.86819
3640.0000 -174.25419 -167.11841 7.13578 2.60608 -167.29665 845.19123
3645.0000 -175.70942 -167.80853 7.90089 2.59973 -167.40643 856.58668
3650.0000 -174.19127 -167.24220 6.94906 2.55869 -168.11681 802.60656
3655.0000 -175.01103 -167.91536 7.09567 2.62197 -167.02165 848.32992
3660.0000 -174.70941 -167.09940 7.61002 2.61914 -167.07061 826.29007
3665.0000 -175.00297 -167.52330 7.47968 2.62524 -166.96499 874.15712
3670.0000 -175.38076 -167.57096 7.80980 2.59019 -167.57152 841.19703
3675.0000 -173.86513 -166.19596 7.66917 2.63308 -166.82931 876.06692
3680.0000 -174.54308 -167.58410 6.95898 2.58583 -167.64707 849.60029
3685.0000 -176.40469 -168.85817 7.54652 2.56718 -167.96984 832.83713
3690.0000 -176.33016 -169.51329 6.81686 2.51482 -168.87609 803.19619
3695.0000 -175.92909 -168.01292 7.91617 2.47128 -169.62952 778.06093
3700.0000 -176.62757 -168.78248 7.84509 2.51275 -168.91179 775.38125
3705.0000 -175.36836 -167.54965 7.81872 2.56961 -167.92774 798.60352
3710.0000 -174.78628 -166.73082 8.05546 2.61054 -167.21941 850.78362
3715.0000 -175.74566 -169.32931 6.41636 2.56456 -168.01516 813.04718
3720.0000 -177.02966 -169.21187 7.81779 2.50995 -168.96032 768.02803
3725.0000 -177.34416 -170.80473 6.53944 2.47210 -169.61536 765.11407
3730.0000 -175.72996 -168.52752 7.20245 2.48402 -169.40909 794.50814
3735.0000 -174.56224 -166.55899 8.00326 2.57531 -167.82909 817.90048
3740.0000 -174.78659 -166.98711 7.79949 2.62398 -166.98681 865.06552
3745.0000 -174.53097 -166.97058 7.56039 2.64350 -166.64891 859.97031
3750.0000 -174.89667 -167.42013 7.47653 2.60214 -167.36478 846.84427
FREEZING PROCESS: loop number 16 T-loop= 783.00000000000000
main_MD> interactions number 16 at Temperature= 783.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.00433 3.76958 -1.03487
force_rgl> df(natom) 0.90348 -3.76229 3.61628
3755.0000 -176.06364 -167.99426 8.06938 2.54398 -168.37128 789.57456
3760.0000 -175.58315 -168.04402 7.53913 2.54416 -168.36815 815.32529
3765.0000 -174.46915 -166.83467 7.63448 2.58434 -167.67284 825.02770
3770.0000 -175.28934 -168.44865 6.84069 2.62336 -166.99749 846.04433
3775.0000 -174.55680 -167.78762 6.76919 2.52398 -168.71752 784.06520
3780.0000 -176.44093 -169.51600 6.92494 2.51346 -168.89949 771.91491
3785.0000 -177.33808 -170.81574 6.52234 2.47007 -169.65044 760.60177
3790.0000 -177.59415 -169.63583 7.95832 2.38455 -171.13062 706.71064
3795.0000 -174.66849 -167.82219 6.84631 2.50502 -169.04563 776.20457
3800.0000 -174.77490 -167.62565 7.14925 2.53845 -168.46711 824.87492
3805.0000 -175.44467 -168.13139 7.31327 2.56265 -168.04826 789.56148
3810.0000 -175.89633 -168.21048 7.68585 2.53273 -168.56604 805.22087
3815.0000 -176.97372 -169.99506 6.97867 2.49207 -169.26968 770.25105
3820.0000 -176.80390 -169.29639 7.50751 2.45649 -169.88560 746.65251
3825.0000 -176.02521 -168.15368 7.87153 2.53865 -168.46354 809.35710
3830.0000 -175.59893 -169.02505 6.57388 2.55186 -168.23501 829.35270
3835.0000 -176.04156 -168.95341 7.08815 2.49621 -169.19810 758.42926
3840.0000 -176.12299 -169.64056 6.48243 2.47122 -169.63062 770.91535
3845.0000 -178.24969 -171.91973 6.32995 2.43282 -170.29523 729.34219
3850.0000 -177.74898 -172.02886 5.72012 2.36964 -171.38866 699.28598
3855.0000 -178.26813 -171.59780 6.67033 2.38603 -171.10502 718.46832
3860.0000 -178.37447 -171.49443 6.88005 2.40041 -170.85609 725.88418
3865.0000 -176.85073 -170.35714 6.49359 2.32398 -172.17885 638.04426
3870.0000 -177.50671 -170.66135 6.84536 2.43461 -170.26421 734.98058
3875.0000 -175.08347 -169.18664 5.89683 2.43043 -170.33652 749.56113
3880.0000 -176.72381 -169.11232 7.61149 2.46610 -169.71922 756.12783
3885.0000 -175.26627 -167.46789 7.79837 2.58118 -167.72751 828.71890
3890.0000 -175.63068 -168.32655 7.30412 2.56685 -167.97560 805.82311
3895.0000 -177.29078 -171.77851 5.51227 2.42184 -170.48520 717.68104
3900.0000 -178.28412 -170.44130 7.84282 2.37843 -171.23656 715.91087
3905.0000 -175.25233 -167.47306 7.77927 2.47659 -169.53772 745.77405
3910.0000 -176.42230 -168.46169 7.96061 2.60215 -167.36458 840.82834
3915.0000 -176.19505 -168.50303 7.69202 2.50897 -168.97730 772.08473
3920.0000 -176.91628 -170.66339 6.25289 2.45849 -169.85086 763.77947
3925.0000 -177.52081 -169.65766 7.86315 2.44093 -170.15492 742.65654
3930.0000 -177.14462 -170.77774 6.36688 2.46548 -169.72990 762.71028
3935.0000 -176.04618 -168.05443 7.99176 2.50727 -169.00661 779.88239
3940.0000 -176.06579 -168.64905 7.41674 2.53424 -168.53999 821.18113
3945.0000 -176.26491 -168.79119 7.47372 2.53386 -168.54648 788.28962
3950.0000 -177.16164 -169.88677 7.27487 2.49684 -169.18724 779.12891
3955.0000 -177.51364 -171.38460 6.12904 2.41388 -170.62291 722.22806
3960.0000 -177.66030 -170.31265 7.34765 2.38603 -171.10495 706.30669
3965.0000 -175.62469 -168.57464 7.05004 2.47846 -169.50534 749.82120
3970.0000 -176.48501 -169.27989 7.20512 2.54621 -168.33271 801.18404
3975.0000 -175.70827 -168.68929 7.01899 2.50316 -169.07784 767.21986
3980.0000 -175.07594 -167.28584 7.79010 2.56490 -168.00928 798.20019
3985.0000 -175.04628 -165.61711 9.42917 2.60610 -167.29631 839.30420
3990.0000 -176.40042 -168.56827 7.83215 2.58877 -167.59625 834.79574
3995.0000 -175.95334 -168.39346 7.55989 2.57616 -167.81433 850.16515
4000.0000 -175.80037 -168.54018 7.26019 2.47626 -169.54330 767.69587
FREEZING PROCESS: loop number 17 T-loop= 758.00000000000000
main_MD> interactions number 17 at Temperature= 758.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -4.02055 0.59190 0.03049
force_rgl> df(natom) -0.31329 0.51181 -1.98975
4005.0000 -174.69143 -168.00218 6.68926 2.56224 -168.05531 822.54583
4010.0000 -176.30760 -168.58429 7.72331 2.52772 -168.65279 802.67912
4015.0000 -175.66117 -169.57783 6.08335 2.51935 -168.79755 761.44848
4020.0000 -176.58105 -169.29547 7.28558 2.49926 -169.14524 768.83354
4025.0000 -177.75588 -169.23645 8.51943 2.52552 -168.69091 799.31946
4030.0000 -176.96856 -169.81097 7.15759 2.47275 -169.60415 756.88678
4035.0000 -175.87836 -168.22581 7.65255 2.48651 -169.36605 764.54925
4040.0000 -176.28591 -168.08194 8.20397 2.55289 -168.21717 803.64629
4045.0000 -176.42780 -168.64244 7.78536 2.51230 -168.91960 766.82365
4050.0000 -175.21978 -167.37185 7.84793 2.54978 -168.27105 806.82184
4055.0000 -176.07903 -168.49740 7.58163 2.53606 -168.50845 827.40891
4060.0000 -175.35614 -167.27518 8.08096 2.55469 -168.18599 810.89385
4065.0000 -175.37653 -168.69669 6.67984 2.56020 -168.09060 837.54031
4070.0000 -175.27358 -167.66878 7.60481 2.53783 -168.47777 772.07979
4075.0000 -176.81519 -169.98997 6.82522 2.53106 -168.59488 793.64750
4080.0000 -177.36474 -170.75068 6.61406 2.39804 -170.89709 725.41623
4085.0000 -177.35331 -170.71360 6.63970 2.40920 -170.70396 687.96834
4090.0000 -176.35994 -170.64476 5.71518 2.43413 -170.27255 703.55548
4095.0000 -176.02059 -169.23056 6.79003 2.45181 -169.96653 719.65029
4100.0000 -174.87911 -168.07878 6.80033 2.54924 -168.28030 789.14896
4105.0000 -177.76736 -171.19160 6.57577 2.50074 -169.11973 799.37663
4110.0000 -176.55014 -169.38179 7.16835 2.42301 -170.46505 741.87949
4115.0000 -176.03986 -169.10227 6.93759 2.52350 -168.72581 781.35074
4120.0000 -176.07720 -169.15720 6.92000 2.50247 -169.08976 774.85399
4125.0000 -178.03952 -170.81765 7.22187 2.48107 -169.46006 762.70191
4130.0000 -177.95015 -170.60867 7.34148 2.39874 -170.88500 736.89117
4135.0000 -177.73513 -171.02649 6.70864 2.41258 -170.64545 717.27946
4140.0000 -176.23537 -169.74333 6.49205 2.44451 -170.09289 741.96689
4145.0000 -177.02746 -169.56818 7.45928 2.49266 -169.25956 763.16108
4150.0000 -177.29788 -169.86687 7.43101 2.47606 -169.54677 742.11429
4155.0000 -176.39323 -170.02160 6.37163 2.43569 -170.24551 718.45049
4160.0000 -176.50825 -169.10396 7.40428 2.46466 -169.74422 762.72966
4165.0000 -177.30903 -169.40669 7.90234 2.50712 -169.00928 790.89196
4170.0000 -175.51932 -169.32806 6.19127 2.47610 -169.54613 779.22494
4175.0000 -175.38873 -168.11388 7.27485 2.54746 -168.31119 803.82370
4180.0000 -176.36277 -169.88043 6.48233 2.48511 -169.39028 744.47347
4185.0000 -175.12080 -167.47942 7.64138 2.49923 -169.14585 766.52152
4190.0000 -176.32563 -168.42031 7.90532 2.50342 -169.07333 759.75790
4195.0000 -176.66050 -169.15169 7.50880 2.51375 -168.89462 764.92634
4200.0000 -175.65681 -168.56938 7.08743 2.50585 -169.03121 804.50138
4205.0000 -176.74084 -170.03618 6.70465 2.47226 -169.61259 762.58155
4210.0000 -178.07988 -171.58665 6.49323 2.40594 -170.76047 733.18840
4215.0000 -176.82613 -169.55597 7.27016 2.44135 -170.14749 759.52027
4220.0000 -177.51740 -169.99943 7.51797 2.48311 -169.42482 756.60747
4225.0000 -176.42561 -168.96249 7.46312 2.48967 -169.31138 778.87647
4230.0000 -177.67182 -170.25232 7.41950 2.46071 -169.81256 755.51563
4235.0000 -176.44660 -169.41196 7.03464 2.44205 -170.13549 748.59992
4240.0000 -177.53117 -169.80749 7.72368 2.46811 -169.68437 752.09104
4245.0000 -177.50351 -170.66712 6.83639 2.46595 -169.72180 763.69470
4250.0000 -177.72577 -170.70254 7.02323 2.37891 -171.22817 704.59496
FREEZING PROCESS: loop number 18 T-loop= 733.00000000000000
main_MD> interactions number 18 at Temperature= 733.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.11862 -3.84862 -0.33731
force_rgl> df(natom) 2.75868 2.81885 1.93302
4255.0000 -177.03391 -169.71120 7.32271 2.44890 -170.01697 757.13279
4260.0000 -177.47305 -171.01636 6.45670 2.41483 -170.60650 720.42476
4265.0000 -176.90202 -170.45752 6.44449 2.39937 -170.87419 708.05732
4270.0000 -176.68235 -169.24577 7.43658 2.45895 -169.84293 785.65885
4275.0000 -177.33066 -170.57998 6.75068 2.45770 -169.86456 749.07833
4280.0000 -176.61684 -170.33395 6.28289 2.39415 -170.96441 697.00527
4285.0000 -177.14459 -169.75423 7.39036 2.45771 -169.86444 740.03244
4290.0000 -175.78145 -169.36560 6.41584 2.44823 -170.02843 744.39294
4295.0000 -178.96485 -172.36204 6.60280 2.37335 -171.32438 696.17006
4300.0000 -177.58866 -171.22105 6.36761 2.38152 -171.18297 704.00973
4305.0000 -177.49001 -170.30746 7.18254 2.42709 -170.39440 720.69140
4310.0000 -176.18727 -169.60689 6.58038 2.45020 -169.99447 742.25796
4315.0000 -176.07173 -169.16653 6.90521 2.49714 -169.18204 767.37285
4320.0000 -176.12353 -169.03917 7.08437 2.54118 -168.41986 802.37540
4325.0000 -177.49495 -171.61009 5.88486 2.44822 -170.02873 763.86350
4330.0000 -178.57238 -170.07249 8.49989 2.40821 -170.72107 740.94872
4335.0000 -175.41396 -168.87044 6.54352 2.46714 -169.70116 760.99309
4340.0000 -176.95874 -170.72465 6.23409 2.42449 -170.43943 720.67754
4345.0000 -177.28360 -171.25046 6.03313 2.40597 -170.75982 733.67629
4350.0000 -177.88231 -171.69004 6.19226 2.33126 -172.05289 673.31473
4355.0000 -178.31952 -171.25485 7.06467 2.34671 -171.78557 679.54518
4360.0000 -178.70971 -171.91810 6.79161 2.37529 -171.29094 716.90300
4365.0000 -177.77802 -171.32692 6.45110 2.38047 -171.20123 705.93858
4370.0000 -177.88341 -171.54249 6.34092 2.38476 -171.12698 713.93053
4375.0000 -177.65135 -171.25326 6.39809 2.37297 -171.33104 711.73504
4380.0000 -177.35494 -170.03211 7.32282 2.39688 -170.91727 735.18045
4385.0000 -175.04956 -168.73874 6.31082 2.47701 -169.53047 788.26376
4390.0000 -176.68548 -169.91018 6.77531 2.55024 -168.26302 835.73904
4395.0000 -178.07214 -171.48304 6.58910 2.44766 -170.03844 752.77708
4400.0000 -176.23465 -169.93067 6.30398 2.38168 -171.18021 698.20546
4405.0000 -176.09324 -169.21791 6.87532 2.47103 -169.63381 760.79643
4410.0000 -176.65338 -169.68452 6.96886 2.46044 -169.81720 742.45766
4415.0000 -177.05705 -170.89146 6.16560 2.41527 -170.59897 712.54046
4420.0000 -177.32607 -169.49829 7.82778 2.46916 -169.66629 756.95902
4425.0000 -177.65617 -170.46923 7.18694 2.43855 -170.19597 740.10221
4430.0000 -177.72684 -169.52038 8.20646 2.43632 -170.23467 739.17230
4435.0000 -176.38713 -170.15701 6.23012 2.47583 -169.55083 723.64180
4440.0000 -176.29378 -168.28078 8.01300 2.50295 -169.08138 760.97186
4445.0000 -178.01956 -170.33206 7.68750 2.47552 -169.55624 775.80458
4450.0000 -176.61566 -170.79027 5.82539 2.42141 -170.49267 726.79028
4455.0000 -176.24192 -169.46418 6.77774 2.45841 -169.85235 746.21770
4460.0000 -177.47471 -170.72762 6.74709 2.42813 -170.37634 769.10165
4465.0000 -177.20517 -170.16057 7.04459 2.42765 -170.38461 714.77694
4470.0000 -176.92764 -169.79336 7.13428 2.44492 -170.08576 743.59851
4475.0000 -176.91204 -170.43294 6.47910 2.47739 -169.52384 769.10997
4480.0000 -178.40774 -171.22368 7.18405 2.39790 -170.89948 707.43270
4485.0000 -177.51836 -170.73512 6.78324 2.39886 -170.88292 689.28676
4490.0000 -176.67560 -170.69165 5.98395 2.41845 -170.54391 731.48979
4495.0000 -177.51571 -170.41863 7.09709 2.41585 -170.58889 698.87377
4500.0000 -175.87452 -170.44960 5.42493 2.47955 -169.48644 758.95266
FREEZING PROCESS: loop number 19 T-loop= 708.00000000000000
main_MD> interactions number 19 at Temperature= 708.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.55054 -0.44467 -1.38384
force_rgl> df(natom) 1.42199 -0.57439 -0.16309
4505.0000 -175.95450 -169.36538 6.58912 2.43326 -170.28757 715.79911
4510.0000 -177.99632 -170.52261 7.47370 2.42586 -170.41563 765.70008
4515.0000 -177.46690 -170.39925 7.06765 2.41337 -170.63187 737.94027
4520.0000 -176.64018 -169.83833 6.80184 2.44170 -170.14149 732.26765
4525.0000 -177.45901 -170.17747 7.28154 2.46251 -169.78139 743.27666
4530.0000 -177.95494 -170.84375 7.11119 2.40649 -170.75087 719.55767
4535.0000 -176.56846 -169.14987 7.41859 2.44405 -170.10090 735.55822
4540.0000 -177.45024 -170.98986 6.46038 2.45990 -169.82661 767.36428
4545.0000 -177.80057 -171.27419 6.52639 2.38673 -171.09295 684.81990
4550.0000 -178.41309 -172.32091 6.09219 2.35528 -171.63716 675.65080
4555.0000 -176.73512 -170.61211 6.12301 2.34389 -171.83434 692.01559
4560.0000 -178.29195 -171.41463 6.87732 2.42303 -170.46463 714.18848
4565.0000 -178.04530 -170.96946 7.07583 2.38984 -171.03901 698.60064
4570.0000 -177.18132 -171.32339 5.85793 2.38013 -171.20703 697.36795
4575.0000 -179.04320 -171.64658 7.39662 2.35431 -171.65392 665.54242
4580.0000 -178.00949 -172.31229 5.69720 2.33856 -171.92656 674.47740
4585.0000 -178.51308 -171.84048 6.67260 2.35669 -171.61272 691.69199
4590.0000 -178.17175 -171.04441 7.12734 2.35628 -171.61992 657.79634
4595.0000 -178.31855 -170.09490 8.22365 2.43009 -170.34237 753.82888
4600.0000 -177.46284 -170.79010 6.67274 2.40314 -170.80895 714.84510
4605.0000 -177.98752 -171.67277 6.31475 2.35166 -171.69976 683.47030
4610.0000 -177.14917 -170.35736 6.79181 2.35726 -171.60297 690.30345
4615.0000 -178.26812 -171.86379 6.40433 2.39426 -170.96247 723.26966
4620.0000 -178.18349 -172.25907 5.92442 2.33076 -172.06161 663.65592
4625.0000 -179.56713 -172.69363 6.87350 2.28590 -172.83788 638.92529
4630.0000 -177.56246 -170.33721 7.22525 2.34799 -171.76331 686.50198
4635.0000 -176.64850 -170.60092 6.04758 2.42998 -170.34440 729.02562
4640.0000 -177.05316 -171.39336 5.65980 2.37653 -171.26940 697.63279
4645.0000 -178.37554 -170.81081 7.56473 2.38492 -171.12428 701.63632
4650.0000 -177.06315 -171.22133 5.84183 2.35791 -171.59160 709.13215
4655.0000 -177.15114 -171.15699 5.99415 2.40241 -170.82159 692.72324
4660.0000 -177.52228 -171.62550 5.89677 2.37877 -171.23062 670.43417
4665.0000 -177.48529 -171.45649 6.02880 2.35786 -171.59247 680.18156
4670.0000 -178.03017 -170.63590 7.39427 2.36314 -171.50123 708.57252
4675.0000 -177.75323 -170.02441 7.72883 2.42765 -170.38469 738.58964
4680.0000 -175.73196 -168.29821 7.43375 2.47683 -169.53352 774.50223
4685.0000 -176.69906 -170.28836 6.41069 2.48057 -169.46877 742.62356
4690.0000 -176.77625 -170.41813 6.35812 2.44069 -170.15891 705.04007
4695.0000 -177.41647 -171.31533 6.10114 2.39539 -170.94297 701.28484
4700.0000 -177.91639 -171.01646 6.89993 2.38424 -171.13593 704.71451
4705.0000 -176.65145 -170.24951 6.40194 2.39266 -170.99016 722.28428
4710.0000 -177.51215 -170.61124 6.90091 2.42223 -170.47851 716.24110
4715.0000 -178.25478 -171.06646 7.18832 2.40368 -170.79958 718.96628
4720.0000 -176.21402 -170.03680 6.17722 2.44265 -170.12514 738.76401
4725.0000 -177.08188 -170.76288 6.31900 2.42825 -170.37423 740.85499
4730.0000 -176.95271 -169.70690 7.24581 2.40770 -170.72998 717.09577
4735.0000 -177.72300 -170.18402 7.53898 2.45272 -169.95083 764.90570
4740.0000 -176.50894 -169.52758 6.98136 2.46549 -169.72980 748.21323
4745.0000 -176.66490 -169.74407 6.92083 2.47484 -169.56789 757.49703
4750.0000 -176.58239 -170.35431 6.22808 2.43522 -170.25366 736.08246
FREEZING PROCESS: loop number 20 T-loop= 683.00000000000000
main_MD> interactions number 20 at Temperature= 683.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.83732 0.23449 -0.28145
force_rgl> df(natom) 0.96664 1.54173 -0.51034
4755.0000 -178.52028 -171.22312 7.29716 2.41719 -170.56567 726.23570
4760.0000 -177.86977 -172.25056 5.61921 2.35858 -171.58010 679.45323
4765.0000 -176.91422 -170.51225 6.40197 2.35961 -171.56231 687.61695
4770.0000 -178.66485 -170.56529 8.09956 2.41347 -170.63004 709.07380
4775.0000 -177.73103 -172.22905 5.50197 2.34539 -171.80836 676.76641
4780.0000 -177.78810 -170.30801 7.48009 2.36747 -171.42628 687.38756
4785.0000 -179.39441 -172.96795 6.42646 2.36435 -171.48020 704.47026
4790.0000 -179.21913 -173.05937 6.15975 2.25851 -173.31194 618.62969
4795.0000 -178.39189 -171.09077 7.30112 2.31825 -172.27810 691.01329
4800.0000 -177.18287 -170.50833 6.67454 2.40107 -170.84465 739.99452
4805.0000 -178.78466 -172.14093 6.64372 2.38252 -171.16569 705.76194
4810.0000 -177.57378 -171.10235 6.47142 2.35358 -171.66660 698.33536
4815.0000 -177.61778 -171.00313 6.61464 2.44331 -170.11360 729.15563
4820.0000 -177.80157 -172.19535 5.60622 2.34695 -171.78128 680.81328
4825.0000 -178.55241 -171.82379 6.72862 2.34614 -171.79537 682.87730
4830.0000 -177.39424 -171.45540 5.93884 2.38038 -171.20269 697.84052
4835.0000 -177.83598 -171.10586 6.73012 2.35510 -171.64021 707.86620
4840.0000 -178.06767 -172.09996 5.96771 2.34713 -171.77829 685.54635
4845.0000 -178.09625 -172.15435 5.94190 2.36059 -171.54528 698.54717
4850.0000 -177.66914 -171.27951 6.38963 2.35076 -171.71540 668.66986
4855.0000 -178.10489 -171.87076 6.23413 2.41494 -170.60468 706.34079
4860.0000 -178.53190 -171.65942 6.87248 2.33839 -171.92944 669.30777
4865.0000 -179.25567 -171.94119 7.31448 2.35715 -171.60488 700.34367
4870.0000 -178.91012 -171.79787 7.11224 2.32426 -172.17410 654.62416
4875.0000 -178.70456 -171.95489 6.74967 2.33415 -172.00294 665.86792
4880.0000 -177.47787 -171.98097 5.49690 2.33397 -172.00592 666.64421
4885.0000 -178.63673 -171.94334 6.69339 2.33544 -171.98062 668.07028
4890.0000 -176.97604 -171.80028 5.17577 2.35615 -171.62204 689.85691
4895.0000 -177.48533 -171.67978 5.80555 2.33435 -171.99942 645.12589
4900.0000 -178.25781 -172.26515 5.99266 2.30819 -172.45216 659.76235
4905.0000 -177.43339 -171.62843 5.80497 2.35289 -171.67851 686.49992
4910.0000 -179.41595 -172.62155 6.79439 2.30681 -172.47597 645.72749
4915.0000 -177.92960 -171.67716 6.25244 2.32207 -172.21187 642.44185
4920.0000 -177.02784 -169.48856 7.53928 2.39469 -170.95515 708.86336
4925.0000 -178.97859 -172.11268 6.86591 2.43915 -170.18572 765.19458
4930.0000 -177.56094 -170.73566 6.82529 2.37950 -171.21798 715.41608
4935.0000 -177.59834 -170.76416 6.83418 2.39558 -170.93963 722.59337
4940.0000 -177.45264 -172.02154 5.43110 2.39370 -170.97225 687.69648
4945.0000 -178.07027 -172.47949 5.59078 2.31888 -172.26710 677.40122
4950.0000 -178.10448 -171.60629 6.49819 2.34372 -171.83731 682.61609
4955.0000 -177.66192 -170.83045 6.83147 2.41186 -170.65787 708.56884
4960.0000 -177.04501 -169.63162 7.41340 2.41735 -170.56288 725.62141
4965.0000 -177.93560 -171.68823 6.24737 2.41289 -170.64007 746.44994
4970.0000 -177.08288 -171.13800 5.94487 2.38969 -171.04165 700.90333
4975.0000 -178.00831 -172.09219 5.91612 2.34877 -171.74986 693.81010
4980.0000 -178.90990 -172.91804 5.99186 2.28764 -172.80791 635.26406
4985.0000 -178.36368 -171.70428 6.65940 2.32631 -172.13850 664.63154
4990.0000 -179.67189 -173.36808 6.30380 2.33854 -171.92688 677.59729
4995.0000 -178.28080 -171.92879 6.35201 2.26594 -173.18339 631.24964
5000.0000 -176.12039 -169.06224 7.05816 2.42892 -170.36266 743.44028
FREEZING PROCESS: loop number 21 T-loop= 658.00000000000000
main_MD> interactions number 21 at Temperature= 658.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.66471 0.57702 -1.26862
force_rgl> df(natom) 8.42542 -2.14172 3.44893
5005.0000 -178.18874 -171.63250 6.55624 2.42332 -170.45970 739.40037
5010.0000 -178.36743 -172.46512 5.90231 2.32349 -172.18742 642.50957
5015.0000 -178.74898 -173.16975 5.57923 2.29143 -172.74218 636.49891
5020.0000 -178.66781 -173.05882 5.60900 2.27758 -172.98200 628.68698
5025.0000 -178.34641 -171.62110 6.72531 2.29846 -172.62052 640.40725
5030.0000 -176.83823 -170.36664 6.47159 2.41031 -170.68485 710.62988
5035.0000 -179.20538 -172.54423 6.66115 2.34983 -171.73150 672.71802
5040.0000 -178.87046 -173.89486 4.97559 2.27616 -173.00647 626.63638
5045.0000 -178.87631 -173.20084 5.67547 2.26928 -173.12554 624.05243
5050.0000 -178.48254 -172.47363 6.00891 2.25532 -173.36719 606.76144
5055.0000 -178.28897 -171.92875 6.36023 2.31063 -172.40995 636.21373
5060.0000 -178.75966 -173.27222 5.48744 2.27896 -172.95809 624.86651
5065.0000 -178.92051 -172.62751 6.29300 2.26007 -173.28502 610.52449
5070.0000 -177.71626 -171.94228 5.77397 2.34784 -171.76595 669.92055
5075.0000 -177.87059 -169.79069 8.07990 2.37578 -171.28240 672.01242
5080.0000 -178.10302 -171.17679 6.92622 2.44732 -170.04423 741.88684
5085.0000 -178.31448 -173.50734 4.80714 2.27267 -173.06684 628.73692
5090.0000 -179.73659 -173.32028 6.41630 2.24186 -173.60015 617.32023
5095.0000 -179.74557 -173.94041 5.80516 2.22865 -173.82881 619.47166
5100.0000 -178.82684 -172.59245 6.23439 2.29458 -172.68778 650.25020
5105.0000 -177.68456 -171.66334 6.02121 2.35105 -171.71034 671.33609
5110.0000 -178.71957 -172.65697 6.06260 2.34010 -171.89998 697.00742
5115.0000 -177.67361 -171.68143 5.99218 2.33815 -171.93372 674.29110
5120.0000 -179.25975 -172.52674 6.73300 2.31363 -172.35798 640.95424
5125.0000 -179.04010 -173.60512 5.43498 2.27238 -173.07188 639.36148
5130.0000 -177.33565 -171.34798 5.98767 2.30933 -172.43245 647.43341
5135.0000 -178.12735 -171.91817 6.20918 2.36123 -171.53422 666.22997
5140.0000 -178.51978 -172.25338 6.26640 2.34794 -171.76427 673.12009
5145.0000 -178.56401 -172.17111 6.39290 2.31973 -172.25252 659.64283
5150.0000 -178.42550 -171.13356 7.29193 2.29282 -172.71815 637.55830
5155.0000 -176.84254 -169.87979 6.96275 2.41168 -170.66103 703.70411
5160.0000 -177.48040 -170.46689 7.01351 2.41509 -170.60201 708.69063
5165.0000 -178.54618 -171.59029 6.95589 2.42292 -170.46652 738.58203
5170.0000 -178.91376 -173.33121 5.58255 2.31507 -172.33303 647.26596
5175.0000 -178.25686 -171.87781 6.37905 2.34994 -171.72956 670.00112
5180.0000 -177.90911 -171.20790 6.70121 2.36076 -171.54235 705.10442
5185.0000 -177.75405 -171.20629 6.54776 2.38874 -171.05807 703.02292
5190.0000 -178.27369 -172.37019 5.90350 2.30263 -172.54836 639.34128
5195.0000 -178.63798 -171.88911 6.74887 2.34737 -171.77408 681.70204
5200.0000 -176.84232 -170.57119 6.27113 2.39247 -170.99345 710.87701
5205.0000 -178.55506 -171.38383 7.17122 2.39019 -171.03293 713.96717
5210.0000 -178.48674 -171.42722 7.05952 2.33486 -171.99061 680.38565
5215.0000 -176.98173 -170.37235 6.60938 2.39047 -171.02822 704.34294
5220.0000 -178.90840 -171.12110 7.78730 2.37544 -171.28829 692.91867
5225.0000 -178.42517 -171.43218 6.99298 2.35515 -171.63947 679.74386
5230.0000 -178.01197 -171.25183 6.76014 2.35875 -171.57716 693.08058
5235.0000 -177.44790 -170.73116 6.71674 2.39085 -171.02149 705.78796
5240.0000 -178.17135 -171.70707 6.46428 2.35238 -171.68745 664.79186
5245.0000 -178.05707 -170.98999 7.06707 2.37235 -171.34183 688.02928
5250.0000 -178.98733 -172.43031 6.55702 2.35235 -171.68788 706.53899
FREEZING PROCESS: loop number 22 T-loop= 633.00000000000000
main_MD> interactions number 22 at Temperature= 633.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.06662 -0.68175 1.88494
force_rgl> df(natom) -0.19973 1.83738 -1.24039
5255.0000 -178.68013 -172.22386 6.45627 2.35372 -171.66415 679.49853
5260.0000 -178.68549 -172.54884 6.13665 2.32841 -172.10223 682.14596
5265.0000 -180.30659 -174.63526 5.67133 2.25941 -173.29645 628.89870
5270.0000 -179.67819 -173.87103 5.80716 2.20480 -174.24156 583.01037
5275.0000 -180.09634 -174.42178 5.67456 2.22234 -173.93793 618.06358
5280.0000 -179.54584 -174.03867 5.50717 2.21856 -174.00337 620.19659
5285.0000 -179.29141 -174.53153 4.75989 2.20422 -174.25163 609.53094
5290.0000 -179.41239 -172.87168 6.54071 2.24766 -173.49984 606.64100
5295.0000 -179.37959 -173.96295 5.41664 2.27072 -173.10072 640.89066
5300.0000 -179.54777 -174.76853 4.77924 2.17749 -174.71423 550.52023
5305.0000 -179.29367 -173.57514 5.71853 2.22952 -173.81373 615.64904
5310.0000 -178.61507 -172.85782 5.75725 2.28362 -172.87732 633.04550
5315.0000 -177.77644 -171.39372 6.38273 2.29244 -172.72482 661.42186
5320.0000 -177.95550 -172.71804 5.23746 2.34251 -171.85815 675.78523
5325.0000 -179.66743 -172.71754 6.94989 2.29690 -172.64765 640.82316
5330.0000 -177.24221 -171.55813 5.68408 2.32364 -172.18482 654.18573
5335.0000 -178.77129 -172.16598 6.60531 2.34437 -171.82594 663.64284
5340.0000 -178.81912 -172.23920 6.57992 2.32388 -172.18067 670.98067
5345.0000 -179.16745 -173.99247 5.17498 2.26659 -173.17220 615.85968
5350.0000 -180.07861 -174.15465 5.92395 2.19110 -174.47859 572.76930
5355.0000 -178.46143 -173.37252 5.08891 2.21698 -174.03082 590.18233
5360.0000 -178.91041 -173.74074 5.16967 2.23886 -173.65198 601.79085
5365.0000 -178.71177 -172.00978 6.70199 2.30780 -172.45895 641.80500
5370.0000 -178.86403 -172.44540 6.41863 2.30369 -172.53006 635.35592
5375.0000 -178.68590 -172.89839 5.78751 2.28012 -172.93805 631.99966
5380.0000 -178.81912 -172.33375 6.48537 2.27944 -172.94977 650.78137
5385.0000 -178.70130 -172.35816 6.34314 2.28935 -172.77818 640.51380
5390.0000 -179.09148 -172.63092 6.46056 2.31072 -172.40838 650.70837
5395.0000 -179.83631 -173.75206 6.08425 2.25065 -173.44807 613.29827
5400.0000 -179.23799 -173.33645 5.90154 2.24087 -173.61729 590.03188
5405.0000 -180.11015 -174.95444 5.15572 2.22093 -173.96231 598.06992
5410.0000 -179.15080 -174.27062 4.88017 2.16606 -174.91202 547.69529
5415.0000 -177.24229 -171.32983 5.91247 2.31173 -172.39098 621.67858
5420.0000 -178.64578 -172.34185 6.30393 2.34825 -171.75886 655.84307
5425.0000 -178.94167 -173.59024 5.35143 2.30973 -172.42551 651.76281
5430.0000 -180.25359 -174.19729 6.05631 2.23049 -173.79685 587.00360
5435.0000 -180.34626 -175.02777 5.31849 2.20623 -174.21683 598.24121
5440.0000 -179.56914 -174.74167 4.82748 2.19290 -174.44749 593.93721
5445.0000 -178.91112 -173.89045 5.02067 2.18694 -174.55070 577.69451
5450.0000 -179.44534 -173.53586 5.90949 2.20925 -174.16460 614.27267
5455.0000 -177.35510 -170.83717 6.51793 2.32741 -172.11945 662.82296
5460.0000 -178.71674 -171.86627 6.85047 2.38645 -171.09771 699.08196
5465.0000 -179.34136 -174.25035 5.09101 2.28063 -172.92919 656.57057
5470.0000 -179.41753 -174.13332 5.28421 2.22172 -173.94867 636.55344
5475.0000 -179.49291 -173.23150 6.26141 2.23005 -173.80446 616.06986
5480.0000 -179.52346 -173.22221 6.30126 2.23016 -173.80260 614.40785
5485.0000 -179.45524 -173.77616 5.67908 2.24920 -173.47317 611.53609
5490.0000 -179.24426 -173.57476 5.66951 2.20634 -174.21488 586.54543
5495.0000 -180.03738 -174.15215 5.88523 2.22262 -173.93311 606.63828
5500.0000 -180.14445 -174.26793 5.87652 2.23378 -173.73990 627.72094
FREEZING PROCESS: loop number 23 T-loop= 608.00000000000000
main_MD> interactions number 23 at Temperature= 608.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.35048 4.89000 -2.09618
force_rgl> df(natom) -0.74747 1.19464 2.88050
5505.0000 -179.52660 -173.50716 6.01944 2.22556 -173.88216 599.30314
5510.0000 -179.72336 -174.38583 5.33753 2.21803 -174.01261 576.51669
5515.0000 -179.20628 -173.30154 5.90474 2.22235 -173.93774 580.89420
5520.0000 -177.80274 -172.27313 5.52961 2.30537 -172.50103 630.67795
5525.0000 -178.97271 -173.39223 5.58048 2.28589 -172.83818 634.81148
5530.0000 -179.44499 -173.92570 5.51930 2.24530 -173.54055 575.36435
5535.0000 -179.93879 -173.22447 6.71432 2.23624 -173.69737 595.95558
5540.0000 -179.31645 -173.58944 5.72701 2.25685 -173.34068 632.22866
5545.0000 -179.82367 -174.48455 5.33912 2.19987 -174.32682 568.19850
5550.0000 -179.98817 -174.36523 5.62294 2.19140 -174.47350 572.38413
5555.0000 -180.16736 -174.73660 5.43076 2.15974 -175.02143 576.88360
5560.0000 -179.46937 -172.89920 6.57018 2.22027 -173.97380 628.48427
5565.0000 -178.98295 -173.22622 5.75672 2.27173 -173.08322 621.27836
5570.0000 -178.82685 -173.04836 5.77849 2.27040 -173.10624 636.91983
5575.0000 -179.10590 -173.75613 5.34978 2.23135 -173.78212 621.13518
5580.0000 -180.43361 -174.85594 5.57767 2.17535 -174.75130 577.83941
5585.0000 -179.97064 -174.59869 5.37195 2.18844 -174.52471 593.05079
5590.0000 -179.44562 -174.57118 4.87444 2.21985 -173.98099 621.74966
5595.0000 -180.16785 -175.84595 4.32189 2.14989 -175.19182 548.56101
5600.0000 -180.16103 -175.33949 4.82154 2.12053 -175.70006 510.71676
5605.0000 -179.90254 -173.85240 6.05014 2.19979 -174.32818 581.21339
5610.0000 -179.25791 -172.85209 6.40582 2.24045 -173.62460 609.88402
5615.0000 -178.72169 -173.13201 5.58968 2.26569 -173.18778 642.12302
5620.0000 -180.01198 -174.01301 5.99896 2.24697 -173.51178 624.30512
5625.0000 -179.80526 -174.50141 5.30385 2.18174 -174.64071 569.29516
5630.0000 -180.79606 -175.13641 5.65965 2.16013 -175.01468 556.96522
5635.0000 -179.80555 -174.78726 5.01829 2.15781 -175.05480 552.38865
5640.0000 -179.47269 -174.05776 5.41493 2.18821 -174.52869 599.93452
5645.0000 -179.16001 -174.07482 5.08519 2.18858 -174.52217 586.32878
5650.0000 -179.96487 -174.03072 5.93415 2.21702 -174.03006 588.04357
5655.0000 -180.34364 -174.61206 5.73158 2.20994 -174.15260 593.59020
5660.0000 -179.71751 -173.30401 6.41351 2.22186 -173.94626 617.89911
5665.0000 -179.22135 -173.44575 5.77560 2.27672 -172.99681 630.15573
5670.0000 -179.06524 -172.96721 6.09804 2.31128 -172.39872 655.01609
5675.0000 -178.08871 -172.24800 5.84071 2.29415 -172.69524 648.43825
5680.0000 -179.16576 -173.06380 6.10196 2.25576 -173.35964 608.70735
5685.0000 -178.81310 -172.81633 5.99678 2.29749 -172.63739 636.92044
5690.0000 -176.95059 -170.85900 6.09159 2.34231 -171.86163 661.81375
5695.0000 -178.54529 -172.41728 6.12801 2.32531 -172.15594 645.12486
5700.0000 -179.27471 -174.34725 4.92746 2.25678 -173.34187 628.53446
5705.0000 -179.45784 -174.09630 5.36154 2.24489 -173.54769 611.50799
5710.0000 -178.86433 -173.74266 5.12167 2.23182 -173.77391 609.27770
5715.0000 -179.32448 -173.70704 5.61744 2.26774 -173.15230 619.80197
5720.0000 -178.97703 -173.14955 5.82747 2.22297 -173.92705 604.48914
5725.0000 -179.63192 -173.99611 5.63581 2.23730 -173.67899 626.72970
5730.0000 -179.27079 -173.83585 5.43494 2.19787 -174.36142 582.04335
5735.0000 -178.97159 -172.90543 6.06616 2.25585 -173.35793 614.14372
5740.0000 -178.44625 -172.17209 6.27416 2.28427 -172.86622 635.12620
5745.0000 -179.29654 -173.77487 5.52167 2.27662 -172.99862 640.58104
5750.0000 -180.00632 -172.90285 7.10348 2.23899 -173.64977 613.87035
FREEZING PROCESS: loop number 24 T-loop= 583.00000000000000
main_MD> interactions number 24 at Temperature= 583.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.07650 0.90878 0.75985
force_rgl> df(natom) -0.04502 2.61437 -2.29217
5755.0000 -178.61158 -172.89392 5.71766 2.28994 -172.76801 664.64790
5760.0000 -179.45055 -173.32391 6.12664 2.25499 -173.37284 641.37075
5765.0000 -178.33091 -173.08713 5.24378 2.29359 -172.70481 646.99831
5770.0000 -180.65615 -174.46706 6.18910 2.25176 -173.42878 613.51703
5775.0000 -181.64102 -176.28300 5.35802 2.15859 -175.04135 580.58332
5780.0000 -179.62346 -174.63556 4.98790 2.15774 -175.05606 576.10791
5785.0000 -180.00473 -174.85296 5.15177 2.19987 -174.32693 589.70867
5790.0000 -180.10385 -174.34950 5.75435 2.17149 -174.81800 586.63335
5795.0000 -179.26348 -174.24470 5.01877 2.19302 -174.44548 574.75470
5800.0000 -179.57438 -173.71870 5.85568 2.23673 -173.68888 603.72452
5805.0000 -178.20301 -172.86551 5.33750 2.28156 -172.91301 660.79213
5810.0000 -179.85861 -172.94617 6.91244 2.29397 -172.69821 683.53164
5815.0000 -180.61814 -175.67442 4.94372 2.17955 -174.67851 610.09126
5820.0000 -180.51528 -174.95341 5.56188 2.14862 -175.21392 578.66305
5825.0000 -179.92607 -173.92036 6.00571 2.17999 -174.67100 572.86600
5830.0000 -179.59083 -174.34502 5.24581 2.19812 -174.35720 576.79065
5835.0000 -179.97718 -174.87471 5.10247 2.18222 -174.63225 560.79013
5840.0000 -180.50942 -175.61586 4.89356 2.16017 -175.01391 542.15879
5845.0000 -180.26698 -175.45210 4.81488 2.12965 -175.54209 547.37355
5850.0000 -178.96630 -173.71065 5.25565 2.14049 -175.35459 533.93889
5855.0000 -179.91539 -174.30289 5.61250 2.18201 -174.63596 573.41724
5860.0000 -180.78097 -176.27183 4.50914 2.12919 -175.55020 544.68495
5865.0000 -180.80746 -175.92706 4.88039 2.08800 -176.26291 500.66943
5870.0000 -179.86586 -174.67330 5.19256 2.10222 -176.01695 521.76554
5875.0000 -180.44386 -175.23735 5.20651 2.17489 -174.75925 573.65824
5880.0000 -179.36110 -174.84823 4.51287 2.13733 -175.40923 532.05873
5885.0000 -180.68006 -176.24041 4.43965 2.12830 -175.56548 521.52207
5890.0000 -179.73592 -174.22239 5.51353 2.14412 -175.29178 550.27118
5895.0000 -179.59562 -174.91851 4.67711 2.20053 -174.31544 579.60690
5900.0000 -179.10870 -173.84134 5.26737 2.22534 -173.88602 598.07519
5905.0000 -180.43655 -175.30619 5.13036 2.19188 -174.46520 575.33849
5910.0000 -180.10629 -174.37623 5.73007 2.17672 -174.72756 567.93506
5915.0000 -180.98718 -175.79214 5.19505 2.15417 -175.11771 562.66477
5920.0000 -180.64163 -174.97078 5.67085 2.15154 -175.16337 559.58183
5925.0000 -179.49556 -174.63311 4.86245 2.16947 -174.85300 559.32743
5930.0000 -178.75721 -173.13588 5.62133 2.20480 -174.24149 584.21922
5935.0000 -179.06075 -172.97883 6.08193 2.24892 -173.47794 621.25538
5940.0000 -179.46206 -173.72781 5.73425 2.25714 -173.33564 623.91852
5945.0000 -179.33342 -172.40243 6.93100 2.23592 -173.70290 594.30867
5950.0000 -179.04518 -173.33363 5.71154 2.27755 -172.98243 636.24314
5955.0000 -178.01999 -172.24950 5.77049 2.29226 -172.72792 639.83757
5960.0000 -178.66875 -172.58371 6.08504 2.30976 -172.42504 636.93071
5965.0000 -179.23371 -173.33699 5.89672 2.27747 -172.98382 636.83814
5970.0000 -179.77987 -174.59388 5.18599 2.24181 -173.60107 627.34001
5975.0000 -180.52349 -174.67287 5.85062 2.15245 -175.14759 559.74832
5980.0000 -180.61641 -175.29370 5.32271 2.15770 -175.05676 567.26074
5985.0000 -180.89957 -175.72018 5.17939 2.14314 -175.30865 553.87325
5990.0000 -180.57877 -174.11909 6.45968 2.16039 -175.01014 555.35947
5995.0000 -180.81380 -175.16107 5.65273 2.18989 -174.49959 581.34897
6000.0000 -179.40348 -173.24385 6.15963 2.19999 -174.32474 568.30361
FREEZING PROCESS: loop number 25 T-loop= 558.00000000000000
main_MD> interactions number 25 at Temperature= 558.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.97728 -0.89836 0.35794
force_rgl> df(natom) 0.91258 -0.32385 3.86691
6005.0000 -179.27408 -174.20840 5.06568 2.20285 -174.27523 578.20760
6010.0000 -180.46131 -175.77634 4.68497 2.15263 -175.14451 555.22009
6015.0000 -181.28072 -175.52841 5.75231 2.13670 -175.42020 546.34874
6020.0000 -180.09272 -175.19844 4.89428 2.13369 -175.47223 544.32861
6025.0000 -180.36884 -175.13774 5.23110 2.13500 -175.44958 551.21904
6030.0000 -179.51753 -174.50517 5.01237 2.18132 -174.64785 570.74658
6035.0000 -180.12014 -175.35980 4.76034 2.17283 -174.79485 559.64800
6040.0000 -180.44199 -175.88128 4.56071 2.11673 -175.76576 517.14714
6045.0000 -179.60711 -174.72370 4.88341 2.13798 -175.39801 523.96075
6050.0000 -179.61299 -174.60445 5.00853 2.20792 -174.18751 590.38430
6055.0000 -179.56758 -173.41866 6.14892 2.22393 -173.91037 592.18291
6060.0000 -180.46752 -175.28164 5.18588 2.21393 -174.08345 583.49692
6065.0000 -180.18157 -174.78047 5.40110 2.14294 -175.31209 547.00373
6070.0000 -180.93395 -175.62315 5.31080 2.16470 -174.93548 582.79218
6075.0000 -179.68556 -174.53290 5.15267 2.15516 -175.10060 553.51028
6080.0000 -179.47135 -174.32159 5.14976 2.16365 -174.95371 540.52158
6085.0000 -180.00360 -175.31553 4.68807 2.16756 -174.88610 553.45186
6090.0000 -181.10199 -175.43170 5.67030 2.11529 -175.79064 501.32366
6095.0000 -178.89412 -173.74140 5.15272 2.16634 -174.90710 553.11049
6100.0000 -179.25082 -174.06301 5.18781 2.20672 -174.20836 589.75714
6105.0000 -180.22709 -174.41666 5.81043 2.20780 -174.18966 589.14364
6110.0000 -180.09117 -175.44583 4.64533 2.19510 -174.40937 596.68353
6115.0000 -180.73373 -175.71571 5.01802 2.13025 -175.53171 543.37438
6120.0000 -179.19804 -174.20152 4.99652 2.16068 -175.00517 543.43211
6125.0000 -181.49146 -176.04171 5.44975 2.16001 -175.01668 570.69880
6130.0000 -180.33499 -174.60250 5.73250 2.11867 -175.73213 558.40065
6135.0000 -178.52418 -172.84935 5.67483 2.20870 -174.17404 609.93201
6140.0000 -180.42764 -174.86463 5.56301 2.20303 -174.27218 588.36512
6145.0000 -180.32463 -176.10646 4.21817 2.14359 -175.30081 541.31964
6150.0000 -180.41081 -175.60188 4.80893 2.10685 -175.93678 501.99760
6155.0000 -181.19671 -176.20151 4.99520 2.14407 -175.29254 555.51718
6160.0000 -181.04180 -176.44795 4.59385 2.08492 -176.31630 485.33723
6165.0000 -179.69137 -174.65862 5.03275 2.11771 -175.74878 522.65436
6170.0000 -180.21102 -175.63292 4.57810 2.14046 -175.35511 536.19612
6175.0000 -180.87122 -175.33029 5.54093 2.13379 -175.47057 542.96078
6180.0000 -181.53227 -176.54056 4.99171 2.10404 -175.98536 528.82036
6185.0000 -180.35420 -175.45324 4.90096 2.09616 -176.12174 516.54419
6190.0000 -180.27284 -175.12168 5.15116 2.15176 -175.15951 560.32666
6195.0000 -180.96739 -174.95396 6.01343 2.15235 -175.14923 553.32146
6200.0000 -180.87829 -176.12995 4.74833 2.10278 -176.00726 544.82022
6205.0000 -180.78513 -175.78334 5.00178 2.12646 -175.59739 562.49629
6210.0000 -180.90328 -175.44689 5.45639 2.11546 -175.78775 535.19931
6215.0000 -180.34917 -175.51123 4.83794 2.16432 -174.94219 576.61076
6220.0000 -179.49939 -174.81564 4.68375 2.13824 -175.39352 544.52591
6225.0000 -180.79809 -175.83974 4.95835 2.14452 -175.28484 538.08067
6230.0000 -180.76872 -175.13940 5.62933 2.12751 -175.57916 553.51743
6235.0000 -180.08009 -175.03724 5.04284 2.12650 -175.59662 553.01099
6240.0000 -179.75494 -175.10704 4.64790 2.15786 -175.05391 553.06470
6245.0000 -179.60556 -174.92516 4.68041 2.16756 -174.88605 555.05232
6250.0000 -180.37228 -174.64334 5.72894 2.17176 -174.81330 555.07653
FREEZING PROCESS: loop number 26 T-loop= 533.00000000000000
main_MD> interactions number 26 at Temperature= 533.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.99078 0.51227 0.79718
force_rgl> df(natom) 1.54546 -1.84937 1.37915
6255.0000 -180.48891 -174.81806 5.67085 2.17478 -174.76116 565.55526
6260.0000 -179.99087 -175.14203 4.84884 2.16012 -175.01483 542.16422
6265.0000 -180.01047 -175.05362 4.95685 2.14517 -175.27348 521.58278
6270.0000 -179.73914 -174.74834 4.99079 2.16654 -174.90366 542.52159
6275.0000 -180.43619 -175.83015 4.60603 2.14316 -175.30841 534.31494
6280.0000 -179.41237 -173.78548 5.62689 2.16271 -174.97002 541.63945
6285.0000 -179.07814 -173.43752 5.64063 2.22935 -173.81672 574.08819
6290.0000 -180.44660 -175.22210 5.22450 2.19888 -174.34396 570.54697
6295.0000 -180.97266 -175.84054 5.13211 2.14367 -175.29943 554.89390
6300.0000 -180.84908 -176.18859 4.66049 2.09663 -176.11362 515.27301
6305.0000 -181.62512 -177.48626 4.13886 2.05554 -176.82486 505.01659
6310.0000 -182.05078 -177.51683 4.53395 2.04351 -177.03305 519.62890
6315.0000 -181.52382 -176.83413 4.68968 2.02437 -177.36417 511.96922
6320.0000 -180.85502 -175.56716 5.28786 2.07477 -176.49189 527.16440
6325.0000 -181.14444 -176.78445 4.35999 2.10260 -176.01030 536.59286
6330.0000 -182.59696 -177.87285 4.72410 2.02363 -177.37712 494.92144
6335.0000 -181.94152 -176.97399 4.96752 2.02445 -177.36277 504.56961
6340.0000 -181.99321 -177.53678 4.45643 1.99394 -177.89094 483.65944
6345.0000 -181.00660 -176.26772 4.73888 2.01157 -177.58568 479.32722
6350.0000 -180.99555 -175.40334 5.59222 2.10513 -175.96652 545.81695
6355.0000 -180.54243 -175.44478 5.09765 2.13915 -175.37770 568.07429
6360.0000 -181.23633 -176.06427 5.17206 2.09251 -176.18498 526.02233
6365.0000 -181.59456 -175.87034 5.72423 2.11544 -175.78814 550.86674
6370.0000 -181.11452 -176.74441 4.37011 2.06377 -176.68240 510.94530
6375.0000 -181.26077 -176.70527 4.55550 2.06523 -176.65704 486.08174
6380.0000 -179.54154 -175.23751 4.30403 2.10617 -175.94853 529.86617
6385.0000 -180.52569 -175.62884 4.89685 2.15685 -175.07149 551.11777
6390.0000 -180.50831 -175.30806 5.20026 2.15998 -175.01729 567.07389
6395.0000 -180.02777 -174.78701 5.24076 2.14982 -175.19309 550.51430
6400.0000 -181.41580 -176.23174 5.18406 2.12853 -175.56155 534.40004
6405.0000 -180.87515 -175.14326 5.73189 2.12827 -175.56601 543.85948
6410.0000 -180.38543 -175.05301 5.33241 2.13253 -175.49238 547.60746
6415.0000 -180.16950 -175.08679 5.08271 2.18324 -174.61470 569.05254
6420.0000 -179.93242 -174.90877 5.02366 2.15757 -175.05891 557.69554
6425.0000 -179.92126 -175.20800 4.71326 2.13860 -175.38730 539.96151
6430.0000 -179.68942 -174.43744 5.25197 2.15675 -175.07322 560.17330
6435.0000 -180.58730 -175.71579 4.87150 2.13585 -175.43477 542.30934
6440.0000 -179.94659 -175.54195 4.40464 2.12993 -175.53732 544.03443
6445.0000 -181.19053 -176.41990 4.77063 2.10855 -175.90733 519.97277
6450.0000 -180.28297 -175.81546 4.46751 2.11887 -175.72872 518.10167
6455.0000 -180.55497 -176.78480 3.77017 2.10089 -176.03982 497.47252
6460.0000 -180.74272 -176.65076 4.09196 2.06269 -176.70097 466.03568
6465.0000 -180.96442 -176.38421 4.58020 2.04655 -176.98044 480.55965
6470.0000 -179.92165 -175.33329 4.58836 2.11344 -175.82270 549.92882
6475.0000 -180.92211 -175.54445 5.37766 2.13199 -175.50162 544.56105
6480.0000 -180.45147 -175.76496 4.68651 2.13134 -175.51287 535.89946
6485.0000 -180.66904 -174.96893 5.70011 2.14014 -175.36059 534.80668
6490.0000 -179.95435 -175.37872 4.57563 2.19255 -174.45350 565.44268
6495.0000 -179.05161 -173.94532 5.10630 2.17033 -174.83803 551.37102
6500.0000 -180.44661 -176.21985 4.22676 2.15759 -175.05866 550.66076
FREEZING PROCESS: loop number 27 T-loop= 508.00000000000000
main_MD> interactions number 27 at Temperature= 508.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.37923 0.31514 -0.96321
force_rgl> df(natom) -0.32276 -5.77106 -0.35152
6505.0000 -180.84867 -176.02237 4.82630 2.08309 -176.34802 491.68024
6510.0000 -180.74184 -176.29564 4.44620 2.10201 -176.02054 512.61778
6515.0000 -181.49308 -176.95868 4.53440 2.05882 -176.76794 487.57478
6520.0000 -180.41633 -176.12565 4.29069 2.04594 -176.99089 483.73473
6525.0000 -180.53334 -174.87652 5.65682 2.14803 -175.22413 550.84954
6530.0000 -180.32327 -175.86097 4.46231 2.12952 -175.54443 533.53386
6535.0000 -180.66000 -175.88736 4.77264 2.12689 -175.58993 521.74466
6540.0000 -180.90290 -175.30880 5.59410 2.10668 -175.93973 510.13315
6545.0000 -180.77304 -175.59790 5.17514 2.15279 -175.14175 573.73645
6550.0000 -181.45954 -176.53714 4.92239 2.11410 -175.81125 548.39306
6555.0000 -180.32592 -176.20205 4.12387 2.09749 -176.09883 523.59074
6560.0000 -181.51336 -176.96274 4.55061 2.07234 -176.53411 491.84095
6565.0000 -181.46009 -176.76019 4.69990 2.07159 -176.54693 499.39597
6570.0000 -181.65540 -176.59906 5.05634 2.03892 -177.11240 491.61334
6575.0000 -181.75007 -177.14778 4.60230 2.06325 -176.69142 500.84246
6580.0000 -181.99108 -177.55203 4.43905 2.02914 -177.28161 493.12404
6585.0000 -181.83960 -178.03504 3.80456 2.02730 -177.31345 488.20632
6590.0000 -181.78827 -176.86637 4.92190 2.02614 -177.33368 489.66035
6595.0000 -181.53598 -176.78397 4.75201 2.01887 -177.45945 486.86710
6600.0000 -181.98757 -177.47390 4.51366 2.03034 -177.26098 487.47387
6605.0000 -182.02325 -178.27994 3.74331 2.01055 -177.60349 490.07241
6610.0000 -182.68188 -177.75507 4.92681 2.00314 -177.73175 473.46999
6615.0000 -182.16945 -178.21355 3.95590 1.98945 -177.96861 464.78831
6620.0000 -180.82823 -176.00458 4.82365 2.02638 -177.32943 470.97118
6625.0000 -181.72880 -176.72724 5.00156 2.06416 -176.67565 508.66021
6630.0000 -181.38407 -177.16420 4.21987 2.05249 -176.87758 479.15861
6635.0000 -180.79329 -176.65681 4.13648 2.06218 -176.70988 472.93234
6640.0000 -180.85404 -176.00449 4.84955 2.07777 -176.44000 487.44035
6645.0000 -180.46635 -175.31924 5.14711 2.08938 -176.23908 494.32521
6650.0000 -181.10432 -175.67723 5.42709 2.11674 -175.76560 523.25041
6655.0000 -181.02166 -175.94202 5.07965 2.10253 -176.01159 516.62110
6660.0000 -180.18426 -176.00453 4.17973 2.07217 -176.53692 489.62962
6665.0000 -181.52685 -176.70133 4.82552 2.08243 -176.35933 490.91939
6670.0000 -181.51377 -176.75453 4.75924 2.09190 -176.19550 505.50044
6675.0000 -181.66782 -177.22285 4.44497 2.06212 -176.71095 485.93589
6680.0000 -180.60742 -176.13813 4.46929 2.05767 -176.78785 485.08135
6685.0000 -182.00101 -176.04990 5.95111 2.06127 -176.72562 495.41207
6690.0000 -179.92145 -175.01278 4.90867 2.13465 -175.45557 581.14537
6695.0000 -180.49349 -175.30886 5.18464 2.14254 -175.31906 543.90046
6700.0000 -180.84916 -175.44032 5.40885 2.15291 -175.13956 538.31873
6705.0000 -181.33112 -175.78321 5.54792 2.11058 -175.87215 544.53085
6710.0000 -180.78820 -176.29134 4.49686 2.10034 -176.04935 541.97745
6715.0000 -180.94064 -176.20985 4.73079 2.10498 -175.96912 543.39005
6720.0000 -180.93923 -176.90742 4.03181 2.06724 -176.62229 510.95591
6725.0000 -182.26571 -177.00112 5.26460 2.05357 -176.85896 495.24614
6730.0000 -180.79342 -176.87370 3.91972 2.05658 -176.80678 491.56832
6735.0000 -181.76643 -177.72123 4.04520 2.02392 -177.37201 465.74701
6740.0000 -182.51826 -177.82954 4.68872 1.98855 -177.98412 452.95211
6745.0000 -181.96302 -177.52493 4.43808 1.99098 -177.94217 449.74510
6750.0000 -182.26436 -177.32935 4.93501 2.03930 -177.10590 494.09496
FREEZING PROCESS: loop number 28 T-loop= 483.00000000000000
main_MD> interactions number 28 at Temperature= 483.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.27855 -1.60585 -2.15229
force_rgl> df(natom) 2.27216 -2.57589 2.08025
6755.0000 -182.91536 -178.58811 4.32725 1.95683 -178.53317 451.96463
6760.0000 -181.93364 -177.72468 4.20896 1.96946 -178.31465 459.73901
6765.0000 -182.27460 -177.24118 5.03342 2.05069 -176.90865 528.71187
6770.0000 -181.47969 -177.49107 3.98862 2.05188 -176.88805 527.89564
6775.0000 -181.97500 -176.55872 5.41628 2.04740 -176.96560 512.47984
6780.0000 -181.16645 -177.42780 3.73865 2.04514 -177.00480 500.33020
6785.0000 -181.02585 -176.45283 4.57302 2.03042 -177.25955 482.36521
6790.0000 -182.24929 -176.96087 5.28842 2.05843 -176.77469 517.91496
6795.0000 -182.36545 -178.29309 4.07236 2.03804 -177.12762 507.56187
6800.0000 -181.72977 -177.43235 4.29742 1.98050 -178.12358 466.56223
6805.0000 -181.22834 -176.90641 4.32193 2.02326 -177.38348 497.85587
6810.0000 -182.36984 -177.43121 4.93863 2.03725 -177.14125 489.22430
6815.0000 -182.04873 -177.38552 4.66321 2.02787 -177.30366 480.24568
6820.0000 -181.69916 -177.31563 4.38353 2.04692 -176.97402 496.93179
6825.0000 -181.83370 -177.22424 4.60946 2.01744 -177.48424 481.24767
6830.0000 -182.29865 -177.72551 4.57315 2.01468 -177.53193 484.52860
6835.0000 -183.10184 -178.06994 5.03190 1.98017 -178.12922 463.32075
6840.0000 -182.66238 -177.70452 4.95786 2.00792 -177.64886 478.33667
6845.0000 -181.83237 -177.61624 4.21613 2.01693 -177.49302 481.63025
6850.0000 -182.49244 -178.16457 4.32786 1.96149 -178.45250 440.37767
6855.0000 -182.04776 -177.32960 4.71816 2.00575 -177.68642 480.84493
6860.0000 -181.75865 -177.27865 4.48000 2.04053 -177.08451 508.67182
6865.0000 -181.96303 -177.94292 4.02012 2.01127 -177.59090 491.93910
6870.0000 -182.71197 -178.37496 4.33701 2.00179 -177.75497 474.27172
6875.0000 -182.75634 -178.79440 3.96193 1.96233 -178.43804 457.28921
6880.0000 -182.02765 -177.60830 4.41936 1.99963 -177.79242 484.73880
6885.0000 -182.32105 -178.10150 4.21955 1.99608 -177.85392 477.68668
6890.0000 -182.92661 -178.12076 4.80585 1.95858 -178.50289 452.77894
6895.0000 -182.01652 -178.24750 3.76902 2.00520 -177.69606 492.18413
6900.0000 -182.72426 -178.22026 4.50400 1.97232 -178.26512 458.69794
6905.0000 -182.17532 -177.55707 4.61825 1.99879 -177.80704 478.45222
6910.0000 -182.12976 -177.66832 4.46144 2.02555 -177.34386 498.90316
6915.0000 -181.62634 -177.46913 4.15722 2.03271 -177.21998 492.93062
6920.0000 -182.65931 -177.68104 4.97827 2.02622 -177.33225 499.74604
6925.0000 -181.67593 -176.45547 5.22045 2.03045 -177.25909 496.83482
6930.0000 -182.34344 -177.34388 4.99956 2.04314 -177.03941 515.42360
6935.0000 -181.52229 -177.00401 4.51827 2.03332 -177.20931 499.81885
6940.0000 -181.83975 -177.64837 4.19138 2.03377 -177.20162 488.14405
6945.0000 -182.21177 -177.57070 4.64106 2.01828 -177.46971 478.38492
6950.0000 -182.50445 -177.67297 4.83148 2.01490 -177.52810 481.36069
6955.0000 -182.75613 -177.95803 4.79811 1.98597 -178.02887 457.16964
6960.0000 -181.80754 -177.74028 4.06726 2.00577 -177.68614 473.71845
6965.0000 -181.54580 -177.40792 4.13788 1.99291 -177.90869 456.73280
6970.0000 -181.07999 -176.72845 4.35154 2.04305 -177.04094 494.72864
6975.0000 -181.81585 -177.31665 4.49920 2.06327 -176.69096 516.09062
6980.0000 -182.61990 -177.88043 4.73947 2.00836 -177.64126 473.49182
6985.0000 -181.90391 -177.45597 4.44794 1.97359 -178.24314 455.52304
6990.0000 -182.26995 -177.96776 4.30219 2.01617 -177.50620 491.10367
6995.0000 -181.99183 -176.94932 5.04252 2.01577 -177.51300 511.76824
7000.0000 -181.25862 -175.73112 5.52750 2.07564 -176.47685 521.38650
FREEZING PROCESS: loop number 29 T-loop= 458.00000000000000
main_MD> interactions number 29 at Temperature= 458.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.45525 0.44133 -1.70716
force_rgl> df(natom) -5.66616 0.23247 -2.80728
7005.0000 -181.05138 -176.11055 4.94083 2.11475 -175.79999 531.17171
7010.0000 -179.67573 -175.03153 4.64419 2.10986 -175.88475 530.70191
7015.0000 -180.48845 -175.93965 4.54880 2.13009 -175.53457 556.25094
7020.0000 -181.67129 -177.53777 4.13352 2.05759 -176.78922 512.97427
7025.0000 -181.97843 -177.24932 4.72910 2.02142 -177.41521 486.73818
7030.0000 -181.90679 -177.23708 4.66971 2.02634 -177.33017 490.05074
7035.0000 -181.42903 -177.24322 4.18581 2.02164 -177.41155 458.97666
7040.0000 -182.10548 -178.24152 3.86396 1.98438 -178.05629 434.22289
7045.0000 -181.96732 -177.87886 4.08846 1.99270 -177.91240 463.14389
7050.0000 -182.73136 -178.59431 4.13704 1.95656 -178.53786 445.18977
7055.0000 -182.94737 -178.51144 4.43592 1.94838 -178.67932 437.88537
7060.0000 -182.49313 -178.98127 3.51186 1.95622 -178.54363 428.85244
7065.0000 -182.40225 -178.18443 4.21783 1.95284 -178.60216 422.71303
7070.0000 -182.16436 -177.88126 4.28311 1.98624 -178.02409 458.19718
7075.0000 -181.54471 -177.48271 4.06200 2.00841 -177.64038 467.17575
7080.0000 -182.41153 -177.37072 5.04081 2.01467 -177.53220 472.52676
7085.0000 -181.93529 -176.61883 5.31646 2.02342 -177.38060 489.48960
7090.0000 -181.78776 -177.15319 4.63457 2.03868 -177.11654 489.63176
7095.0000 -182.05045 -177.76430 4.28614 2.00852 -177.63857 475.93129
7100.0000 -182.40138 -178.20117 4.20021 1.95828 -178.50805 429.16236
7105.0000 -182.06182 -177.45005 4.61177 2.00297 -177.73464 461.55055
7110.0000 -181.20774 -176.71751 4.49023 2.02438 -177.36411 478.43668
7115.0000 -181.96883 -177.29367 4.67516 2.01834 -177.46861 466.64168
7120.0000 -181.93610 -178.30088 3.63522 2.01493 -177.52759 466.60422
7125.0000 -183.24364 -179.02004 4.22361 1.96344 -178.41876 453.41569
7130.0000 -183.42924 -179.50326 3.92598 1.90041 -179.50965 392.73420
7135.0000 -182.16472 -178.60599 3.55873 1.92857 -179.02228 427.73869
7140.0000 -181.81581 -177.29035 4.52546 1.99232 -177.91887 469.90051
7145.0000 -181.97960 -178.26313 3.71647 2.01149 -177.58723 487.27288
7150.0000 -181.91182 -177.77790 4.13392 1.99977 -177.78991 468.69524
7155.0000 -182.25538 -176.75961 5.49577 2.01198 -177.57872 458.71631
7160.0000 -180.86763 -176.95520 3.91242 2.03957 -177.10119 483.60532
7165.0000 -182.40684 -177.92845 4.47839 2.00644 -177.67451 485.31765
7170.0000 -182.22698 -177.91203 4.31495 1.98310 -178.07845 468.82947
7175.0000 -181.88034 -177.94216 3.93818 1.99021 -177.95541 461.45430
7180.0000 -182.74680 -179.30832 3.43848 1.95847 -178.50471 451.42058
7185.0000 -183.08119 -179.16959 3.91160 1.92950 -179.00611 429.47208
7190.0000 -183.07510 -179.27423 3.80087 1.91587 -179.24199 412.11056
7195.0000 -183.03910 -179.08704 3.95206 1.93886 -178.84420 428.34214
7200.0000 -183.42345 -179.07234 4.35111 1.95755 -178.52065 453.58462
7205.0000 -182.57334 -177.59318 4.98016 1.97113 -178.28572 456.15031
7210.0000 -181.70635 -177.32015 4.38620 2.02497 -177.35382 489.12291
7215.0000 -182.38504 -177.46224 4.92280 2.02478 -177.35716 484.47899
7220.0000 -182.58333 -178.76683 3.81650 1.96835 -178.33376 439.35304
7225.0000 -182.29669 -178.56201 3.73468 1.98661 -178.01771 449.85378
7230.0000 -182.99976 -178.84393 4.15582 1.91103 -179.32574 394.51041
7235.0000 -182.17891 -177.80986 4.36904 1.99577 -177.85916 466.55565
7240.0000 -182.98194 -177.63023 5.35171 2.00604 -177.68151 480.23560
7245.0000 -182.64375 -178.53411 4.10964 1.99870 -177.80859 466.01534
7250.0000 -182.97498 -178.13354 4.84144 1.99407 -177.88856 468.83073
FREEZING PROCESS: loop number 30 T-loop= 433.00000000000000
main_MD> interactions number 30 at Temperature= 433.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.51598 0.97536 2.24548
force_rgl> df(natom) -0.83082 2.37453 0.92880
7255.0000 -182.84009 -178.05929 4.78079 1.96691 -178.35878 442.08508
7260.0000 -182.77278 -178.34534 4.42744 1.97138 -178.28127 437.97573
7265.0000 -182.65622 -178.39697 4.25925 1.97793 -178.16794 452.67464
7270.0000 -182.07488 -178.62727 3.44761 1.94523 -178.73388 431.61686
7275.0000 -182.89103 -178.44953 4.44150 1.93926 -178.83725 430.70324
7280.0000 -182.71874 -178.96437 3.75437 1.95448 -178.57380 444.85722
7285.0000 -182.98583 -178.96469 4.02114 1.90840 -179.37130 406.05661
7290.0000 -182.62179 -178.24393 4.37785 1.96883 -178.32542 456.61289
7295.0000 -183.02112 -179.28392 3.73720 1.92691 -179.05094 418.65155
7300.0000 -182.84619 -179.36151 3.48468 1.91665 -179.22854 418.08457
7305.0000 -183.28807 -179.32240 3.96567 1.91560 -179.24672 415.57522
7310.0000 -183.58586 -179.47162 4.11424 1.90253 -179.47296 402.12540
7315.0000 -183.53144 -179.88802 3.64341 1.90139 -179.49260 403.83427
7320.0000 -182.41819 -178.82246 3.59572 1.89903 -179.53342 404.22339
7325.0000 -182.86499 -178.63597 4.22902 1.94840 -178.67901 444.38077
7330.0000 -182.56401 -178.29377 4.27025 1.94012 -178.82238 440.57883
7335.0000 -183.14256 -178.61432 4.52824 1.95162 -178.62332 448.31413
7340.0000 -181.90945 -178.44324 3.46621 1.95866 -178.50149 444.10090
7345.0000 -182.61412 -178.03792 4.57620 1.98565 -178.03434 467.90578
7350.0000 -182.05254 -177.48948 4.56306 1.99669 -177.84328 477.92841
7355.0000 -182.78041 -178.50489 4.27552 1.99114 -177.93944 479.20876
7360.0000 -182.93043 -179.55222 3.37820 1.93494 -178.91202 428.10081
7365.0000 -183.37460 -179.69226 3.68234 1.88684 -179.74441 395.44898
7370.0000 -182.82947 -179.39180 3.43768 1.88303 -179.81048 390.88227
7375.0000 -182.52101 -178.78817 3.73284 1.94227 -178.78511 432.03787
7380.0000 -181.84360 -178.21883 3.62477 1.97270 -178.25843 437.92774
7385.0000 -182.66000 -178.44855 4.21145 1.96068 -178.46649 436.86584
7390.0000 -182.74001 -178.82455 3.91546 1.96820 -178.33640 452.00657
7395.0000 -182.67444 -178.93909 3.73535 1.94662 -178.70994 436.23424
7400.0000 -182.75808 -178.68222 4.07586 1.94761 -178.69275 439.66433
7405.0000 -183.18264 -178.77751 4.40513 1.92308 -179.11732 425.10123
7410.0000 -182.83142 -179.04967 3.78175 1.93518 -178.90790 428.68289
7415.0000 -183.05932 -179.05312 4.00620 1.93347 -178.93748 430.99760
7420.0000 -183.08239 -178.91614 4.16625 1.94610 -178.71880 439.21877
7425.0000 -183.11806 -178.73944 4.37862 1.94737 -178.69686 442.46852
7430.0000 -183.34879 -178.51200 4.83679 1.93612 -178.89155 438.12499
7435.0000 -182.26824 -178.14411 4.12413 1.99383 -177.89279 479.67165
7440.0000 -181.88568 -177.30921 4.57647 1.99421 -177.88616 478.81293
7445.0000 -182.08323 -177.81867 4.26456 2.00245 -177.74364 496.77854
7450.0000 -183.56820 -178.83727 4.73093 1.97065 -178.29392 461.93020
7455.0000 -183.20500 -178.48819 4.71682 1.94637 -178.71425 450.69846
7460.0000 -181.79806 -177.61415 4.18390 1.95683 -178.53322 446.23773
7465.0000 -182.20490 -178.23104 3.97386 1.99789 -177.82252 485.33456
7470.0000 -183.23660 -178.97346 4.26314 1.95725 -178.52581 450.42889
7475.0000 -183.09471 -178.56870 4.52601 1.93546 -178.90305 444.87427
7480.0000 -183.61631 -180.05596 3.56036 1.89584 -179.58865 404.82750
7485.0000 -183.17260 -180.01921 3.15340 1.87068 -180.02417 387.69277
7490.0000 -183.18450 -179.30363 3.88088 1.90548 -179.42186 414.70055
7495.0000 -182.58839 -178.41426 4.17414 1.92857 -179.02219 421.34576
7500.0000 -183.49537 -179.88317 3.61221 1.92778 -179.03587 425.28192
FREEZING PROCESS: loop number 31 T-loop= 408.00000000000000
main_MD> interactions number 31 at Temperature= 408.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.51663 1.16682 0.00948
force_rgl> df(natom) 2.06831 2.17668 -1.21844
7505.0000 -182.88483 -179.38139 3.50344 1.89070 -179.67761 406.29413
7510.0000 -183.20816 -179.87080 3.33736 1.89343 -179.63046 404.09480
7515.0000 -183.35398 -180.35695 2.99702 1.87443 -179.95925 387.20764
7520.0000 -183.18535 -179.42247 3.76288 1.88444 -179.78592 396.92706
7525.0000 -183.28546 -179.58373 3.70173 1.90712 -179.39340 424.14051
7530.0000 -183.79239 -179.34558 4.44681 1.91423 -179.27043 424.99742
7535.0000 -182.96815 -179.17792 3.79023 1.91920 -179.18450 422.35112
7540.0000 -183.21019 -179.60176 3.60843 1.91677 -179.22641 422.72936
7545.0000 -183.15660 -178.88759 4.26901 1.90548 -179.42190 417.27622
7550.0000 -183.41932 -179.69702 3.72230 1.91585 -179.24231 425.04945
7555.0000 -183.59048 -179.45092 4.13956 1.90933 -179.35517 422.41504
7560.0000 -183.16819 -180.07650 3.09169 1.90446 -179.43945 415.34191
7565.0000 -183.32694 -179.87428 3.45266 1.87706 -179.91378 396.30335
7570.0000 -183.61541 -178.96780 4.64760 1.91455 -179.26483 424.55880
7575.0000 -183.23089 -179.71349 3.51740 1.90656 -179.40314 417.61310
7580.0000 -183.64429 -180.17604 3.46825 1.89179 -179.65877 406.63053
7585.0000 -183.51191 -179.67670 3.83521 1.88737 -179.73531 402.99456
7590.0000 -183.99710 -180.11778 3.87932 1.88692 -179.74309 401.64270
7595.0000 -183.18870 -179.35935 3.82934 1.90858 -179.36829 424.48282
7600.0000 -183.46162 -179.83626 3.62536 1.87979 -179.86649 393.03096
7605.0000 -183.55120 -180.08761 3.46359 1.86575 -180.10944 381.68080
7610.0000 -183.00603 -179.04538 3.96065 1.90306 -179.46370 411.84671
7615.0000 -183.43502 -179.35230 4.08271 1.90941 -179.35382 420.77192
7620.0000 -183.78133 -180.21219 3.56914 1.89788 -179.55348 412.75413
7625.0000 -182.45321 -177.88239 4.57082 1.92820 -179.02857 430.71862
7630.0000 -182.91438 -178.93788 3.97650 1.96969 -178.31067 467.48018
7635.0000 -182.99744 -179.10414 3.89331 1.92872 -179.01970 424.66657
7640.0000 -183.25766 -179.96796 3.28970 1.87732 -179.90923 370.44000
7645.0000 -182.81678 -179.02326 3.79352 1.89197 -179.65562 380.84654
7650.0000 -182.77640 -179.58128 3.19512 1.92808 -179.03080 409.38768
7655.0000 -182.61149 -178.45681 4.15469 1.92560 -179.07361 407.38451
7660.0000 -182.40797 -178.50418 3.90379 1.96417 -178.40619 442.47691
7665.0000 -182.96189 -179.05978 3.90211 1.95359 -178.58919 427.97682
7670.0000 -183.36259 -179.65039 3.71220 1.93011 -178.99551 440.85026
7675.0000 -183.39520 -179.59047 3.80473 1.88407 -179.79236 397.56791
7680.0000 -183.08181 -179.41647 3.66533 1.89855 -179.54180 406.35397
7685.0000 -183.36900 -179.32649 4.04252 1.88581 -179.76225 390.82438
7690.0000 -182.75828 -179.03884 3.71944 1.91140 -179.31937 423.89238
7695.0000 -183.84487 -179.79627 4.04860 1.90655 -179.40340 413.06874
7700.0000 -183.38438 -179.35282 4.03156 1.89355 -179.62841 394.03475
7705.0000 -182.94464 -179.01826 3.92638 1.91110 -179.32468 423.45984
7710.0000 -183.39865 -179.04282 4.35582 1.91214 -179.30667 427.79993
7715.0000 -183.13720 -179.25483 3.88237 1.92229 -179.13085 428.84002
7720.0000 -182.80059 -179.38480 3.41579 1.89543 -179.59574 409.10603
7725.0000 -183.32094 -179.26903 4.05192 1.92349 -179.11013 436.42568
7730.0000 -182.31268 -178.28645 4.02623 1.91137 -179.31992 416.81865
7735.0000 -183.43030 -179.12395 4.30636 1.93613 -178.89146 435.53932
7740.0000 -184.02709 -180.44283 3.58426 1.90846 -179.37033 418.85248
7745.0000 -183.21195 -179.08734 4.12461 1.90461 -179.43685 412.85540
7750.0000 -183.77835 -179.80840 3.96995 1.89831 -179.54602 413.26492
FREEZING PROCESS: loop number 32 T-loop= 383.00000000000000
main_MD> interactions number 32 at Temperature= 383.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.46670 -1.00154 0.47123
force_rgl> df(natom) -1.87820 -2.08449 0.76442
7755.0000 -183.16853 -179.67404 3.49449 1.89405 -179.61961 410.73842
7760.0000 -183.98974 -180.33822 3.65152 1.87337 -179.97763 398.14565
7765.0000 -183.79715 -180.12849 3.66866 1.85147 -180.35667 380.51743
7770.0000 -183.17538 -179.82829 3.34709 1.88059 -179.85271 392.01410
7775.0000 -183.35741 -180.05462 3.30279 1.86842 -180.06331 381.58025
7780.0000 -183.43887 -179.82959 3.60928 1.87459 -179.95644 394.55797
7785.0000 -183.72712 -179.99527 3.73185 1.87445 -179.95883 397.25721
7790.0000 -183.96022 -180.03608 3.92414 1.87210 -179.99953 394.44099
7795.0000 -183.99192 -179.84465 4.14726 1.88129 -179.84055 403.39151
7800.0000 -184.27699 -180.47617 3.80082 1.85140 -180.35787 374.53160
7805.0000 -184.32875 -180.91437 3.41438 1.82640 -180.79057 356.49221
7810.0000 -183.91754 -180.71436 3.20319 1.85033 -180.37631 371.65987
7815.0000 -184.05641 -180.94978 3.10663 1.82737 -180.77371 354.55516
7820.0000 -183.78278 -179.46772 4.31506 1.84111 -180.53596 366.49260
7825.0000 -183.71742 -180.30746 3.40996 1.90283 -179.46782 421.23850
7830.0000 -184.27671 -181.25882 3.01789 1.83023 -180.72425 356.93265
7835.0000 -183.69842 -180.00195 3.69647 1.82052 -180.89235 347.60301
7840.0000 -183.34435 -179.86790 3.47646 1.86750 -180.07925 389.54775
7845.0000 -183.05255 -179.77257 3.27999 1.88264 -179.81721 395.96491
7850.0000 -184.43168 -181.07037 3.36130 1.85485 -180.29812 376.86036
7855.0000 -183.57456 -180.72516 2.84940 1.82865 -180.75161 356.19209
7860.0000 -184.09594 -180.19987 3.89606 1.83254 -180.68430 362.40735
7865.0000 -183.85568 -180.63619 3.21948 1.84194 -180.52153 368.46118
7870.0000 -183.19466 -179.94176 3.25290 1.85230 -180.34224 369.74750
7875.0000 -183.43564 -179.71326 3.72238 1.88465 -179.78231 405.01853
7880.0000 -183.57047 -180.28315 3.28733 1.87543 -179.94193 394.01251
7885.0000 -183.77289 -180.16503 3.60786 1.89765 -179.55742 412.68267
7890.0000 -183.54661 -179.88047 3.66613 1.88397 -179.79421 397.30245
7895.0000 -184.11687 -180.16131 3.95557 1.87258 -179.99118 392.77352
7900.0000 -183.77707 -180.25198 3.52508 1.82479 -180.81843 350.64815
7905.0000 -183.42417 -178.93585 4.48832 1.88804 -179.72367 404.36223
7910.0000 -183.65276 -179.22267 4.43009 1.90980 -179.34705 424.16270
7915.0000 -183.47475 -179.90075 3.57400 1.89235 -179.64908 413.70405
7920.0000 -184.08733 -180.86706 3.22028 1.82750 -180.77153 354.73812
7925.0000 -184.07521 -180.56431 3.51091 1.84141 -180.53075 363.25509
7930.0000 -183.25934 -179.60592 3.65342 1.85086 -180.36710 375.07295
7935.0000 -184.26804 -179.83162 4.43642 1.87840 -179.89062 399.67198
7940.0000 -184.45969 -181.09303 3.36666 1.83198 -180.69385 356.70525
7945.0000 -184.39067 -181.66952 2.72115 1.78791 -181.45667 321.75150
7950.0000 -184.48319 -181.09490 3.38829 1.80853 -181.09978 338.10617
7955.0000 -183.78828 -180.28963 3.49865 1.82460 -180.82158 353.64718
7960.0000 -183.67837 -180.35994 3.31843 1.84049 -180.54665 367.26505
7965.0000 -184.09601 -180.64095 3.45506 1.85645 -180.27048 375.84126
7970.0000 -184.16818 -181.60484 2.56334 1.81829 -180.93086 343.50934
7975.0000 -183.84089 -180.30820 3.53269 1.81635 -180.96445 345.55367
7980.0000 -183.78561 -180.68563 3.09997 1.84478 -180.47245 366.69434
7985.0000 -184.66149 -180.98343 3.67806 1.84082 -180.54100 364.80707
7990.0000 -183.60901 -180.25196 3.35705 1.84245 -180.51265 365.94407
7995.0000 -184.21529 -181.30027 2.91502 1.82656 -180.78766 355.07506
8000.0000 -183.74842 -180.23867 3.50975 1.84853 -180.40755 367.39106
FREEZING PROCESS: loop number 33 T-loop= 358.00000000000000
main_MD> interactions number 33 at Temperature= 358.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.34530 -0.26908 -1.29726
force_rgl> df(natom) 3.37146 1.73537 0.64663
8005.0000 -183.83538 -180.49364 3.34173 1.86561 -180.11186 387.05586
8010.0000 -184.25802 -181.17625 3.08176 1.81788 -180.93792 343.94666
8015.0000 -183.79081 -180.45191 3.33890 1.81416 -181.00226 340.11615
8020.0000 -184.14861 -180.88308 3.26553 1.84582 -180.45441 369.86030
8025.0000 -183.82847 -180.40406 3.42441 1.84101 -180.53771 364.36277
8030.0000 -183.55641 -180.37110 3.18531 1.84865 -180.40546 374.75865
8035.0000 -183.31520 -180.13065 3.18455 1.84674 -180.43855 373.14637
8040.0000 -184.03041 -180.37487 3.65554 1.84680 -180.43738 368.91760
8045.0000 -183.82652 -180.30720 3.51932 1.85616 -180.27553 378.31779
8050.0000 -183.80712 -179.89438 3.91274 1.84639 -180.44446 369.39499
8055.0000 -183.87431 -180.91599 2.95832 1.84104 -180.53716 365.83277
8060.0000 -184.46747 -181.08553 3.38195 1.80355 -181.18591 333.53515
8065.0000 -184.83402 -181.87425 2.95977 1.79255 -181.37629 326.64824
8070.0000 -184.20559 -181.16620 3.03939 1.79343 -181.36104 322.98400
8075.0000 -184.13785 -180.63031 3.50754 1.82239 -180.85986 350.91536
8080.0000 -184.08257 -180.93919 3.14338 1.83137 -180.70454 359.35570
8085.0000 -183.47574 -179.96119 3.51455 1.83917 -180.56956 361.25170
8090.0000 -183.46453 -179.80854 3.65599 1.86001 -180.20876 376.62185
8095.0000 -183.87543 -179.42566 4.44977 1.88283 -179.81394 396.25101
8100.0000 -183.97980 -180.69100 3.28880 1.86196 -180.17503 378.20901
8105.0000 -183.66871 -180.12578 3.54294 1.84603 -180.45070 363.03571
8110.0000 -183.90511 -180.62653 3.27858 1.84960 -180.38904 372.53812
8115.0000 -184.29668 -181.03726 3.25942 1.81627 -180.96581 346.76864
8120.0000 -184.46807 -181.39457 3.07350 1.82538 -180.80823 357.51062
8125.0000 -184.42507 -181.42183 3.00325 1.79309 -181.36697 326.84371
8130.0000 -184.08480 -181.41211 2.67269 1.78481 -181.51022 320.17778
8135.0000 -184.25535 -180.82825 3.42710 1.81882 -180.92175 347.39941
8140.0000 -183.58802 -180.03794 3.55008 1.83456 -180.64928 358.66382
8145.0000 -184.28355 -181.25596 3.02760 1.83444 -180.65143 361.61561
8150.0000 -184.45497 -181.33414 3.12083 1.81311 -181.02046 339.72813
8155.0000 -184.11245 -180.98149 3.13096 1.80882 -181.09479 330.68734
8160.0000 -184.06216 -180.77310 3.28906 1.82239 -180.85990 343.44478
8165.0000 -183.94480 -180.69226 3.25254 1.82620 -180.79391 348.07794
8170.0000 -184.31800 -181.00673 3.31127 1.82933 -180.73975 362.76031
8175.0000 -184.22670 -180.74085 3.48585 1.80059 -181.23722 337.80735
8180.0000 -184.22933 -180.95971 3.26961 1.82175 -180.87098 357.75670
8185.0000 -183.62970 -180.53891 3.09079 1.84852 -180.40762 379.93127
8190.0000 -183.95889 -181.11780 2.84109 1.82385 -180.83464 359.53252
8195.0000 -184.03175 -180.28098 3.75077 1.83660 -180.61396 370.77617
8200.0000 -183.75306 -180.24572 3.50734 1.84986 -180.38444 382.14589
8205.0000 -184.21117 -180.43317 3.77800 1.86060 -180.19856 390.88590
8210.0000 -184.20685 -181.04992 3.15692 1.80101 -181.22996 341.26980
8215.0000 -184.47114 -181.35752 3.11363 1.81138 -181.05042 348.92272
8220.0000 -183.48137 -180.16303 3.31835 1.82930 -180.74032 359.31972
8225.0000 -183.26518 -179.41972 3.84546 1.88235 -179.82225 407.16432
8230.0000 -183.97297 -180.65379 3.31918 1.86874 -180.05780 396.61226
8235.0000 -183.72289 -180.49349 3.22940 1.84534 -180.46263 376.58441
8240.0000 -183.86809 -180.51146 3.35663 1.82771 -180.76781 363.35615
8245.0000 -184.09178 -180.82464 3.26714 1.84245 -180.51267 380.83392
8250.0000 -184.19369 -180.66545 3.52824 1.84756 -180.42424 386.43069
FREEZING PROCESS: loop number 34 T-loop= 333.00000000000000
main_MD> interactions number 34 at Temperature= 333.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.35414 1.40770 -1.98247
force_rgl> df(natom) 0.09711 -2.70928 0.22683
8255.0000 -184.55991 -180.96246 3.59745 1.83704 -180.60634 369.78219
8260.0000 -184.79983 -181.26608 3.53376 1.81982 -180.90444 357.84825
8265.0000 -184.53035 -181.18529 3.34506 1.80661 -181.13304 343.10898
8270.0000 -183.93130 -180.75574 3.17556 1.82715 -180.77746 356.05934
8275.0000 -184.57973 -181.32432 3.25542 1.82357 -180.83946 362.25812
8280.0000 -185.20710 -181.94710 3.26001 1.78181 -181.56228 321.57483
8285.0000 -184.12281 -181.59496 2.52786 1.77467 -181.68580 319.28400
8290.0000 -184.26324 -181.01559 3.24765 1.80472 -181.16571 341.14658
8295.0000 -184.80185 -181.57529 3.22656 1.79580 -181.32018 332.44288
8300.0000 -184.07512 -181.32020 2.75493 1.78770 -181.46026 327.54316
8305.0000 -184.56048 -181.96650 2.59398 1.78898 -181.43818 328.10414
8310.0000 -184.30649 -181.46562 2.84086 1.75873 -181.96169 303.74989
8315.0000 -184.62328 -181.40572 3.21756 1.79407 -181.34997 332.36768
8320.0000 -184.82064 -181.79843 3.02221 1.77834 -181.62225 318.67483
8325.0000 -184.78969 -181.49230 3.29739 1.77456 -181.68778 318.98318
8330.0000 -184.32024 -181.21391 3.10634 1.78549 -181.49854 325.89601
8335.0000 -184.32842 -181.36863 2.95979 1.79019 -181.41724 328.97812
8340.0000 -184.63071 -181.52020 3.11051 1.77809 -181.62659 318.46243
8345.0000 -184.76324 -180.99949 3.76375 1.80813 -181.10668 343.39445
8350.0000 -184.37935 -181.26118 3.11817 1.81980 -180.90465 359.52268
8355.0000 -184.72580 -181.69159 3.03421 1.78152 -181.56728 323.32720
8360.0000 -184.53107 -181.35121 3.17986 1.79551 -181.32513 334.12423
8365.0000 -183.97826 -180.43591 3.54235 1.84277 -180.50715 374.02997
8370.0000 -184.35681 -181.06804 3.28877 1.81961 -180.90797 352.04055
8375.0000 -184.83301 -181.50804 3.32497 1.78816 -181.45224 330.16076
8380.0000 -184.19561 -181.00675 3.18886 1.80032 -181.24191 337.99990
8385.0000 -184.32028 -181.22876 3.09152 1.80105 -181.22917 339.43889
8390.0000 -184.98055 -182.40156 2.57899 1.80029 -181.24242 335.89322
8395.0000 -184.68389 -181.81398 2.86991 1.74402 -182.21626 290.98719
8400.0000 -184.41001 -181.29643 3.11358 1.77682 -181.64853 319.21988
8405.0000 -184.48086 -181.63265 2.84822 1.78488 -181.50915 322.12009
8410.0000 -184.90058 -181.91132 2.98926 1.78433 -181.51858 327.70163
8415.0000 -184.32158 -181.90571 2.41587 1.76698 -181.81895 309.79484
8420.0000 -184.50353 -181.39657 3.10696 1.77323 -181.71066 315.21870
8425.0000 -184.44933 -181.83057 2.61876 1.77096 -181.75008 311.27141
8430.0000 -184.15971 -181.27131 2.88840 1.78828 -181.45030 326.85913
8435.0000 -184.44392 -180.94508 3.49884 1.79175 -181.39016 333.21247
8440.0000 -185.10110 -181.77875 3.32235 1.79598 -181.31694 337.87171
8445.0000 -184.16076 -180.72220 3.43856 1.79908 -181.26340 337.16521
8450.0000 -184.93496 -181.40475 3.53021 1.81577 -180.97451 349.93459
8455.0000 -184.28166 -181.25880 3.02285 1.79259 -181.37562 331.70879
8460.0000 -184.75136 -181.96960 2.78176 1.79103 -181.40261 330.77431
8465.0000 -184.47622 -181.62149 2.85473 1.76158 -181.91233 306.22720
8470.0000 -184.57646 -181.36785 3.20861 1.78870 -181.44298 327.84466
8475.0000 -184.58907 -181.07148 3.51760 1.78826 -181.45052 327.94953
8480.0000 -184.62348 -181.58404 3.03944 1.79283 -181.37153 332.03633
8485.0000 -184.76305 -182.03317 2.72988 1.75933 -181.95123 304.94748
8490.0000 -184.34477 -181.44324 2.90153 1.78731 -181.46698 327.02950
8495.0000 -184.23938 -181.05112 3.18826 1.81348 -181.01419 351.98678
8500.0000 -183.93032 -180.45384 3.47648 1.83285 -180.67888 368.76286
FREEZING PROCESS: loop number 35 T-loop= 308.00000000000000
main_MD> interactions number 35 at Temperature= 308.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.17932 -0.05925 0.71354
force_rgl> df(natom) -3.37113 1.13697 -3.15415
8505.0000 -184.56430 -181.48160 3.08270 1.79628 -181.31181 335.95351
8510.0000 -184.74250 -181.98394 2.75856 1.76682 -181.82158 308.15627
8515.0000 -184.93258 -181.57394 3.35864 1.78189 -181.56087 323.12586
8520.0000 -184.80046 -182.16747 2.63299 1.77705 -181.64457 318.63200
8525.0000 -185.24994 -182.76636 2.48358 1.74390 -182.21838 292.91709
8530.0000 -184.86950 -182.21809 2.65142 1.73665 -182.34375 283.08479
8535.0000 -184.85942 -182.14726 2.71216 1.74059 -182.27569 287.86412
8540.0000 -184.21965 -181.37227 2.84738 1.77528 -181.67528 316.62955
8545.0000 -184.60492 -182.10271 2.50220 1.77049 -181.75811 315.58090
8550.0000 -184.26733 -181.93467 2.33266 1.76587 -181.83805 307.99661
8555.0000 -184.82938 -182.28510 2.54428 1.74677 -182.16871 294.04458
8560.0000 -184.57448 -181.54003 3.03445 1.75009 -182.11117 298.45131
8565.0000 -184.83670 -182.00824 2.82845 1.77796 -181.62892 322.10670
8570.0000 -184.36661 -181.48992 2.87669 1.76502 -181.85278 309.16408
8575.0000 -184.85499 -181.89341 2.96158 1.77576 -181.66689 317.59630
8580.0000 -184.74162 -181.69754 3.04409 1.78643 -181.48220 324.04313
8585.0000 -184.83490 -181.85537 2.97953 1.77525 -181.67583 320.51919
8590.0000 -184.13388 -180.94867 3.18521 1.80295 -181.19643 337.62304
8595.0000 -184.22791 -180.95460 3.27331 1.81076 -181.06110 346.46359
8600.0000 -184.23972 -180.93812 3.30159 1.80021 -181.24372 336.35451
8605.0000 -184.48396 -181.41895 3.06502 1.79835 -181.27592 335.81556
8610.0000 -184.57848 -181.49522 3.08325 1.78362 -181.53095 327.56692
8615.0000 -184.38785 -181.81069 2.57716 1.77063 -181.75569 313.78792
8620.0000 -184.44402 -181.73405 2.70997 1.76363 -181.87687 307.46797
8625.0000 -184.66150 -181.19122 3.47028 1.77979 -181.59725 322.63399
8630.0000 -184.52547 -181.73048 2.79499 1.78642 -181.48247 325.80082
8635.0000 -185.18185 -181.91476 3.26709 1.76761 -181.80795 307.94129
8640.0000 -184.69343 -181.54152 3.15191 1.76372 -181.87531 310.45528
8645.0000 -184.55065 -181.47320 3.07745 1.79126 -181.39859 330.92302
8650.0000 -184.92527 -182.38653 2.53873 1.74455 -182.20705 292.62172
8655.0000 -184.75601 -182.14115 2.61486 1.75572 -182.01385 300.93620
8660.0000 -184.80774 -182.36648 2.44127 1.74985 -182.11527 294.79727
8665.0000 -184.84749 -182.41823 2.42926 1.72820 -182.49013 275.87352
8670.0000 -185.16051 -182.60706 2.55344 1.72225 -182.59309 269.29558
8675.0000 -185.22676 -182.12403 3.10273 1.73521 -182.36879 282.08342
8680.0000 -184.27320 -181.36581 2.90739 1.78502 -181.50668 323.78966
8685.0000 -184.76144 -181.49740 3.26404 1.79270 -181.37377 334.75436
8690.0000 -184.93078 -182.27174 2.65905 1.75964 -181.94586 304.01596
8695.0000 -185.35895 -183.04788 2.31107 1.71883 -182.65225 267.50847
8700.0000 -184.81003 -182.00476 2.80527 1.72790 -182.49520 275.96064
8705.0000 -185.42345 -182.71628 2.70717 1.73720 -182.33424 282.55639
8710.0000 -185.02813 -182.65800 2.37012 1.72343 -182.57265 272.25231
8715.0000 -184.18951 -181.45820 2.73131 1.75162 -182.08465 293.48849
8720.0000 -185.09364 -181.95802 3.13562 1.77494 -181.68115 313.39684
8725.0000 -184.85787 -182.58488 2.27299 1.74343 -182.22653 290.12313
8730.0000 -184.71513 -181.45711 3.25802 1.77146 -181.74127 314.56925
8735.0000 -184.87714 -182.02596 2.85118 1.77278 -181.71850 313.32381
8740.0000 -184.24707 -181.43546 2.81160 1.76393 -181.87162 306.74504
8745.0000 -184.82109 -181.75428 3.06681 1.77257 -181.72212 316.43036
8750.0000 -184.65681 -181.57085 3.08597 1.76561 -181.84254 306.65022
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 13 [min], 29.1507521 [s].
main_MD> Deallocating global variables
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