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nanoparticlesims/growth_Melting_Silver_ICO_2451/freezeSims/run_65/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_65.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 = 65 ntipo2 = 0
read_input> Finish reading input
main_MD> Allocating global variables
main_MD> Number of outputs that will be created: 1650
main_MD> Size of nv and nvoiz: 65 6500
main_MD> Size of nv and nvoiz: 65 6500
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 = 65
main_MD> Consider changing parameter nsiz in module_parameters.f90 for performance
main_MD> collvar_wanted = F
main_MD> INPUT AND POTENTIAL FILE READING IS DONE
main_MD> THERMALIZATION IS STARTING
init> 3.7793071133508903E-002 -8.6466908036287510E-002 -0.10622373119253843 initial drift of cluster / NP1 for coalescence
init> 0.35104667532423039 0.34713946657978051 0.32889269775458269 scaling for velocity /for coalescence NP1
init.f90 > facguy = 3.6123167651443892E-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) 1.38986 0.84676 -0.83611
force_rgl> df(natom) 0.38688 1.10617 0.17135
preparo> THERMALIZATION PROCESS AT 1132.7041359112905
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -143.60016411166652 8.2123387711247116 -151.81250288279122 6.3591562039328484E-004
preparo> END THERMALISATION ON NPAST DEFINE IN PARACLUSTER MODULE
main_MD> Time-loop is starting for freezing
main_MD> Now the computation of EXECUTION TIME starts
main_MD> Running from loop 1 to 33
FREEZING PROCESS: loop number 1 T-loop= 1107.0000000000000
main_MD> interactions number 1 at Temperature= 1107.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.49857 0.88013 1.58933
force_rgl> df(natom) -6.69804 0.58254 -4.16487
5.0000 -152.78541 -143.53932 9.24609 2.95187 -144.02932 1113.76138
10.0000 -152.16425 -143.08364 9.08061 3.01295 -143.04188 1157.78530
15.0000 -153.80055 -144.03356 9.76699 2.96017 -143.89522 1144.10591
20.0000 -155.01245 -146.46816 8.54429 2.85245 -145.63661 1058.24120
25.0000 -152.51850 -144.39527 8.12323 2.79049 -146.63833 999.72177
30.0000 -154.61353 -145.90056 8.71297 2.88460 -145.11690 1084.66069
35.0000 -154.54650 -146.20202 8.34449 2.86010 -145.51294 1086.10553
40.0000 -155.23157 -146.68213 8.54944 2.76100 -147.11507 988.79817
45.0000 -154.41557 -144.75686 9.65871 2.82846 -146.02437 1036.33456
50.0000 -153.98001 -145.11631 8.86370 2.89765 -144.90587 1055.36949
55.0000 -152.21191 -143.78329 8.42862 2.88768 -145.06705 1056.95363
60.0000 -152.28202 -143.44753 8.83448 2.93323 -144.33070 1074.05757
65.0000 -153.82244 -144.49831 9.32413 2.98374 -143.51413 1129.24939
70.0000 -152.97124 -144.46833 8.50292 2.87862 -145.21352 1052.45425
75.0000 -153.01373 -141.79082 11.22291 3.01554 -143.00012 1159.34032
80.0000 -155.10298 -144.75626 10.34672 3.00045 -143.24396 1144.37786
85.0000 -152.88892 -143.38698 9.50193 2.91820 -144.57367 1090.97956
90.0000 -152.28212 -143.22506 9.05705 3.00395 -143.18745 1139.71856
95.0000 -152.98653 -142.73902 10.24751 3.03861 -142.62709 1178.46740
100.0000 -152.04747 -142.76463 9.28284 3.01909 -142.94260 1157.84126
105.0000 -152.77116 -144.48847 8.28269 3.06111 -142.26332 1188.20616
110.0000 -154.16502 -144.88397 9.28105 2.92939 -144.39284 1106.90108
115.0000 -152.26441 -143.54613 8.71828 2.89475 -144.95272 1067.40998
120.0000 -153.19641 -145.06250 8.13391 2.89116 -145.01079 1059.98495
125.0000 -154.25213 -145.66146 8.59066 2.90130 -144.84688 1045.58408
130.0000 -153.71984 -143.75579 9.96404 2.83840 -145.86369 1030.18307
135.0000 -151.22853 -140.19209 11.03644 3.07042 -142.11282 1187.34068
140.0000 -152.49006 -141.51906 10.97100 3.11889 -141.32934 1219.88962
145.0000 -152.80864 -144.19339 8.61525 2.98318 -143.52326 1115.86686
150.0000 -151.99816 -142.26292 9.73524 3.06032 -142.27611 1201.14283
155.0000 -152.46999 -141.37377 11.09622 3.12005 -141.31050 1238.62297
160.0000 -151.73457 -142.14206 9.59251 3.05783 -142.31634 1174.55540
165.0000 -151.97964 -143.41052 8.56911 3.02213 -142.89361 1144.24889
170.0000 -152.38306 -144.07030 8.31275 2.98124 -143.55450 1133.69296
175.0000 -154.27959 -144.78404 9.49555 2.91513 -144.62325 1113.36533
180.0000 -152.09289 -143.46101 8.63188 2.89326 -144.97687 1089.98324
185.0000 -151.67379 -142.48484 9.18895 3.05016 -142.44039 1194.67746
190.0000 -153.31898 -144.75595 8.56303 2.96939 -143.74611 1145.39950
195.0000 -151.75087 -142.62326 9.12761 2.98854 -143.43662 1126.61515
200.0000 -153.18456 -143.78893 9.39564 2.96116 -143.87911 1112.70747
205.0000 -153.37260 -144.02009 9.35251 2.91850 -144.56879 1111.26950
210.0000 -154.19928 -146.20592 7.99335 2.93296 -144.33516 1101.80101
215.0000 -154.18294 -145.16685 9.01609 2.92904 -144.39845 1096.60567
220.0000 -155.66085 -145.01972 10.64113 2.84823 -145.70490 1057.38663
225.0000 -155.39947 -146.78103 8.61843 2.82973 -146.00395 994.10074
230.0000 -153.75480 -144.05386 9.70094 2.84934 -145.68690 1021.26007
235.0000 -153.28383 -144.94743 8.33640 2.97466 -143.66096 1133.10330
240.0000 -152.28842 -143.84845 8.43997 2.93088 -144.36877 1083.67907
245.0000 -152.88100 -144.23020 8.65080 2.94117 -144.20241 1097.73419
250.0000 -153.72420 -143.32138 10.40282 2.92986 -144.38518 1077.57934
FREEZING PROCESS: loop number 2 T-loop= 1082.0000000000000
main_MD> interactions number 2 at Temperature= 1082.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.32413 -0.06341 -0.35639
force_rgl> df(natom) 4.18170 -0.17978 -1.78600
255.0000 -152.57935 -143.00548 9.57387 3.04243 -142.56543 1180.04026
260.0000 -151.57684 -142.45903 9.11781 3.00711 -143.13643 1161.07757
265.0000 -151.82054 -142.53586 9.28468 3.07951 -141.96593 1186.63190
270.0000 -153.26468 -144.37573 8.88894 2.98498 -143.49405 1122.79974
275.0000 -155.94528 -147.24232 8.70296 2.83119 -145.98033 1058.22931
280.0000 -155.01047 -145.88060 9.12987 2.82464 -146.08619 1033.40248
285.0000 -153.80272 -144.48072 9.32200 2.87469 -145.27702 1062.52320
290.0000 -154.99436 -145.43461 9.55975 2.89545 -144.94153 1087.16566
295.0000 -154.86214 -144.78012 10.08202 2.85710 -145.56142 1079.84747
300.0000 -153.67827 -144.24522 9.43305 2.90988 -144.70827 1080.62808
305.0000 -155.21346 -145.48538 9.72808 2.88959 -145.03616 1090.60334
310.0000 -152.28522 -144.69977 7.58546 2.88073 -145.17941 1053.76448
315.0000 -153.80867 -144.61846 9.19021 2.87279 -145.30787 1065.63390
320.0000 -154.02285 -144.45153 9.57132 2.88055 -145.18242 1070.79006
325.0000 -153.32662 -143.28932 10.03730 2.99771 -143.28831 1157.62302
330.0000 -152.82673 -143.65631 9.17042 3.03481 -142.68851 1184.30900
335.0000 -153.39303 -144.65800 8.73503 2.92628 -144.44305 1051.05251
340.0000 -152.94092 -144.13151 8.80941 2.95585 -143.96511 1116.97297
345.0000 -153.26098 -145.10209 8.15889 2.92391 -144.48140 1069.54323
350.0000 -153.05283 -144.43797 8.61486 2.89712 -144.91447 1085.55212
355.0000 -154.62663 -145.27472 9.35191 2.91388 -144.64354 1062.19045
360.0000 -152.72058 -143.43316 9.28742 2.88286 -145.14508 1077.46628
365.0000 -152.07764 -141.98992 10.08772 2.99097 -143.39732 1154.42082
370.0000 -151.30668 -142.08722 9.21946 3.05751 -142.32160 1184.12910
375.0000 -151.57456 -141.59808 9.97647 3.08816 -141.82612 1217.45051
380.0000 -150.42319 -141.18529 9.23789 3.10608 -141.53644 1222.38401
385.0000 -153.30017 -145.18734 8.11283 2.98676 -143.46536 1112.97919
390.0000 -154.63014 -144.78276 9.84738 2.93104 -144.36618 1064.82224
395.0000 -153.54530 -145.40820 8.13710 2.88971 -145.03432 1061.34311
400.0000 -154.14750 -145.46944 8.67807 2.86650 -145.40945 1047.10038
405.0000 -153.53828 -145.67987 7.85841 2.85263 -145.63379 1018.56186
410.0000 -152.83156 -144.54607 8.28548 2.95764 -143.93609 1107.72412
415.0000 -155.05408 -146.88504 8.16904 2.79653 -146.54061 1026.24791
420.0000 -151.88477 -141.88938 9.99538 2.93809 -144.25212 1092.99787
425.0000 -152.49638 -141.78412 10.71227 3.09404 -141.73100 1189.22980
430.0000 -153.88449 -146.15975 7.72473 2.94649 -144.11629 1093.18275
435.0000 -152.70599 -143.57589 9.13010 2.89048 -145.02182 1059.14992
440.0000 -154.92938 -145.24165 9.68773 2.93173 -144.35497 1109.60130
445.0000 -153.23334 -144.41819 8.81515 2.93163 -144.35651 1109.99317
450.0000 -154.36777 -146.04063 8.32715 2.92888 -144.40109 1079.11176
455.0000 -154.37831 -145.73073 8.64758 2.88941 -145.03909 1089.29347
460.0000 -155.43717 -145.49798 9.93919 2.78235 -146.76992 990.00697
465.0000 -152.48597 -142.52991 9.95606 3.01097 -143.07400 1154.22657
470.0000 -152.22137 -142.40626 9.81511 3.02395 -142.86407 1200.29560
475.0000 -154.66454 -144.94387 9.72067 3.02616 -142.82842 1157.71627
480.0000 -156.25539 -147.46049 8.79490 2.74752 -147.33299 991.38117
485.0000 -154.14136 -146.49578 7.64559 2.73351 -147.55946 968.73871
490.0000 -153.94367 -142.31442 11.62925 2.98606 -143.47660 1125.31164
495.0000 -153.02229 -143.15104 9.87125 3.03563 -142.67523 1190.62172
500.0000 -154.92727 -145.80356 9.12370 2.94350 -144.16472 1116.37018
FREEZING PROCESS: loop number 3 T-loop= 1057.0000000000000
main_MD> interactions number 3 at Temperature= 1057.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.03375 -1.71878 -0.58317
force_rgl> df(natom) 0.54076 0.66992 -0.39325
505.0000 -152.88667 -143.18705 9.69963 2.92771 -144.41988 1110.52378
510.0000 -155.06348 -146.85231 8.21117 2.87596 -145.25663 1070.86669
515.0000 -156.28291 -147.97324 8.30967 2.78861 -146.66872 996.51829
520.0000 -155.20740 -145.96994 9.23746 2.75371 -147.23293 978.30798
525.0000 -152.56397 -143.83105 8.73291 2.90957 -144.71318 1095.36083
530.0000 -155.65687 -147.00692 8.64994 2.84628 -145.73632 1045.43915
535.0000 -154.60780 -144.24955 10.35826 2.83505 -145.91794 1001.57749
540.0000 -153.74780 -145.16715 8.58065 2.88913 -145.04367 1071.07283
545.0000 -154.39759 -144.01035 10.38724 2.86281 -145.46920 1038.31160
550.0000 -155.97008 -147.04449 8.92559 2.86197 -145.48277 1045.08506
555.0000 -154.82044 -145.69962 9.12082 2.82999 -145.99978 1034.48597
560.0000 -154.00726 -146.80392 7.20335 2.79221 -146.61045 1004.31751
565.0000 -151.94509 -143.14903 8.79606 2.83625 -145.89850 1013.36059
570.0000 -152.38623 -143.24391 9.14233 2.96785 -143.77103 1128.70302
575.0000 -153.46646 -144.83804 8.62842 2.94083 -144.20787 1101.73578
580.0000 -154.94002 -145.63832 9.30169 2.80469 -146.40875 1016.40501
585.0000 -153.76491 -145.92801 7.83690 2.85824 -145.54310 1029.73722
590.0000 -152.90208 -145.24580 7.65629 2.83709 -145.88486 1020.47028
595.0000 -154.61342 -145.43803 9.17538 2.92322 -144.49251 1089.77918
600.0000 -155.42721 -147.22763 8.19959 2.78641 -146.70428 1013.14831
605.0000 -154.38027 -145.70065 8.67962 2.78915 -146.65992 999.23345
610.0000 -156.21231 -148.49991 7.71240 2.86648 -145.40983 1086.82165
615.0000 -156.23472 -148.23499 7.99973 2.68963 -148.26876 952.27629
620.0000 -153.38043 -145.79368 7.58675 2.79147 -146.62238 1017.01508
625.0000 -152.96623 -145.98703 6.97920 2.86806 -145.38427 1055.25683
630.0000 -154.54793 -145.56960 8.97833 2.85620 -145.57604 1041.76017
635.0000 -154.67858 -147.05785 7.62074 2.80064 -146.47417 972.29941
640.0000 -155.25186 -147.17047 8.08139 2.78453 -146.73457 984.23772
645.0000 -152.65850 -145.62320 7.03530 2.76712 -147.01607 1008.85726
650.0000 -156.24681 -147.40173 8.84507 2.83148 -145.97564 1077.56006
655.0000 -155.10506 -146.36350 8.74157 2.72333 -147.72405 987.57110
660.0000 -152.93968 -144.01251 8.92716 2.92103 -144.52799 1068.37620
665.0000 -153.83393 -144.84280 8.99113 2.99853 -143.27498 1135.89358
670.0000 -153.87685 -145.34922 8.52764 2.87720 -145.23645 1027.93720
675.0000 -154.84260 -148.05046 6.79214 2.82146 -146.13756 1037.31780
680.0000 -155.23977 -145.81177 9.42799 2.80727 -146.36699 1023.55900
685.0000 -152.68062 -144.49386 8.18676 2.93000 -144.38299 1118.43624
690.0000 -153.26103 -145.61790 7.64312 2.89677 -144.92007 1045.63261
695.0000 -153.56975 -145.36892 8.20083 2.83726 -145.88218 1015.44694
700.0000 -154.68310 -146.74781 7.93529 2.89394 -144.96594 1059.62734
705.0000 -155.32575 -148.66182 6.66392 2.73124 -147.59618 921.54109
710.0000 -155.07756 -146.88272 8.19484 2.73631 -147.51425 980.88255
715.0000 -156.65936 -148.10083 8.55853 2.69792 -148.13480 954.56754
720.0000 -153.98474 -146.09456 7.89018 2.75358 -147.23505 989.42674
725.0000 -153.70359 -143.94292 9.76067 2.87958 -145.19810 1046.02224
730.0000 -153.65937 -145.52130 8.13808 2.89728 -144.91187 1060.38213
735.0000 -152.50336 -143.95066 8.55270 2.89242 -144.99042 1052.40044
740.0000 -151.40550 -141.25044 10.15506 3.03214 -142.73179 1152.86830
745.0000 -152.00612 -142.25086 9.75526 3.12087 -141.29722 1249.50217
750.0000 -152.38510 -143.97408 8.41102 2.99260 -143.37088 1109.96005
FREEZING PROCESS: loop number 4 T-loop= 1032.0000000000000
main_MD> interactions number 4 at Temperature= 1032.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.21327 0.33385 -4.04843
force_rgl> df(natom) -3.11691 -0.01979 2.50770
755.0000 -156.56834 -146.04869 10.51965 2.87214 -145.31829 1021.69491
760.0000 -154.30794 -145.96410 8.34384 2.82588 -146.06615 1026.41715
765.0000 -155.38597 -147.22713 8.15884 2.77519 -146.88565 973.76314
770.0000 -152.74476 -145.26389 7.48087 2.78348 -146.75167 965.37816
775.0000 -153.98560 -145.99784 7.98776 2.88220 -145.15565 1041.89423
780.0000 -154.67807 -145.06588 9.61219 2.85894 -145.53176 1060.15114
785.0000 -153.08425 -145.64154 7.44271 2.87860 -145.21394 1059.70872
790.0000 -154.80251 -144.77599 10.02653 2.87944 -145.20029 1067.46948
795.0000 -154.42883 -146.12403 8.30481 2.85839 -145.54060 1052.79036
800.0000 -153.86573 -143.57622 10.28951 2.90907 -144.72122 1085.51304
805.0000 -156.01522 -145.67031 10.34491 2.86708 -145.40014 1062.61355
810.0000 -152.22604 -142.58084 9.64520 2.92086 -144.53066 1057.34102
815.0000 -154.67744 -146.31939 8.35805 2.90832 -144.73347 1078.09831
820.0000 -156.02823 -147.91259 8.11565 2.80086 -146.47060 1020.02504
825.0000 -156.20094 -147.14669 9.05425 2.75428 -147.22365 981.64390
830.0000 -155.31880 -146.96575 8.35306 2.75500 -147.21208 984.30770
835.0000 -154.14153 -144.74235 9.39919 2.88045 -145.18389 1046.30011
840.0000 -156.56200 -146.81269 9.74930 2.82356 -146.10362 1037.66760
845.0000 -155.40619 -145.12934 10.27685 2.81837 -146.18754 1045.26323
850.0000 -155.09601 -146.43759 8.65842 2.76343 -147.07578 995.05446
855.0000 -155.60340 -146.36904 9.23436 2.84048 -145.83012 1046.02975
860.0000 -154.17376 -146.06882 8.10494 2.84696 -145.72545 1081.24525
865.0000 -155.61989 -145.40493 10.21496 2.87261 -145.31078 1079.93392
870.0000 -155.86096 -147.48177 8.37918 2.79602 -146.54893 996.55726
875.0000 -153.70279 -145.67544 8.02735 2.82132 -146.13980 1017.24398
880.0000 -154.24161 -145.87499 8.36662 2.79260 -146.60424 1023.15831
885.0000 -154.27911 -145.20777 9.07134 2.82888 -146.01763 1035.68527
890.0000 -153.66573 -143.96367 9.70207 2.92755 -144.42250 1133.07795
895.0000 -153.22658 -144.83816 8.38843 2.91493 -144.62650 1093.20098
900.0000 -153.81786 -145.08619 8.73166 2.87036 -145.34704 1064.10764
905.0000 -153.67372 -144.49417 9.17955 2.95869 -143.91910 1122.94075
910.0000 -154.41803 -145.31254 9.10548 2.90374 -144.80748 1089.19804
915.0000 -152.83767 -144.06577 8.77190 2.90126 -144.84756 1035.44605
920.0000 -152.41031 -144.29057 8.11975 2.96405 -143.83242 1105.16497
925.0000 -155.04056 -145.56076 9.47980 2.92718 -144.42860 1072.30054
930.0000 -155.05177 -146.86490 8.18687 2.82412 -146.09457 1010.98483
935.0000 -154.95304 -144.94977 10.00328 2.85187 -145.64608 1009.21559
940.0000 -155.26826 -146.99802 8.27023 2.79115 -146.62755 989.71937
945.0000 -155.27499 -147.60252 7.67246 2.78355 -146.75049 1015.80149
950.0000 -154.78346 -146.03590 8.74755 2.71496 -147.85925 919.99940
955.0000 -154.76173 -146.65684 8.10490 2.83090 -145.98493 1029.80463
960.0000 -156.53701 -146.93992 9.59708 2.77347 -146.91343 990.62317
965.0000 -154.09943 -145.23423 8.86521 2.83599 -145.90273 1033.68234
970.0000 -154.43188 -144.39278 10.03910 2.95986 -143.90022 1126.14554
975.0000 -153.37450 -144.24368 9.13083 2.99260 -143.37086 1153.85887
980.0000 -154.93384 -145.11262 9.82122 2.87263 -145.31042 1065.97616
985.0000 -155.68461 -144.48596 11.19865 2.85498 -145.59569 1072.15220
990.0000 -152.45231 -143.15791 9.29439 2.97435 -143.66589 1137.38117
995.0000 -154.32772 -146.01319 8.31453 2.91940 -144.55436 1065.84386
1000.0000 -156.05789 -149.02050 7.03738 2.72245 -147.73829 956.03556
FREEZING PROCESS: loop number 5 T-loop= 1007.0000000000000
main_MD> interactions number 5 at Temperature= 1007.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.32164 0.32174 -0.72034
force_rgl> df(natom) 0.67211 -3.02439 -1.12714
1005.0000 -155.65494 -147.50172 8.15322 2.76733 -147.01270 1019.15857
1010.0000 -155.27479 -148.25998 7.01481 2.69842 -148.12675 961.30006
1015.0000 -155.37789 -147.87301 7.50488 2.72508 -147.69579 942.80509
1020.0000 -155.10273 -146.43556 8.66716 2.75953 -147.13879 960.87555
1025.0000 -155.54077 -147.34424 8.19653 2.77289 -146.92273 1020.64397
1030.0000 -155.49574 -146.54085 8.95489 2.77149 -146.94550 1018.90892
1035.0000 -155.88461 -146.00379 9.88082 2.84364 -145.77913 1020.30189
1040.0000 -155.83073 -146.71252 9.11821 2.76304 -147.08204 996.41027
1045.0000 -155.02544 -147.32096 7.70448 2.78180 -146.77883 1012.06616
1050.0000 -155.01063 -147.59787 7.41276 2.72662 -147.67080 967.45249
1055.0000 -155.51154 -147.30611 8.20543 2.72794 -147.64949 930.19130
1060.0000 -155.90015 -146.21466 9.68549 2.81038 -146.31676 1041.05027
1065.0000 -154.92058 -146.11232 8.80826 2.77536 -146.88294 985.72528
1070.0000 -153.29465 -145.55858 7.73607 2.80715 -146.36903 986.94217
1075.0000 -155.44128 -146.52661 8.91466 2.81019 -146.31980 993.79057
1080.0000 -153.71385 -145.37027 8.34358 2.81520 -146.23889 1015.26848
1085.0000 -153.26972 -145.17978 8.08994 2.88074 -145.17925 1024.99534
1090.0000 -154.36032 -145.24847 9.11184 2.80888 -146.34102 1010.57872
1095.0000 -152.91534 -144.72039 8.19496 2.88431 -145.12161 1078.01387
1100.0000 -154.77063 -146.17755 8.59309 2.84311 -145.78769 1065.76529
1105.0000 -153.74628 -146.12288 7.62339 2.79920 -146.49751 1031.84647
1110.0000 -154.57515 -147.31239 7.26276 2.81329 -146.26963 1002.23169
1115.0000 -156.40703 -148.94056 7.46646 2.73139 -147.59366 948.30799
1120.0000 -158.16844 -150.90182 7.26662 2.58167 -150.01415 855.36850
1125.0000 -157.81537 -150.02497 7.79040 2.54291 -150.64079 835.75522
1130.0000 -157.23146 -149.23056 8.00090 2.63482 -149.15495 915.48062
1135.0000 -155.78058 -148.86475 6.91582 2.64444 -148.99933 900.45163
1140.0000 -155.39430 -147.36016 8.03414 2.66378 -148.68674 900.14392
1145.0000 -156.18641 -148.26662 7.91979 2.72342 -147.72253 975.37751
1150.0000 -156.46664 -147.97644 8.49020 2.66150 -148.72362 919.49672
1155.0000 -156.18777 -148.21983 7.96794 2.70946 -147.94816 942.35093
1160.0000 -155.04337 -147.97244 7.07094 2.68249 -148.38423 924.07328
1165.0000 -155.61826 -148.12065 7.49761 2.73100 -147.59998 930.77160
1170.0000 -156.32105 -146.44965 9.87140 2.78890 -146.66401 988.12919
1175.0000 -155.77747 -148.01265 7.76482 2.75775 -147.16760 983.37636
1180.0000 -155.22584 -145.36228 9.86356 2.85219 -145.64089 1041.17636
1185.0000 -154.41287 -145.54014 8.87273 2.87099 -145.33685 1043.18184
1190.0000 -155.53148 -145.71238 9.81909 2.90088 -144.85370 1119.91275
1195.0000 -155.29375 -147.67724 7.61651 2.79925 -146.49671 1008.15241
1200.0000 -155.40608 -148.48842 6.91766 2.65089 -148.89507 889.37632
1205.0000 -154.82107 -146.40933 8.41173 2.73176 -147.58775 968.47971
1210.0000 -156.17225 -147.54346 8.62878 2.76777 -147.00564 959.13119
1215.0000 -154.95273 -145.99581 8.95692 2.77305 -146.92025 990.82697
1220.0000 -155.03208 -146.76822 8.26385 2.78521 -146.72360 992.01489
1225.0000 -154.25796 -145.38682 8.87114 2.79811 -146.51511 1017.67202
1230.0000 -154.28300 -144.99084 9.29216 2.87365 -145.29384 1043.52529
1235.0000 -154.09623 -145.14724 8.94899 2.88904 -145.04511 1028.12642
1240.0000 -154.98325 -146.15917 8.82408 2.79131 -146.62497 996.71025
1245.0000 -153.34270 -145.82147 7.52123 2.80331 -146.43098 1011.73556
1250.0000 -153.96958 -145.60099 8.36859 2.88002 -145.19086 1060.79524
FREEZING PROCESS: loop number 6 T-loop= 982.00000000000000
main_MD> interactions number 6 at Temperature= 982.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 4.34282 0.17104 1.73559
force_rgl> df(natom) 1.18138 -2.14633 -0.21052
1255.0000 -155.99071 -148.60926 7.38145 2.74257 -147.41303 978.77562
1260.0000 -156.75777 -148.84701 7.91076 2.61823 -149.42312 909.68700
1265.0000 -155.91443 -148.32413 7.59030 2.66358 -148.68986 916.77772
1270.0000 -155.16459 -147.17122 7.99337 2.72696 -147.66536 930.07833
1275.0000 -157.48009 -146.52770 10.95240 2.77337 -146.91500 998.41139
1280.0000 -156.71499 -148.72033 7.99466 2.72535 -147.69142 964.08518
1285.0000 -156.35436 -149.40968 6.94468 2.64328 -149.01818 884.82175
1290.0000 -156.85091 -148.31117 8.53974 2.63491 -149.15335 901.45349
1295.0000 -157.61270 -149.11654 8.49616 2.64565 -148.97978 907.26575
1300.0000 -155.20169 -147.94446 7.25723 2.64260 -149.02906 896.88420
1305.0000 -154.13137 -146.90051 7.23086 2.78139 -146.78541 990.46719
1310.0000 -155.39182 -146.91292 8.47890 2.78633 -146.70553 1000.08751
1315.0000 -154.31216 -145.69574 8.61642 2.83098 -145.98368 1045.86246
1320.0000 -152.83263 -145.98638 6.84625 2.78535 -146.72144 1003.69096
1325.0000 -155.98986 -146.11009 9.87977 2.86940 -145.36254 1080.57642
1330.0000 -155.75660 -147.38220 8.37440 2.78722 -146.69114 1028.11513
1335.0000 -156.60969 -148.21872 8.39096 2.76798 -147.00223 1040.63351
1340.0000 -156.49365 -147.52189 8.97176 2.70524 -148.01650 967.17763
1345.0000 -156.58276 -148.62530 7.95746 2.70383 -148.03922 924.19847
1350.0000 -153.73904 -144.16759 9.57145 2.82561 -146.07055 1039.01443
1355.0000 -154.81477 -146.38142 8.43335 2.89285 -144.98358 1076.85737
1360.0000 -153.64620 -145.40299 8.24321 2.84676 -145.72862 1009.13237
1365.0000 -154.24401 -145.59596 8.64806 2.87650 -145.24781 1047.50909
1370.0000 -154.78456 -146.97867 7.80589 2.83012 -145.99755 1059.88334
1375.0000 -156.26403 -145.34671 10.91732 2.83504 -145.91801 1025.97843
1380.0000 -155.31049 -147.66416 7.64633 2.82766 -146.03740 1036.94389
1385.0000 -154.21659 -146.32735 7.88924 2.78163 -146.78159 969.03977
1390.0000 -154.42963 -146.09392 8.33571 2.78271 -146.76404 991.43790
1395.0000 -155.16098 -145.66790 9.49308 2.82695 -146.04883 1029.29320
1400.0000 -156.76048 -147.10599 9.65449 2.86081 -145.50142 1079.83613
1405.0000 -156.33119 -149.48267 6.84852 2.67405 -148.52074 936.09556
1410.0000 -155.79438 -149.00340 6.79098 2.62114 -149.37603 905.41953
1415.0000 -156.94765 -149.29063 7.65702 2.65670 -148.80112 912.74931
1420.0000 -156.49893 -147.20912 9.28981 2.63009 -149.23132 896.36327
1425.0000 -156.53915 -148.88551 7.65364 2.71966 -147.78341 934.43590
1430.0000 -155.26336 -146.61785 8.64551 2.71204 -147.90646 908.78669
1435.0000 -157.74443 -149.32860 8.41583 2.73022 -147.61266 968.46308
1440.0000 -155.82211 -148.63224 7.18986 2.63583 -149.13857 887.76039
1445.0000 -154.92478 -147.82054 7.10423 2.70505 -148.01955 932.49339
1450.0000 -155.18981 -148.59356 6.59625 2.74424 -147.38594 959.80115
1455.0000 -157.32019 -148.63359 8.68659 2.65601 -148.81237 913.62947
1460.0000 -155.73593 -148.02724 7.70869 2.72386 -147.71543 935.26368
1465.0000 -156.29655 -147.50014 8.79641 2.74459 -147.38026 979.49376
1470.0000 -154.88226 -147.23474 7.64751 2.74699 -147.34153 948.13323
1475.0000 -155.17962 -147.01638 8.16324 2.80309 -146.43464 1015.92575
1480.0000 -155.66568 -147.04903 8.61665 2.76507 -147.04922 973.70101
1485.0000 -155.38993 -147.21897 8.17096 2.71738 -147.82016 968.98591
1490.0000 -154.95065 -146.68977 8.26088 2.79973 -146.48887 993.88752
1495.0000 -154.46549 -146.33786 8.12763 2.80450 -146.41177 1007.39124
1500.0000 -155.61071 -147.64891 7.96180 2.79696 -146.53362 1031.28209
FREEZING PROCESS: loop number 7 T-loop= 957.00000000000000
main_MD> interactions number 7 at Temperature= 957.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.81289 1.17096 -1.95932
force_rgl> df(natom) -1.14446 0.85154 1.90159
1505.0000 -154.75428 -147.42460 7.32968 2.69386 -148.20040 936.47782
1510.0000 -155.57118 -148.17876 7.39242 2.78950 -146.65424 975.52540
1515.0000 -157.01661 -148.36335 8.65327 2.74742 -147.33464 993.12196
1520.0000 -155.99846 -149.31085 6.68761 2.60964 -149.56201 877.45722
1525.0000 -154.91198 -147.45241 7.45957 2.70672 -147.99252 937.52097
1530.0000 -153.49404 -146.23719 7.25685 2.75066 -147.28216 973.48643
1535.0000 -157.20446 -147.61573 9.58873 2.77194 -146.93811 1025.18585
1540.0000 -154.95513 -146.70973 8.24540 2.72422 -147.70956 978.71697
1545.0000 -155.37786 -146.41101 8.96685 2.78028 -146.80327 1002.17778
1550.0000 -156.56999 -147.67174 8.89825 2.74875 -147.31302 976.30340
1555.0000 -156.01821 -147.78429 8.23392 2.65786 -148.78243 910.28683
1560.0000 -156.92388 -148.79611 8.12777 2.73345 -147.56040 960.76396
1565.0000 -156.49923 -148.48532 8.01390 2.65256 -148.86814 893.80492
1570.0000 -155.75673 -149.32134 6.43539 2.64886 -148.92789 905.77911
1575.0000 -155.60181 -148.85808 6.74372 2.68317 -148.37319 926.22538
1580.0000 -157.80197 -149.69332 8.10866 2.62410 -149.32821 921.54055
1585.0000 -156.48250 -148.32017 8.16233 2.66891 -148.60372 960.48899
1590.0000 -155.55454 -147.34148 8.21306 2.66401 -148.68301 933.69199
1595.0000 -154.90511 -146.92551 7.97959 2.78872 -146.66682 992.39376
1600.0000 -155.65849 -146.81004 8.84844 2.77419 -146.90172 977.75982
1605.0000 -157.03151 -148.88311 8.14840 2.72494 -147.69803 946.37864
1610.0000 -154.89962 -147.81471 7.08491 2.69411 -148.19633 918.68753
1615.0000 -154.37988 -145.41062 8.96927 2.76983 -146.97223 976.68798
1620.0000 -155.73127 -149.18329 6.54798 2.69665 -148.15531 936.59807
1625.0000 -156.53614 -147.18242 9.35372 2.74522 -147.37006 975.84057
1630.0000 -156.93334 -148.18082 8.75252 2.75952 -147.13890 1009.60217
1635.0000 -156.02029 -147.53026 8.49003 2.69631 -148.16089 957.38330
1640.0000 -155.02661 -146.63412 8.39249 2.76921 -146.98225 994.33114
1645.0000 -154.92026 -146.79819 8.12207 2.75911 -147.14554 981.99160
1650.0000 -156.10577 -149.22742 6.87835 2.65700 -148.79635 922.46796
1655.0000 -156.53298 -148.92063 7.61236 2.63541 -149.14540 867.26777
1660.0000 -157.20735 -148.33619 8.87116 2.65534 -148.82309 921.99116
1665.0000 -154.98492 -146.51935 8.46557 2.71132 -147.91815 966.43426
1670.0000 -155.17456 -147.76838 7.40618 2.78547 -146.71947 1007.34720
1675.0000 -155.85847 -148.55509 7.30338 2.66473 -148.67135 898.32785
1680.0000 -154.97217 -147.27417 7.69800 2.74795 -147.32602 918.59565
1685.0000 -154.49442 -146.68880 7.80562 2.75873 -147.15175 952.00319
1690.0000 -154.06667 -146.51879 7.54788 2.80291 -146.43757 1017.87500
1695.0000 -156.36149 -147.97843 8.38307 2.74551 -147.36540 980.21422
1700.0000 -155.23917 -146.24580 8.99337 2.73387 -147.55369 969.20470
1705.0000 -154.05691 -145.63842 8.41849 2.77785 -146.84262 979.10694
1710.0000 -154.38919 -147.24106 7.14813 2.81366 -146.26363 1002.57154
1715.0000 -156.93534 -148.54028 8.39507 2.69847 -148.12597 928.00139
1720.0000 -158.09472 -149.75480 8.33992 2.67592 -148.49047 922.58723
1725.0000 -155.29072 -146.29297 8.99775 2.71214 -147.90488 957.97730
1730.0000 -155.24056 -144.43487 10.80570 2.84924 -145.68847 1036.04182
1735.0000 -153.63438 -143.96884 9.66554 2.95059 -144.05011 1099.18099
1740.0000 -155.00602 -146.58034 8.42568 2.86796 -145.38582 1027.15482
1745.0000 -153.78110 -144.75809 9.02300 2.78802 -146.67820 986.10595
1750.0000 -156.36819 -146.22805 10.14014 2.83006 -145.99865 1043.82905
FREEZING PROCESS: loop number 8 T-loop= 932.00000000000000
main_MD> interactions number 8 at Temperature= 932.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.16582 -2.36027 1.55573
force_rgl> df(natom) -0.82896 -0.80788 -2.61268
1755.0000 -156.65922 -149.58447 7.07475 2.68330 -148.37107 925.47663
1760.0000 -157.39721 -148.95735 8.43986 2.61119 -149.53690 882.99091
1765.0000 -157.52170 -149.46660 8.05509 2.63313 -149.18224 927.79089
1770.0000 -157.45194 -149.75413 7.69781 2.59365 -149.82044 902.10946
1775.0000 -157.79146 -149.50232 8.28914 2.60217 -149.68267 884.31591
1780.0000 -156.96624 -149.12283 7.84342 2.59770 -149.75491 867.27926
1785.0000 -155.53468 -148.58944 6.94524 2.62769 -149.27021 891.31378
1790.0000 -157.57726 -148.18059 9.39667 2.69703 -148.14923 922.99022
1795.0000 -155.19900 -149.16012 6.03887 2.65844 -148.77300 906.66599
1800.0000 -154.08709 -147.60192 6.48518 2.69911 -148.11559 926.57585
1805.0000 -156.23167 -148.43425 7.79743 2.69518 -148.17905 934.57890
1810.0000 -156.38812 -148.58533 7.80279 2.66254 -148.70680 912.10246
1815.0000 -156.50072 -148.84387 7.65685 2.68182 -148.39511 917.91248
1820.0000 -155.98060 -147.38794 8.59267 2.69111 -148.24493 943.36236
1825.0000 -155.37899 -146.48740 8.89159 2.80683 -146.37415 1002.22439
1830.0000 -156.04357 -149.08128 6.96229 2.74414 -147.38759 951.79192
1835.0000 -156.36065 -147.40880 8.95185 2.71856 -147.80109 936.51355
1840.0000 -155.60484 -146.54223 9.06261 2.75495 -147.21277 971.62022
1845.0000 -152.84588 -145.06112 7.78477 2.80957 -146.32983 968.99650
1850.0000 -156.38378 -148.57172 7.81206 2.75332 -147.23916 957.41663
1855.0000 -156.83840 -148.84873 7.98967 2.65468 -148.83376 915.50705
1860.0000 -157.44645 -150.59304 6.85341 2.58740 -149.92150 846.51696
1865.0000 -155.60927 -148.22745 7.38182 2.63400 -149.16811 900.63186
1870.0000 -155.90803 -147.93590 7.97213 2.69115 -148.24428 976.09912
1875.0000 -155.51879 -149.36970 6.14910 2.68561 -148.33380 921.73580
1880.0000 -155.01745 -147.49617 7.52128 2.72599 -147.68100 958.44596
1885.0000 -158.19287 -150.08808 8.10479 2.64031 -149.06609 926.30500
1890.0000 -156.06767 -148.79536 7.27231 2.66863 -148.60822 931.35904
1895.0000 -157.13962 -148.44162 8.69799 2.62946 -149.24153 910.57295
1900.0000 -156.00830 -148.10002 7.90828 2.71780 -147.81342 964.74933
1905.0000 -155.66315 -148.57428 7.08888 2.74275 -147.41000 995.74909
1910.0000 -156.47918 -150.27063 6.20855 2.59918 -149.73101 884.10186
1915.0000 -157.05852 -149.06665 7.99187 2.65695 -148.79710 918.70075
1920.0000 -157.02499 -148.35180 8.67319 2.66840 -148.61197 909.27033
1925.0000 -155.37761 -149.11270 6.26491 2.66992 -148.58749 888.27746
1930.0000 -155.69366 -147.26169 8.43197 2.66824 -148.61466 904.91730
1935.0000 -155.92394 -149.10149 6.82246 2.71055 -147.93055 939.97593
1940.0000 -156.77051 -149.68287 7.08764 2.61665 -149.44858 912.82570
1945.0000 -155.28578 -148.11908 7.16670 2.68110 -148.40665 916.59765
1950.0000 -155.44435 -147.37906 8.06528 2.71688 -147.82825 917.06538
1955.0000 -156.82841 -149.25503 7.57339 2.69639 -148.15953 948.03730
1960.0000 -156.50420 -149.11015 7.39405 2.60017 -149.71497 885.75376
1965.0000 -156.10648 -148.01985 8.08663 2.69484 -148.18466 938.02062
1970.0000 -156.87886 -148.01452 8.86434 2.73770 -147.49163 968.04300
1975.0000 -154.91293 -147.66389 7.24904 2.70609 -148.00270 943.08884
1980.0000 -155.23283 -147.68945 7.54339 2.76134 -147.10953 971.18329
1985.0000 -152.95265 -144.96389 7.98876 2.78764 -146.68431 989.88699
1990.0000 -155.51524 -147.82550 7.68974 2.78195 -146.77634 994.72804
1995.0000 -155.61056 -148.28625 7.32432 2.73218 -147.58100 1002.88111
2000.0000 -157.27793 -150.41790 6.86004 2.61106 -149.53901 876.76639
FREEZING PROCESS: loop number 9 T-loop= 907.00000000000000
main_MD> interactions number 9 at Temperature= 907.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.59773 3.88922 -0.01943
force_rgl> df(natom) 0.66306 -4.31560 2.64382
2005.0000 -157.42355 -149.81474 7.60881 2.57686 -150.09186 843.37860
2010.0000 -156.90434 -150.38210 6.52224 2.55931 -150.37566 847.13279
2015.0000 -156.04602 -148.64242 7.40360 2.62182 -149.36506 893.97729
2020.0000 -157.64836 -150.25037 7.39799 2.60158 -149.69231 858.29657
2025.0000 -156.99071 -148.41565 8.57507 2.65752 -148.78787 919.57286
2030.0000 -156.71788 -148.92998 7.78790 2.70820 -147.96858 955.96443
2035.0000 -158.00393 -149.59424 8.40969 2.61367 -149.49673 900.73856
2040.0000 -156.38783 -148.78757 7.60026 2.60495 -149.63773 894.97817
2045.0000 -156.22522 -147.55304 8.67219 2.66803 -148.61805 932.59999
2050.0000 -155.52642 -148.40473 7.12169 2.68746 -148.30395 958.99146
2055.0000 -155.31840 -148.08260 7.23580 2.73645 -147.51191 930.44381
2060.0000 -157.06552 -149.87953 7.18599 2.63237 -149.19449 877.35700
2065.0000 -157.65864 -150.10029 7.55835 2.61572 -149.46360 904.50965
2070.0000 -156.49260 -148.21177 8.28083 2.55026 -150.52185 870.43485
2075.0000 -156.60885 -147.87759 8.73126 2.74833 -147.31992 970.18388
2080.0000 -156.17776 -149.20614 6.97161 2.70565 -148.00989 957.63540
2085.0000 -157.07637 -149.85461 7.22176 2.68093 -148.40944 926.30062
2090.0000 -157.13393 -148.84348 8.29045 2.65538 -148.82248 916.10693
2095.0000 -158.49830 -150.75210 7.74620 2.61799 -149.42688 860.15755
2100.0000 -157.09205 -150.00116 7.09089 2.59752 -149.75790 886.78851
2105.0000 -156.52720 -148.28427 8.24292 2.65364 -148.85055 924.20964
2110.0000 -157.10587 -149.99503 7.11084 2.60689 -149.60644 899.47779
2115.0000 -155.71663 -147.43468 8.28195 2.67793 -148.45792 904.78418
2120.0000 -153.55545 -145.63718 7.91827 2.78895 -146.66324 999.09887
2125.0000 -155.74345 -147.59067 8.15278 2.78862 -146.66850 1002.60622
2130.0000 -155.91120 -148.96484 6.94636 2.69738 -148.14351 922.93622
2135.0000 -158.36225 -150.25758 8.10467 2.62502 -149.31334 891.46397
2140.0000 -157.16953 -149.65684 7.51269 2.59812 -149.74816 897.53381
2145.0000 -157.18355 -149.96174 7.22181 2.56917 -150.21620 844.40261
2150.0000 -157.45061 -150.36034 7.09027 2.55282 -150.48052 832.73958
2155.0000 -157.91038 -149.78076 8.12962 2.51944 -151.02010 807.42507
2160.0000 -157.37114 -149.87294 7.49820 2.54827 -150.55409 841.17496
2165.0000 -158.50227 -151.61096 6.89131 2.52574 -150.91829 824.50638
2170.0000 -157.78895 -150.57571 7.21324 2.45334 -152.08875 792.79634
2175.0000 -157.25661 -148.76563 8.49097 2.63368 -149.17329 905.11298
2180.0000 -155.98398 -148.32888 7.65510 2.65073 -148.89772 936.99474
2185.0000 -154.90120 -147.21302 7.68818 2.70205 -148.06806 940.81704
2190.0000 -156.12608 -147.01343 9.11265 2.71641 -147.83582 970.20909
2195.0000 -156.45861 -147.42978 9.02883 2.70215 -148.06641 955.03909
2200.0000 -154.30770 -147.88559 6.42211 2.70431 -148.03152 907.13676
2205.0000 -155.05081 -147.22587 7.82494 2.63802 -149.10320 877.06744
2210.0000 -155.98436 -149.76635 6.21801 2.71938 -147.78783 963.03999
2215.0000 -156.29184 -148.66320 7.62864 2.64958 -148.91628 922.20358
2220.0000 -155.43228 -146.49851 8.93377 2.71503 -147.85823 947.07317
2225.0000 -157.24241 -150.26767 6.97474 2.72621 -147.67750 976.51376
2230.0000 -155.30803 -149.04722 6.26080 2.62895 -149.24973 898.89362
2235.0000 -156.53745 -148.27210 8.26534 2.68386 -148.36202 908.57528
2240.0000 -157.78153 -149.54513 8.23640 2.64765 -148.94747 909.64305
2245.0000 -157.96785 -151.29408 6.67377 2.58428 -149.97192 873.12658
2250.0000 -157.30984 -150.55718 6.75266 2.52859 -150.87217 829.44824
FREEZING PROCESS: loop number 10 T-loop= 882.00000000000000
main_MD> interactions number 10 at Temperature= 882.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.02454 0.88201 -7.67282
force_rgl> df(natom) 2.37160 -1.88747 -0.51403
2255.0000 -157.05902 -150.14555 6.91348 2.62668 -149.28648 902.36521
2260.0000 -156.50797 -149.18073 7.32724 2.60117 -149.69894 856.41754
2265.0000 -156.33332 -148.39870 7.93461 2.62725 -149.27729 884.96354
2270.0000 -156.73378 -148.58661 8.14717 2.67801 -148.45670 916.13177
2275.0000 -156.85977 -150.47354 6.38623 2.60204 -149.68482 841.16159
2280.0000 -156.75626 -150.42472 6.33154 2.54520 -150.60375 831.16790
2285.0000 -157.93317 -150.53113 7.40203 2.54129 -150.66695 829.52248
2290.0000 -158.25779 -150.50150 7.75629 2.52588 -150.91595 845.34464
2295.0000 -157.20244 -149.15404 8.04839 2.58543 -149.95328 872.26124
2300.0000 -157.15320 -149.85810 7.29510 2.60348 -149.66157 894.14597
2305.0000 -158.29293 -150.68873 7.60420 2.60179 -149.68886 881.27370
2310.0000 -156.96332 -149.68469 7.27864 2.59503 -149.79819 867.36754
2315.0000 -158.96065 -151.35888 7.60177 2.51746 -151.05223 835.88564
2320.0000 -158.79036 -152.22589 6.56447 2.46334 -151.92708 816.78789
2325.0000 -156.81369 -148.36176 8.45193 2.52856 -150.87268 856.12181
2330.0000 -156.03166 -147.19702 8.83464 2.71032 -147.93430 977.81563
2335.0000 -155.23854 -148.18839 7.05014 2.70817 -147.96905 919.95831
2340.0000 -157.24587 -149.30778 7.93809 2.59709 -149.76478 862.66891
2345.0000 -158.44099 -150.72605 7.71494 2.64494 -148.99135 918.83498
2350.0000 -157.09163 -150.84656 6.24507 2.58061 -150.03120 866.30148
2355.0000 -156.86674 -150.26862 6.59812 2.56121 -150.34491 865.56021
2360.0000 -155.74954 -148.43277 7.31677 2.66473 -148.67141 934.30761
2365.0000 -156.89875 -148.58303 8.31572 2.65763 -148.78611 902.29220
2370.0000 -157.45435 -149.97243 7.48192 2.58678 -149.93146 864.49720
2375.0000 -157.11316 -150.35156 6.76159 2.59524 -149.79477 871.82039
2380.0000 -157.69106 -148.70633 8.98473 2.61089 -149.54173 874.66937
2385.0000 -154.46028 -147.29376 7.16652 2.69231 -148.22552 939.97009
2390.0000 -158.71889 -150.43929 8.27960 2.62852 -149.25675 885.56460
2395.0000 -156.55805 -148.09452 8.46352 2.59342 -149.82415 867.61003
2400.0000 -156.75022 -148.51447 8.23574 2.66406 -148.68212 878.30447
2405.0000 -157.37455 -150.27328 7.10127 2.60436 -149.64729 836.89305
2410.0000 -157.31167 -150.16262 7.14905 2.54474 -150.61111 796.41867
2415.0000 -157.77283 -149.85870 7.91413 2.54535 -150.60133 795.02106
2420.0000 -158.04694 -150.06349 7.98345 2.60460 -149.64335 875.55282
2425.0000 -156.52315 -149.63919 6.88395 2.59219 -149.84398 894.43414
2430.0000 -158.15944 -151.24537 6.91407 2.54376 -150.62693 828.01772
2435.0000 -157.01462 -149.78394 7.23068 2.51021 -151.16943 835.44633
2440.0000 -157.08531 -150.15789 6.92741 2.60254 -149.67678 896.23845
2445.0000 -157.74025 -151.28742 6.45284 2.54452 -150.61473 828.29565
2450.0000 -157.34914 -150.56860 6.78054 2.55908 -150.37929 862.25477
2455.0000 -157.60154 -150.39315 7.20839 2.53281 -150.80406 840.47048
2460.0000 -157.50769 -151.15491 6.35278 2.53037 -150.84346 819.33868
2465.0000 -156.75447 -150.19315 6.56132 2.51524 -151.08800 834.78303
2470.0000 -158.33772 -151.03370 7.30402 2.57762 -150.07956 854.35538
2475.0000 -157.41403 -150.23262 7.18141 2.58888 -149.89756 848.04210
2480.0000 -157.07619 -149.38243 7.69376 2.57361 -150.14444 845.19032
2485.0000 -156.41396 -149.08787 7.32610 2.68122 -148.40479 946.47809
2490.0000 -158.26193 -150.71957 7.54236 2.65062 -148.89942 898.16378
2495.0000 -156.04637 -148.36416 7.68221 2.56157 -150.33898 795.35555
2500.0000 -157.97478 -151.22992 6.74486 2.58787 -149.91381 856.60618
FREEZING PROCESS: loop number 11 T-loop= 857.00000000000000
main_MD> interactions number 11 at Temperature= 857.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.01234 -4.16252 -0.01321
force_rgl> df(natom) 1.62263 3.11023 -1.78439
2505.0000 -158.16211 -151.98721 6.17490 2.50060 -151.32474 805.74309
2510.0000 -158.61380 -152.00549 6.60831 2.43443 -152.39441 784.61094
2515.0000 -157.40641 -150.42367 6.98273 2.48532 -151.57175 816.29800
2520.0000 -157.72977 -151.00648 6.72329 2.51801 -151.04324 810.54413
2525.0000 -155.99011 -149.89397 6.09615 2.57532 -150.11680 868.71473
2530.0000 -155.38067 -147.64833 7.73234 2.65677 -148.80009 889.99535
2535.0000 -155.89280 -147.87105 8.02175 2.70757 -147.97880 917.60818
2540.0000 -156.35602 -148.69382 7.66220 2.69859 -148.12402 919.24668
2545.0000 -155.02280 -148.63048 6.39231 2.68710 -148.30969 927.72884
2550.0000 -156.87313 -149.31053 7.56260 2.61959 -149.40106 907.22812
2555.0000 -157.94279 -150.47028 7.47251 2.60139 -149.69537 875.47445
2560.0000 -157.12930 -150.54327 6.58603 2.61473 -149.47962 895.09209
2565.0000 -157.04462 -149.94198 7.10264 2.60061 -149.70797 848.42006
2570.0000 -159.21860 -151.56873 7.64988 2.51961 -151.01737 827.96139
2575.0000 -157.31499 -150.70287 6.61212 2.46900 -151.83563 807.68493
2580.0000 -157.55432 -149.47424 8.08008 2.62839 -149.25875 931.14283
2585.0000 -155.26594 -146.85110 8.41484 2.68735 -148.30569 948.41923
2590.0000 -156.28480 -149.20278 7.08202 2.70201 -148.06870 963.87077
2595.0000 -157.09807 -150.12669 6.97137 2.61077 -149.54365 874.48194
2600.0000 -157.89868 -150.20219 7.69649 2.58603 -149.94370 860.26228
2605.0000 -157.29354 -150.72679 6.56674 2.55297 -150.47801 832.97886
2610.0000 -156.04436 -148.98609 7.05827 2.58514 -149.95802 846.83630
2615.0000 -157.72029 -151.09378 6.62651 2.51015 -151.17033 804.28482
2620.0000 -158.51188 -151.47437 7.03751 2.49506 -151.41422 762.96578
2625.0000 -158.28896 -151.38210 6.90686 2.52290 -150.96420 818.94096
2630.0000 -157.75903 -150.25189 7.50714 2.50425 -151.26574 803.49143
2635.0000 -157.81635 -150.36222 7.45414 2.56325 -150.31192 850.46209
2640.0000 -158.35639 -151.50449 6.85189 2.56175 -150.33610 863.15682
2645.0000 -157.19022 -150.21114 6.97908 2.55950 -150.37254 846.93006
2650.0000 -157.66554 -150.78222 6.88332 2.60918 -149.56941 891.93685
2655.0000 -157.55146 -150.71711 6.83435 2.55852 -150.38842 819.45579
2660.0000 -156.96313 -150.84653 6.11659 2.52239 -150.97242 817.70353
2665.0000 -157.22639 -151.53075 5.69565 2.54368 -150.62824 807.31513
2670.0000 -159.10473 -151.75679 7.34795 2.46478 -151.90387 790.11577
2675.0000 -158.16877 -151.90262 6.26615 2.45255 -152.10149 789.83516
2680.0000 -157.38433 -149.77319 7.61114 2.51282 -151.12719 837.84199
2685.0000 -154.50845 -148.01704 6.49141 2.64095 -149.05572 901.55326
2690.0000 -158.27924 -150.95802 7.32122 2.57544 -150.11484 845.50482
2695.0000 -157.17874 -151.51495 5.66379 2.51686 -151.06184 810.97535
2700.0000 -158.19300 -149.86303 8.32997 2.53682 -150.73925 846.13038
2705.0000 -157.61388 -150.06477 7.54911 2.59292 -149.83221 894.69693
2710.0000 -156.74811 -149.29787 7.45025 2.60412 -149.65122 882.22247
2715.0000 -156.07698 -148.39939 7.67759 2.64079 -149.05832 885.29017
2720.0000 -157.20521 -149.67332 7.53188 2.67025 -148.58212 911.46886
2725.0000 -155.81543 -147.71782 8.09761 2.60174 -149.68961 856.70769
2730.0000 -156.13363 -148.28679 7.84684 2.66438 -148.67698 928.92835
2735.0000 -156.51753 -149.34252 7.17501 2.67950 -148.43257 941.42996
2740.0000 -157.26635 -149.99896 7.26739 2.59049 -149.87150 866.69963
2745.0000 -156.18831 -148.69280 7.49551 2.59705 -149.76552 855.47863
2750.0000 -157.48259 -150.28940 7.19318 2.62770 -149.26998 898.06217
FREEZING PROCESS: loop number 12 T-loop= 832.00000000000000
main_MD> interactions number 12 at Temperature= 832.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.60367 -0.65790 0.82994
force_rgl> df(natom) -0.20527 -3.56828 -0.58066
2755.0000 -158.05456 -151.58491 6.46965 2.56778 -150.23859 844.47824
2760.0000 -157.69043 -151.79463 5.89579 2.48482 -151.57984 780.14571
2765.0000 -158.81997 -151.69935 7.12062 2.46758 -151.85845 770.23159
2770.0000 -157.97151 -151.77525 6.19626 2.50942 -151.18214 799.01092
2775.0000 -156.77304 -148.60330 8.16975 2.56207 -150.33102 883.35784
2780.0000 -157.45682 -151.32450 6.13232 2.55768 -150.40187 846.14467
2785.0000 -156.14770 -149.51778 6.62992 2.54963 -150.53206 783.76475
2790.0000 -159.19408 -151.22197 7.97211 2.55101 -150.50983 851.86044
2795.0000 -157.46951 -150.51656 6.95295 2.49495 -151.41605 817.58118
2800.0000 -159.12409 -151.97486 7.14924 2.50177 -151.30576 823.87860
2805.0000 -155.79693 -149.69131 6.10562 2.55912 -150.37860 837.20347
2810.0000 -159.09355 -152.02096 7.07259 2.57904 -150.05662 857.24247
2815.0000 -156.38829 -149.07084 7.31745 2.55020 -150.52292 832.26077
2820.0000 -157.66544 -151.81060 5.85484 2.51020 -151.16945 803.00239
2825.0000 -158.83772 -151.34120 7.49653 2.45210 -152.10883 775.79672
2830.0000 -157.67935 -150.68724 6.99211 2.52275 -150.96662 863.98260
2835.0000 -160.25198 -154.08215 6.16983 2.46822 -151.84819 796.71819
2840.0000 -160.22495 -153.37803 6.84692 2.36400 -153.53297 751.92482
2845.0000 -156.81858 -150.79768 6.02091 2.45371 -152.08268 805.15944
2850.0000 -154.20185 -147.92755 6.27430 2.63459 -149.15866 879.44705
2855.0000 -156.99083 -147.76990 9.22092 2.69095 -148.24753 911.44029
2860.0000 -156.19241 -148.23020 7.96221 2.69461 -148.18827 945.12363
2865.0000 -157.46097 -150.12065 7.34031 2.70069 -148.08994 937.49350
2870.0000 -157.67207 -151.16567 6.50640 2.52262 -150.96880 833.06114
2875.0000 -157.63255 -149.81499 7.81756 2.54489 -150.60871 823.47716
2880.0000 -158.59549 -152.08626 6.50924 2.56081 -150.35139 862.89692
2885.0000 -157.09429 -150.24397 6.85032 2.50705 -151.22037 816.56739
2890.0000 -157.94838 -151.48685 6.46152 2.48539 -151.57056 798.01226
2895.0000 -158.71294 -152.75722 5.95572 2.45515 -152.05951 791.49976
2900.0000 -157.59015 -150.06841 7.52175 2.47639 -151.71612 796.39170
2905.0000 -157.57081 -150.91984 6.65097 2.49701 -151.38280 811.96294
2910.0000 -158.40077 -151.96565 6.43511 2.48819 -151.52540 785.40290
2915.0000 -157.22425 -151.26380 5.96045 2.47765 -151.69565 773.55045
2920.0000 -158.20862 -151.22962 6.97900 2.47112 -151.80137 776.21782
2925.0000 -157.36923 -150.85974 6.50949 2.48911 -151.51049 796.33731
2930.0000 -156.69517 -150.54016 6.15501 2.50080 -151.32145 804.71764
2935.0000 -157.70754 -150.67735 7.03019 2.56235 -150.32647 861.16306
2940.0000 -156.92371 -150.91643 6.00728 2.57279 -150.15763 845.28549
2945.0000 -158.61898 -150.90159 7.71739 2.57041 -150.19610 852.36783
2950.0000 -158.30284 -151.38769 6.91515 2.51961 -151.01738 826.86678
2955.0000 -159.80904 -152.89163 6.91742 2.44020 -152.30119 775.37776
2960.0000 -158.05297 -150.13270 7.92027 2.47561 -151.72870 803.67903
2965.0000 -157.18473 -149.39708 7.78765 2.57866 -150.06270 877.14159
2970.0000 -157.60967 -149.42484 8.18483 2.63595 -149.13655 904.21415
2975.0000 -156.03376 -148.04435 7.98941 2.64112 -149.05297 902.78148
2980.0000 -156.00416 -149.22941 6.77475 2.64083 -149.05769 866.35850
2985.0000 -156.83362 -149.36045 7.47317 2.60893 -149.57344 864.97632
2990.0000 -157.22494 -151.25450 5.97044 2.56267 -150.32133 818.17316
2995.0000 -157.41417 -149.88479 7.52939 2.56849 -150.22723 823.16410
3000.0000 -156.72046 -149.16973 7.55073 2.63262 -149.19040 902.80500
FREEZING PROCESS: loop number 13 T-loop= 807.00000000000000
main_MD> interactions number 13 at Temperature= 807.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.47642 1.04946 0.80611
force_rgl> df(natom) 2.42335 2.03761 1.82173
3005.0000 -156.50804 -149.29367 7.21436 2.61523 -149.47156 891.60917
3010.0000 -155.61900 -149.49339 6.12561 2.57139 -150.18037 824.67415
3015.0000 -157.41823 -150.40171 7.01652 2.55396 -150.46203 824.79477
3020.0000 -156.88444 -150.40428 6.48015 2.56528 -150.27914 829.50991
3025.0000 -158.75484 -152.50071 6.25414 2.50799 -151.20525 779.93787
3030.0000 -158.33287 -152.21149 6.12138 2.43687 -152.35493 773.08413
3035.0000 -157.06743 -150.58675 6.48068 2.46963 -151.82545 785.92008
3040.0000 -157.48753 -149.88777 7.59976 2.57278 -150.15777 851.50055
3045.0000 -158.16358 -151.57872 6.58486 2.63487 -149.15403 906.47648
3050.0000 -157.88711 -151.40838 6.47872 2.49964 -151.34019 817.69005
3055.0000 -158.17757 -150.77679 7.40079 2.54015 -150.68541 819.44314
3060.0000 -157.81780 -149.40341 8.41439 2.58335 -149.98697 869.10784
3065.0000 -156.07657 -148.78544 7.29113 2.62511 -149.31182 900.03915
3070.0000 -156.75445 -149.93165 6.82281 2.58931 -149.89066 849.88820
3075.0000 -156.38096 -149.51260 6.86836 2.58853 -149.90319 825.78772
3080.0000 -157.24155 -149.64828 7.59328 2.56979 -150.20620 844.92386
3085.0000 -156.57920 -148.72660 7.85260 2.66900 -148.60225 892.90191
3090.0000 -156.98135 -149.57822 7.40313 2.63203 -149.20005 895.59970
3095.0000 -157.57913 -151.29168 6.28745 2.52404 -150.94573 811.40517
3100.0000 -156.48750 -149.94405 6.54345 2.53269 -150.80600 808.17731
3105.0000 -157.84282 -151.12058 6.72224 2.54537 -150.60102 822.40491
3110.0000 -159.70414 -152.70726 6.99688 2.47987 -151.65990 801.10711
3115.0000 -158.45184 -152.05324 6.39860 2.45209 -152.10897 763.21098
3120.0000 -157.48218 -150.77111 6.71107 2.49303 -151.44706 804.79261
3125.0000 -158.85229 -152.27305 6.57924 2.53022 -150.84586 837.05384
3130.0000 -158.46149 -151.55438 6.90711 2.46963 -151.82534 796.16667
3135.0000 -160.36170 -154.05563 6.30607 2.37752 -153.31438 722.43413
3140.0000 -158.78643 -153.22623 5.56020 2.34842 -153.78486 728.52994
3145.0000 -159.17900 -152.85507 6.32394 2.37150 -153.41171 709.61015
3150.0000 -158.63959 -151.66596 6.97363 2.42733 -152.50915 744.56494
3155.0000 -159.29662 -153.50105 5.79557 2.39636 -153.00980 742.55154
3160.0000 -159.30024 -153.12147 6.17876 2.35403 -153.69414 717.88754
3165.0000 -159.22636 -152.41052 6.81583 2.40202 -152.91835 735.87957
3170.0000 -157.86561 -151.70641 6.15921 2.42257 -152.58622 760.82628
3175.0000 -157.98769 -151.51006 6.47763 2.47958 -151.66449 795.77814
3180.0000 -158.51150 -151.33651 7.17499 2.50590 -151.23903 833.55469
3185.0000 -158.80557 -151.88079 6.92478 2.50442 -151.26294 833.82627
3190.0000 -158.37625 -151.65089 6.72536 2.50523 -151.24983 810.44474
3195.0000 -158.03726 -151.19686 6.84040 2.40656 -152.84504 758.91160
3200.0000 -158.46679 -151.06149 7.40530 2.49737 -151.37690 786.56601
3205.0000 -156.23473 -149.34512 6.88961 2.58670 -149.93288 879.33562
3210.0000 -158.55490 -151.67894 6.87596 2.54994 -150.52706 834.01269
3215.0000 -158.02165 -150.60170 7.41995 2.51329 -151.11956 814.92859
3220.0000 -158.07083 -151.00213 7.06871 2.51529 -151.08718 809.87136
3225.0000 -156.75750 -149.60946 7.14804 2.59624 -149.77862 875.37374
3230.0000 -157.97168 -150.27390 7.69778 2.56751 -150.24300 820.54330
3235.0000 -158.58150 -152.10306 6.47844 2.51964 -151.01698 816.66805
3240.0000 -158.31993 -151.27490 7.04503 2.45613 -152.04367 740.58590
3245.0000 -158.97805 -150.98806 7.98999 2.49859 -151.35716 783.22618
3250.0000 -159.33394 -152.43551 6.89842 2.47567 -151.72778 804.69481
FREEZING PROCESS: loop number 14 T-loop= 782.00000000000000
main_MD> interactions number 14 at Temperature= 782.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 7.59964 1.65073 -1.82779
force_rgl> df(natom) -4.78167 4.90879 3.60408
3255.0000 -157.68812 -150.90970 6.77843 2.49890 -151.35221 825.43678
3260.0000 -158.25810 -151.50986 6.74824 2.47702 -151.70585 792.88333
3265.0000 -159.99407 -153.96089 6.03318 2.39753 -152.99101 734.24319
3270.0000 -159.30503 -152.84676 6.45828 2.39015 -153.11034 729.18085
3275.0000 -157.42845 -150.26225 7.16620 2.47159 -151.79362 801.22611
3280.0000 -159.57600 -151.36865 8.20735 2.56863 -150.22491 838.07231
3285.0000 -158.53005 -151.08119 7.44886 2.51005 -151.17202 838.55270
3290.0000 -157.17067 -150.36849 6.80218 2.51037 -151.16681 803.25698
3295.0000 -156.55130 -150.35666 6.19464 2.56610 -150.26590 844.94088
3300.0000 -159.27211 -152.22656 7.04555 2.48553 -151.56827 795.70988
3305.0000 -157.76539 -151.36351 6.40188 2.46904 -151.83497 777.38000
3310.0000 -158.78301 -152.49066 6.29235 2.45253 -152.10185 760.61323
3315.0000 -158.35373 -152.46534 5.88839 2.42896 -152.48282 774.74499
3320.0000 -159.40876 -153.45171 5.95705 2.40754 -152.82912 753.19436
3325.0000 -158.26557 -151.66094 6.60463 2.44243 -152.26504 768.73052
3330.0000 -158.63147 -150.77349 7.85798 2.47459 -151.74514 801.07111
3335.0000 -158.50082 -150.52643 7.97439 2.50503 -151.25305 832.99427
3340.0000 -158.14713 -151.32548 6.82165 2.52121 -150.99145 818.63420
3345.0000 -159.87596 -152.37901 7.49695 2.44083 -152.29092 790.90879
3350.0000 -158.65411 -152.31162 6.34250 2.41467 -152.71383 775.05562
3355.0000 -158.14914 -151.39889 6.75025 2.44554 -152.21482 762.96110
3360.0000 -158.18235 -151.34850 6.83386 2.51006 -151.17186 792.48675
3365.0000 -158.44582 -151.45992 6.98590 2.48754 -151.53585 799.93402
3370.0000 -159.03441 -153.35915 5.67525 2.43025 -152.46196 778.89179
3375.0000 -158.68508 -152.18269 6.50239 2.39053 -153.10406 707.13354
3380.0000 -156.72867 -150.69737 6.03130 2.47998 -151.65812 770.47642
3385.0000 -157.25288 -151.06877 6.18411 2.49906 -151.34963 773.00095
3390.0000 -159.08936 -152.38930 6.70006 2.41104 -152.77259 739.45837
3395.0000 -158.31863 -151.51412 6.80451 2.49894 -151.35155 783.57166
3400.0000 -158.61512 -152.28828 6.32684 2.46341 -151.92599 756.00882
3405.0000 -158.57552 -151.52991 7.04561 2.43194 -152.43475 748.35466
3410.0000 -157.69645 -150.49651 7.19994 2.52395 -150.94726 801.66615
3415.0000 -159.44580 -151.33322 8.11258 2.55409 -150.46005 851.67043
3420.0000 -158.56023 -151.44061 7.11962 2.49888 -151.35245 792.96637
3425.0000 -158.17801 -151.74213 6.43587 2.43816 -152.33411 754.42272
3430.0000 -157.49185 -150.26660 7.22526 2.54878 -150.54587 838.59099
3435.0000 -157.56487 -150.61919 6.94568 2.52502 -150.92994 806.64095
3440.0000 -158.10171 -150.59367 7.50804 2.54807 -150.55729 817.26158
3445.0000 -157.86692 -151.74357 6.12335 2.50574 -151.24155 788.51131
3450.0000 -158.97136 -152.47039 6.50097 2.45971 -151.98576 725.97257
3455.0000 -158.71309 -152.75194 5.96115 2.42302 -152.57894 725.06452
3460.0000 -157.73962 -151.69709 6.04253 2.48437 -151.58716 788.58514
3465.0000 -161.23601 -154.05393 7.18208 2.42738 -152.50838 746.68040
3470.0000 -160.22914 -153.78690 6.44224 2.35679 -153.64954 703.64449
3475.0000 -157.75263 -151.49767 6.25497 2.41515 -152.70608 743.11425
3480.0000 -157.61634 -149.78129 7.83505 2.54490 -150.60858 864.85801
3485.0000 -157.11531 -150.37780 6.73750 2.60888 -149.57416 892.11681
3490.0000 -158.83623 -150.75909 8.07714 2.51638 -151.06956 815.08953
3495.0000 -157.61109 -151.26813 6.34296 2.47402 -151.75433 768.84808
3500.0000 -157.77644 -150.38472 7.39172 2.54288 -150.64120 813.30449
FREEZING PROCESS: loop number 15 T-loop= 757.00000000000000
main_MD> interactions number 15 at Temperature= 757.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.13355 1.64115 4.26736
force_rgl> df(natom) -1.89943 -0.65335 2.57602
3505.0000 -158.92450 -152.70374 6.22076 2.49294 -151.44851 792.12363
3510.0000 -158.15172 -151.43731 6.71441 2.47456 -151.74573 766.87664
3515.0000 -159.03895 -151.52717 7.51178 2.47350 -151.76283 796.95101
3520.0000 -157.93279 -150.60896 7.32384 2.48474 -151.58117 811.33804
3525.0000 -158.56764 -151.13041 7.43724 2.51682 -151.06247 810.51782
3530.0000 -157.95800 -152.29852 5.65949 2.48790 -151.53004 797.70945
3535.0000 -158.94383 -152.40754 6.53629 2.46002 -151.98069 800.71671
3540.0000 -159.67067 -153.30669 6.36398 2.44839 -152.16872 775.75899
3545.0000 -158.39297 -152.10004 6.29294 2.40624 -152.85022 724.57907
3550.0000 -158.62913 -152.56387 6.06527 2.43804 -152.33612 746.04310
3555.0000 -160.17194 -153.94215 6.22979 2.40132 -152.92966 759.00253
3560.0000 -158.96633 -152.07282 6.89351 2.36404 -153.53240 735.63608
3565.0000 -157.76536 -151.52631 6.23905 2.47515 -151.73617 798.69103
3570.0000 -159.41650 -152.70147 6.71503 2.48585 -151.56322 816.94979
3575.0000 -159.11525 -152.61480 6.50045 2.43294 -152.41853 750.68363
3580.0000 -158.74283 -152.63344 6.10939 2.42898 -152.48257 731.91451
3585.0000 -158.34997 -151.88662 6.46335 2.45075 -152.13055 763.79227
3590.0000 -158.78573 -150.90274 7.88299 2.51342 -151.11743 776.63241
3595.0000 -159.01338 -153.38673 5.62665 2.45557 -152.05263 785.43553
3600.0000 -158.30115 -151.95560 6.34555 2.42843 -152.49147 785.31319
3605.0000 -158.06925 -151.54136 6.52789 2.44835 -152.16939 766.96149
3610.0000 -158.53701 -151.15890 7.37811 2.48559 -151.56734 757.61515
3615.0000 -158.29946 -150.31725 7.98221 2.54224 -150.65155 840.91534
3620.0000 -157.69354 -151.19332 6.50022 2.54523 -150.60319 823.43188
3625.0000 -159.21028 -153.20978 6.00049 2.43185 -152.43607 745.43160
3630.0000 -160.01417 -152.76269 7.25148 2.43544 -152.37810 766.99931
3635.0000 -157.71884 -151.75630 5.96254 2.48452 -151.58459 793.75783
3640.0000 -158.69503 -151.43929 7.25574 2.49032 -151.49094 791.44396
3645.0000 -158.46800 -151.65253 6.81547 2.44058 -152.29498 761.86246
3650.0000 -159.29567 -153.52820 5.76747 2.38704 -153.16056 704.34980
3655.0000 -159.21797 -152.40373 6.81424 2.38818 -153.14214 735.44807
3660.0000 -158.11532 -151.62274 6.49259 2.44038 -152.29832 783.83560
3665.0000 -159.18975 -152.96700 6.22275 2.38233 -153.23675 708.69283
3670.0000 -158.94536 -152.68721 6.25815 2.39872 -152.97167 712.36935
3675.0000 -158.59392 -152.81249 5.78143 2.41543 -152.70152 733.75213
3680.0000 -159.28009 -152.79242 6.48767 2.39656 -153.00659 742.84200
3685.0000 -158.46266 -152.48754 5.97512 2.39984 -152.95365 758.48705
3690.0000 -157.63306 -151.40033 6.23273 2.45976 -151.98497 776.43679
3695.0000 -158.82155 -151.53548 7.28608 2.49737 -151.37689 812.69492
3700.0000 -157.79242 -151.92780 5.86463 2.54005 -150.68699 827.97628
3705.0000 -158.64211 -152.01653 6.62557 2.48727 -151.54019 787.92284
3710.0000 -158.43923 -152.51566 5.92356 2.41148 -152.76546 732.26690
3715.0000 -159.67468 -153.70121 5.97347 2.35175 -153.73103 687.85035
3720.0000 -157.96629 -151.70443 6.26187 2.44063 -152.29420 752.08964
3725.0000 -158.58206 -152.34001 6.24205 2.46483 -151.90299 777.61714
3730.0000 -158.87053 -153.14608 5.72445 2.46015 -151.97867 773.36911
3735.0000 -158.71474 -151.80214 6.91260 2.38853 -153.13648 757.92970
3740.0000 -158.79512 -151.60653 7.18859 2.45412 -152.07618 776.97391
3745.0000 -159.30604 -151.00648 8.29957 2.46271 -151.93718 797.89081
3750.0000 -158.02474 -152.48659 5.53815 2.51103 -151.15607 821.70036
FREEZING PROCESS: loop number 16 T-loop= 732.00000000000000
main_MD> interactions number 16 at Temperature= 732.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.26206 4.62711 -0.83025
force_rgl> df(natom) -0.64592 -0.28368 -3.03218
3755.0000 -161.32305 -155.93007 5.39298 2.32406 -154.17870 689.51463
3760.0000 -160.32616 -154.50050 5.82567 2.26394 -155.15056 639.41214
3765.0000 -158.79317 -152.54551 6.24766 2.36264 -153.55504 721.05183
3770.0000 -158.56421 -153.03881 5.52540 2.41461 -152.71479 743.38616
3775.0000 -158.37239 -153.83702 4.53537 2.37942 -153.28367 694.01890
3780.0000 -158.54164 -152.75499 5.78666 2.37155 -153.41103 698.71347
3785.0000 -158.84793 -152.62393 6.22400 2.41537 -152.70260 733.08046
3790.0000 -159.79736 -153.39612 6.40125 2.41195 -152.75790 740.16972
3795.0000 -157.83301 -150.90669 6.92633 2.44063 -152.29423 745.73192
3800.0000 -159.68019 -152.76039 6.91981 2.49842 -151.35989 795.75400
3805.0000 -158.30893 -152.49223 5.81670 2.45035 -152.13712 772.45158
3810.0000 -158.20422 -151.72882 6.47540 2.47680 -151.70949 805.70203
3815.0000 -159.00316 -152.47710 6.52607 2.48498 -151.57720 800.33793
3820.0000 -158.93849 -152.87921 6.05928 2.42840 -152.49191 753.92909
3825.0000 -157.89957 -152.51316 5.38641 2.40005 -152.95024 756.85459
3830.0000 -159.75209 -154.40894 5.34315 2.38600 -153.17741 745.30068
3835.0000 -160.82843 -153.44229 7.38614 2.35886 -153.61614 718.19079
3840.0000 -160.72652 -154.21798 6.50854 2.35236 -153.72119 721.25754
3845.0000 -160.02934 -153.99620 6.03314 2.33962 -153.92715 727.32773
3850.0000 -158.87589 -152.33454 6.54134 2.38129 -153.25350 738.92014
3855.0000 -158.97025 -152.27100 6.69925 2.45620 -152.04251 779.51673
3860.0000 -158.37512 -151.81584 6.55928 2.43548 -152.37739 765.40866
3865.0000 -160.39926 -153.73430 6.66495 2.39022 -153.10915 722.66794
3870.0000 -161.01992 -154.64539 6.37452 2.30657 -154.46144 681.62847
3875.0000 -159.80352 -153.98549 5.81803 2.31508 -154.32387 693.38999
3880.0000 -160.15712 -153.91558 6.24154 2.33882 -153.94013 689.88691
3885.0000 -160.47883 -153.42826 7.05057 2.38318 -153.22290 754.56918
3890.0000 -158.67715 -152.86445 5.81270 2.35217 -153.72424 687.81756
3895.0000 -159.76014 -152.42418 7.33596 2.42472 -152.55134 714.48061
3900.0000 -160.64621 -154.56338 6.08283 2.38607 -153.17620 737.56522
3905.0000 -160.24314 -154.36003 5.88311 2.27928 -154.90267 648.98712
3910.0000 -158.94698 -152.93783 6.00915 2.35494 -153.67955 698.97915
3915.0000 -160.15980 -154.10829 6.05151 2.35908 -153.61261 711.93176
3920.0000 -159.62450 -152.78377 6.84073 2.37634 -153.33355 730.35343
3925.0000 -158.85405 -153.42292 5.43113 2.40946 -152.79815 756.08644
3930.0000 -158.99634 -152.57522 6.42112 2.40106 -152.93385 744.03608
3935.0000 -159.29133 -153.70498 5.58634 2.38767 -153.15041 724.40298
3940.0000 -159.72513 -153.80295 5.92218 2.34185 -153.89113 686.35489
3945.0000 -158.70453 -152.39407 6.31046 2.39031 -153.10770 739.94704
3950.0000 -159.85570 -154.21048 5.64522 2.38587 -153.17940 735.70765
3955.0000 -159.41740 -153.03370 6.38369 2.35063 -153.74914 717.69666
3960.0000 -158.92510 -153.47888 5.44622 2.42670 -152.51937 757.06566
3965.0000 -160.20773 -154.43426 5.77347 2.32794 -154.11596 692.46257
3970.0000 -160.10950 -152.88115 7.22835 2.37185 -153.40612 724.80538
3975.0000 -159.51788 -153.63589 5.88200 2.39599 -153.01589 756.25001
3980.0000 -158.42875 -151.26748 7.16128 2.45432 -152.07290 797.09057
3985.0000 -157.50190 -151.34270 6.15920 2.49241 -151.45716 811.39546
3990.0000 -157.90983 -151.52920 6.38063 2.51755 -151.05077 818.96788
3995.0000 -159.94974 -153.70347 6.24627 2.39860 -152.97363 748.87676
4000.0000 -160.91439 -154.43640 6.47800 2.32875 -154.10290 695.20739
FREEZING PROCESS: loop number 17 T-loop= 707.00000000000000
main_MD> interactions number 17 at Temperature= 707.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.46815 -0.91717 0.30383
force_rgl> df(natom) 0.30513 0.94952 0.77181
4005.0000 -160.20800 -154.03881 6.16919 2.31393 -154.34250 680.15986
4010.0000 -160.52063 -154.80192 5.71870 2.29251 -154.68881 642.87381
4015.0000 -160.37267 -154.10382 6.26885 2.31121 -154.38636 660.41661
4020.0000 -159.75307 -152.46468 7.28839 2.35470 -153.68339 699.38031
4025.0000 -158.86871 -152.93611 5.93260 2.42300 -152.57916 749.85918
4030.0000 -159.21938 -153.20677 6.01261 2.38807 -153.14393 734.23430
4035.0000 -158.80105 -152.90772 5.89334 2.35373 -153.69907 693.64888
4040.0000 -159.63411 -153.31151 6.32260 2.41377 -152.72849 754.66245
4045.0000 -160.21620 -154.35426 5.86193 2.33560 -153.99217 710.52732
4050.0000 -160.58808 -154.35857 6.22951 2.30753 -154.44597 668.45272
4055.0000 -159.49196 -153.88847 5.60349 2.33844 -153.94615 699.13008
4060.0000 -160.07612 -154.39866 5.67746 2.33171 -154.05502 700.93020
4065.0000 -160.01676 -154.13187 5.88490 2.33943 -153.93028 691.43360
4070.0000 -159.66772 -153.50870 6.15901 2.32633 -154.14208 694.74435
4075.0000 -160.83726 -154.42720 6.41006 2.34053 -153.91250 727.46497
4080.0000 -160.38515 -154.09581 6.28934 2.30915 -154.41973 682.00659
4085.0000 -158.02741 -152.71553 5.31188 2.39659 -153.00610 765.47992
4090.0000 -158.80449 -152.91386 5.89063 2.37139 -153.41349 729.82210
4095.0000 -159.42675 -153.91234 5.51440 2.36497 -153.51726 722.09535
4100.0000 -159.30696 -154.29496 5.01200 2.34168 -153.89390 693.13400
4105.0000 -159.55935 -153.31507 6.24427 2.30897 -154.42263 659.60216
4110.0000 -158.59140 -153.30619 5.28521 2.40335 -152.89684 728.00736
4115.0000 -158.60127 -153.01859 5.58268 2.39975 -152.95506 738.27068
4120.0000 -158.19813 -152.07099 6.12714 2.43545 -152.37801 742.24446
4125.0000 -158.11311 -152.38758 5.72554 2.43324 -152.41370 758.61392
4130.0000 -159.49701 -153.94775 5.54926 2.35097 -153.74368 720.00593
4135.0000 -159.80699 -153.76000 6.04699 2.34879 -153.77889 702.58032
4140.0000 -159.12296 -153.59101 5.53195 2.35050 -153.75126 690.23021
4145.0000 -159.19679 -154.49948 4.69731 2.35392 -153.69594 699.43192
4150.0000 -158.29276 -152.70260 5.59015 2.36200 -153.56538 704.05202
4155.0000 -159.30929 -153.09474 6.21455 2.39179 -153.08377 740.93991
4160.0000 -159.49163 -152.46989 7.02174 2.45724 -152.02568 756.37303
4165.0000 -159.73206 -152.97362 6.75844 2.40889 -152.80738 735.38466
4170.0000 -158.82200 -152.48216 6.33984 2.38640 -153.17095 723.40635
4175.0000 -158.01489 -152.37020 5.64469 2.41736 -152.67036 728.65403
4180.0000 -159.82964 -152.91693 6.91272 2.37803 -153.30623 704.90004
4185.0000 -157.89354 -152.25070 5.64284 2.42175 -152.59944 755.34477
4190.0000 -160.54463 -154.86362 5.68101 2.39931 -152.96215 715.99141
4195.0000 -159.84701 -154.22176 5.62526 2.30566 -154.47621 657.98829
4200.0000 -159.59673 -155.11363 4.48310 2.33923 -153.93349 673.87660
4205.0000 -159.49477 -154.66918 4.82559 2.33963 -153.92703 695.90908
4210.0000 -160.36484 -154.81795 5.54689 2.29392 -154.66601 689.35737
4215.0000 -159.50613 -154.33173 5.17440 2.30882 -154.42504 669.06044
4220.0000 -160.11240 -153.84231 6.27009 2.34266 -153.87797 694.77903
4225.0000 -159.30488 -154.22582 5.07906 2.36590 -153.50226 718.85040
4230.0000 -158.65743 -152.54721 6.11021 2.41065 -152.77893 748.61380
4235.0000 -159.34843 -153.51294 5.83549 2.41648 -152.68468 770.32349
4240.0000 -158.31841 -151.69446 6.62395 2.44573 -152.21178 760.82205
4245.0000 -159.81391 -153.81617 5.99775 2.40826 -152.81744 736.00809
4250.0000 -159.12201 -153.59993 5.52208 2.38588 -153.17935 760.33740
FREEZING PROCESS: loop number 18 T-loop= 682.00000000000000
main_MD> interactions number 18 at Temperature= 682.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.26482 -0.09520 2.06589
force_rgl> df(natom) 0.90301 0.43512 -0.74486
4255.0000 -159.28842 -153.53917 5.74925 2.37389 -153.37317 720.72197
4260.0000 -159.22897 -153.67850 5.55047 2.34404 -153.85570 693.50078
4265.0000 -159.14532 -153.33003 5.81529 2.34894 -153.77641 690.73739
4270.0000 -160.77457 -156.05420 4.72037 2.28741 -154.77115 657.08430
4275.0000 -160.80491 -155.03069 5.77423 2.20426 -156.11537 595.99215
4280.0000 -161.06707 -154.17693 6.89014 2.26640 -155.11078 662.58703
4285.0000 -161.38375 -156.21813 5.16562 2.22232 -155.82340 639.18142
4290.0000 -160.74598 -156.26547 4.48051 2.22470 -155.78490 630.66200
4295.0000 -160.86751 -155.27927 5.58824 2.19317 -156.29466 598.11500
4300.0000 -160.24043 -154.67225 5.56818 2.27810 -154.92178 656.00649
4305.0000 -160.92050 -155.39491 5.52560 2.27852 -154.91495 662.91785
4310.0000 -160.24185 -155.11478 5.12707 2.26568 -155.12242 648.34770
4315.0000 -159.98964 -154.25968 5.72996 2.27019 -155.04965 658.89642
4320.0000 -160.40937 -155.26501 5.14436 2.28787 -154.76374 656.98654
4325.0000 -160.47129 -154.88982 5.58146 2.30289 -154.52093 672.25578
4330.0000 -161.33750 -155.28788 6.04962 2.25024 -155.37201 657.90769
4335.0000 -160.29547 -155.61866 4.67681 2.24572 -155.44511 657.51670
4340.0000 -159.11649 -153.01288 6.10360 2.33908 -153.93594 672.81162
4345.0000 -159.12335 -152.68477 6.43858 2.36074 -153.58565 695.10199
4350.0000 -158.95124 -152.19995 6.75129 2.39450 -153.03992 728.24861
4355.0000 -159.52774 -153.84674 5.68099 2.37256 -153.39466 698.96631
4360.0000 -159.28512 -154.24924 5.03588 2.34369 -153.86142 684.83062
4365.0000 -158.13195 -152.50057 5.63137 2.38591 -153.17882 722.45004
4370.0000 -158.73556 -153.07379 5.66177 2.37722 -153.31937 711.50693
4375.0000 -159.09205 -153.03262 6.05943 2.41385 -152.72720 731.29860
4380.0000 -159.33280 -153.77380 5.55900 2.34075 -153.90889 693.93951
4385.0000 -159.59240 -153.88117 5.71123 2.36135 -153.57583 710.14610
4390.0000 -160.67012 -156.04365 4.62647 2.26440 -155.14321 644.79399
4395.0000 -160.52393 -154.97557 5.54836 2.25161 -155.35000 626.28208
4400.0000 -160.89684 -154.41444 6.48240 2.27719 -154.93633 687.71226
4405.0000 -161.23234 -155.31212 5.92022 2.29209 -154.69551 676.58450
4410.0000 -160.19624 -155.29653 4.89971 2.27015 -155.05023 651.98828
4415.0000 -160.30342 -155.27806 5.02535 2.28616 -154.79132 658.62610
4420.0000 -159.54978 -153.78102 5.76876 2.30548 -154.47911 690.57654
4425.0000 -159.99065 -153.42830 6.56235 2.35235 -153.72143 733.67422
4430.0000 -160.04421 -153.61655 6.42766 2.38311 -153.22408 713.42927
4435.0000 -160.53277 -155.24646 5.28630 2.28210 -154.85701 657.63924
4440.0000 -159.77553 -154.00285 5.77268 2.31444 -154.33428 673.39935
4445.0000 -158.71591 -153.28469 5.43123 2.35828 -153.62553 692.84529
4450.0000 -159.63461 -153.25834 6.37626 2.40462 -152.87631 718.61925
4455.0000 -159.00043 -152.56604 6.43439 2.38677 -153.16499 713.73765
4460.0000 -158.36434 -151.94766 6.41668 2.41510 -152.70692 743.30071
4465.0000 -160.07909 -154.08378 5.99530 2.41148 -152.76540 760.07000
4470.0000 -160.22819 -154.68027 5.54792 2.31781 -154.27977 702.84871
4475.0000 -160.33673 -153.96961 6.36712 2.26771 -155.08959 676.24162
4480.0000 -160.85599 -155.21184 5.64414 2.27860 -154.91355 686.16045
4485.0000 -161.34468 -155.36499 5.97969 2.29747 -154.60864 689.82024
4490.0000 -159.98679 -153.49105 6.49574 2.27759 -154.93001 653.48520
4495.0000 -159.26202 -153.20655 6.05547 2.38803 -153.14460 757.98562
4500.0000 -160.28954 -153.71195 6.57760 2.37137 -153.41393 745.45211
FREEZING PROCESS: loop number 19 T-loop= 657.00000000000000
main_MD> interactions number 19 at Temperature= 657.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.82560 -2.08646 1.53727
force_rgl> df(natom) 3.99865 3.15857 -1.38718
4505.0000 -160.56783 -155.34739 5.22044 2.29211 -154.69515 676.12212
4510.0000 -161.51677 -156.58534 4.93143 2.22906 -155.71448 662.45056
4515.0000 -161.66681 -155.55742 6.10939 2.24268 -155.49428 657.25383
4520.0000 -160.11010 -154.51115 5.59896 2.27854 -154.91454 683.02004
4525.0000 -162.33705 -157.34704 4.99001 2.22737 -155.74176 647.80628
4530.0000 -161.42579 -156.49837 4.92742 2.13544 -157.22804 566.26670
4535.0000 -160.43457 -154.51957 5.91500 2.21918 -155.87424 620.57556
4540.0000 -161.42983 -156.14580 5.28403 2.23031 -155.69428 635.43976
4545.0000 -162.82538 -157.44152 5.38386 2.15960 -156.83745 584.47182
4550.0000 -160.71301 -155.23614 5.47687 2.18821 -156.37493 636.56775
4555.0000 -161.42120 -155.98485 5.43635 2.28987 -154.73148 695.55456
4560.0000 -162.03989 -156.86453 5.17536 2.17731 -156.55116 611.45964
4565.0000 -160.52793 -154.19453 6.33340 2.20230 -156.14710 625.16836
4570.0000 -159.32153 -153.91003 5.41150 2.32433 -154.17431 697.14180
4575.0000 -161.36633 -154.77556 6.59078 2.30280 -154.52242 660.02409
4580.0000 -159.48744 -155.37784 4.10961 2.27774 -154.92753 652.67115
4585.0000 -161.46372 -156.24330 5.22042 2.26653 -155.10870 659.02205
4590.0000 -161.67015 -155.94368 5.72646 2.19992 -156.18555 595.41566
4595.0000 -161.18781 -155.91488 5.27293 2.20990 -156.02425 610.84136
4600.0000 -161.74781 -156.11883 5.62898 2.21001 -156.02241 628.23823
4605.0000 -160.94274 -156.16561 4.77713 2.24323 -155.48541 652.05320
4610.0000 -161.02115 -155.94299 5.07816 2.23165 -155.67260 628.87973
4615.0000 -160.30091 -154.07915 6.22176 2.28359 -154.83289 657.45293
4620.0000 -160.87455 -154.90880 5.96576 2.26184 -155.18449 639.19832
4625.0000 -159.01978 -153.36355 5.65624 2.30601 -154.47058 690.92557
4630.0000 -158.99736 -153.21731 5.78005 2.33653 -153.97709 681.34845
4635.0000 -160.09602 -153.78486 6.31116 2.34854 -153.78300 688.72885
4640.0000 -160.17995 -154.19849 5.98146 2.35581 -153.66538 686.35941
4645.0000 -158.33875 -152.88117 5.45758 2.34014 -153.91873 677.08381
4650.0000 -159.61128 -153.27217 6.33910 2.40871 -152.81020 734.82702
4655.0000 -159.88039 -152.81181 7.06858 2.38357 -153.21666 715.82862
4660.0000 -159.37991 -153.82780 5.55210 2.38088 -153.26006 689.24792
4665.0000 -159.88399 -154.14971 5.73428 2.34920 -153.77233 696.95093
4670.0000 -160.46408 -154.56317 5.90092 2.28381 -154.82946 652.67835
4675.0000 -160.13874 -154.39211 5.74664 2.28863 -154.75155 674.68427
4680.0000 -159.29309 -153.77105 5.52204 2.33686 -153.97178 703.34219
4685.0000 -160.16077 -155.23465 4.92612 2.31281 -154.36064 663.34207
4690.0000 -161.00794 -155.50578 5.50217 2.28849 -154.75380 669.20218
4695.0000 -161.45878 -155.76708 5.69170 2.25049 -155.36805 639.84713
4700.0000 -161.42099 -156.19510 5.22589 2.21164 -155.99609 626.55040
4705.0000 -160.58937 -155.19455 5.39483 2.24278 -155.49261 636.46304
4710.0000 -161.63340 -156.08232 5.55107 2.23819 -155.56685 643.70707
4715.0000 -161.10409 -156.08306 5.02103 2.21773 -155.89769 642.95661
4720.0000 -160.85808 -156.48354 4.37453 2.16484 -156.75264 568.25525
4725.0000 -160.48359 -154.85039 5.63320 2.21011 -156.02091 623.72062
4730.0000 -160.47671 -155.23731 5.23940 2.26711 -155.09940 657.20489
4735.0000 -160.25682 -155.14287 5.11395 2.27034 -155.04716 653.27959
4740.0000 -160.83043 -155.21825 5.61218 2.21993 -155.86201 597.83204
4745.0000 -159.79016 -153.82145 5.96871 2.32317 -154.19303 668.46900
4750.0000 -160.61585 -155.50134 5.11451 2.29704 -154.61558 649.01783
FREEZING PROCESS: loop number 20 T-loop= 632.00000000000000
main_MD> interactions number 20 at Temperature= 632.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.71697 -1.09079 -0.56943
force_rgl> df(natom) 0.49105 -1.28825 0.47734
4755.0000 -160.38084 -154.61672 5.76412 2.23556 -155.60940 631.39850
4760.0000 -160.38045 -155.22886 5.15159 2.28638 -154.78780 642.34219
4765.0000 -160.86874 -155.48474 5.38401 2.22666 -155.75321 626.29397
4770.0000 -162.04210 -157.31158 4.73052 2.20012 -156.18233 611.62960
4775.0000 -161.23237 -156.11561 5.11676 2.16143 -156.80775 598.54227
4780.0000 -160.63096 -154.89525 5.73571 2.22933 -155.71011 647.54329
4785.0000 -161.12060 -155.44552 5.67508 2.24479 -155.46017 646.06227
4790.0000 -161.59939 -156.33272 5.26666 2.22326 -155.80825 636.53611
4795.0000 -160.35943 -154.07483 6.28460 2.23391 -155.63606 624.39198
4800.0000 -159.75040 -154.09462 5.65578 2.31209 -154.37216 688.82093
4805.0000 -160.92882 -155.30673 5.62209 2.30168 -154.54054 665.52934
4810.0000 -159.52760 -154.71999 4.80761 2.27094 -155.03743 630.93199
4815.0000 -161.74672 -155.43704 6.30969 2.27463 -154.97785 667.15114
4820.0000 -162.83127 -157.05008 5.78119 2.19454 -156.27261 635.63410
4825.0000 -162.25382 -156.89269 5.36113 2.13220 -157.28040 603.33282
4830.0000 -161.44090 -156.81732 4.62358 2.17612 -156.57038 639.08080
4835.0000 -162.24647 -158.36959 3.87688 2.10147 -157.77715 585.76704
4840.0000 -161.87733 -156.06816 5.80917 2.14206 -157.12095 605.38492
4845.0000 -160.95078 -156.21045 4.74033 2.22383 -155.79911 661.11761
4850.0000 -161.40297 -155.03973 6.36324 2.23274 -155.65497 635.78536
4855.0000 -160.67466 -155.53790 5.13676 2.22628 -155.75938 652.79373
4860.0000 -160.35235 -155.05534 5.29701 2.24593 -155.44175 613.73293
4865.0000 -159.83865 -154.38125 5.45740 2.26914 -155.06659 644.65998
4870.0000 -159.13800 -153.82170 5.31629 2.28535 -154.80455 651.01161
4875.0000 -157.50220 -151.98746 5.51474 2.40261 -152.90887 703.50524
4880.0000 -160.47822 -154.56511 5.91311 2.34826 -153.78755 724.63913
4885.0000 -161.80476 -156.00723 5.79753 2.23160 -155.67346 629.92556
4890.0000 -161.17395 -155.95390 5.22005 2.20708 -156.06982 606.62182
4895.0000 -160.73100 -156.18579 4.54520 2.23937 -155.54774 623.60113
4900.0000 -161.78607 -156.11057 5.67549 2.21480 -155.94495 616.21239
4905.0000 -161.49987 -155.33127 6.16861 2.23004 -155.69866 619.06053
4910.0000 -160.25647 -155.63429 4.62218 2.24628 -155.43605 632.25873
4915.0000 -160.48287 -154.63611 5.84676 2.25735 -155.25717 646.49081
4920.0000 -160.42359 -155.18096 5.24263 2.26816 -155.08245 657.70714
4925.0000 -162.10631 -155.86537 6.24094 2.26194 -155.18294 635.41808
4930.0000 -160.63199 -154.55552 6.07647 2.24504 -155.45611 636.05798
4935.0000 -160.29562 -154.86554 5.43008 2.26571 -155.12201 644.91685
4940.0000 -160.84562 -155.83215 5.01347 2.27027 -155.04833 655.46863
4945.0000 -161.16605 -156.36524 4.80081 2.16981 -156.67236 577.18494
4950.0000 -161.17525 -156.75438 4.42087 2.19600 -156.24896 608.91073
4955.0000 -161.84056 -156.84383 4.99672 2.15685 -156.88187 584.37182
4960.0000 -161.50498 -157.24950 4.25547 2.17313 -156.61875 596.14507
4965.0000 -161.73724 -156.58541 5.15183 2.14181 -157.12507 569.09509
4970.0000 -161.84707 -156.34536 5.50171 2.21344 -155.96698 615.23408
4975.0000 -160.94905 -155.75117 5.19788 2.20544 -156.09635 596.99971
4980.0000 -161.81636 -156.79381 5.02255 2.20939 -156.03254 599.81964
4985.0000 -161.28959 -156.86011 4.42949 2.12585 -157.38304 548.52335
4990.0000 -161.14255 -155.75614 5.38640 2.18872 -156.36658 604.01120
4995.0000 -160.29328 -153.77356 6.51972 2.27834 -154.91783 662.21136
5000.0000 -159.14695 -153.36636 5.78059 2.35570 -153.66724 704.10357
FREEZING PROCESS: loop number 21 T-loop= 607.00000000000000
main_MD> interactions number 21 at Temperature= 607.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.24156 -0.52729 -0.83924
force_rgl> df(natom) -1.49724 -4.58509 1.01454
5005.0000 -159.20741 -154.54628 4.66113 2.34710 -153.80622 675.11156
5010.0000 -159.58277 -153.96748 5.61529 2.31166 -154.37908 658.56210
5015.0000 -160.34188 -154.70033 5.64155 2.30473 -154.49120 663.51709
5020.0000 -161.19358 -156.00726 5.18632 2.28257 -154.84937 650.44555
5025.0000 -159.77772 -154.89477 4.88295 2.23327 -155.64642 631.38757
5030.0000 -161.31708 -155.78427 5.53281 2.26431 -155.14460 633.66560
5035.0000 -160.91307 -156.26967 4.64339 2.19979 -156.18772 592.86779
5040.0000 -160.48156 -155.20089 5.28067 2.22518 -155.77722 625.94572
5045.0000 -162.44664 -156.04884 6.39780 2.21395 -155.95882 607.87765
5050.0000 -161.95005 -156.89503 5.05501 2.17544 -156.58139 591.21047
5055.0000 -163.02692 -157.79618 5.23074 2.11304 -157.59013 555.07565
5060.0000 -161.90980 -156.96357 4.94623 2.10497 -157.72049 566.39781
5065.0000 -161.78407 -157.83852 3.94555 2.13219 -157.28059 567.94366
5070.0000 -161.87775 -156.62142 5.25633 2.12310 -157.42739 557.88395
5075.0000 -161.79793 -156.56813 5.22981 2.17694 -156.55715 580.95446
5080.0000 -161.91551 -156.46867 5.44684 2.20141 -156.16149 601.71074
5085.0000 -161.18236 -157.31751 3.86485 2.20599 -156.08743 594.29048
5090.0000 -160.69845 -155.48400 5.21446 2.16482 -156.75300 579.39994
5095.0000 -160.99646 -156.24518 4.75128 2.21006 -156.02164 617.86371
5100.0000 -161.34698 -156.44759 4.89940 2.18633 -156.40529 598.54725
5105.0000 -161.87005 -156.63714 5.23291 2.20756 -156.06214 611.03937
5110.0000 -162.36452 -157.08139 5.28313 2.19360 -156.28770 604.23718
5115.0000 -161.58110 -156.78351 4.79759 2.16811 -156.69988 595.60128
5120.0000 -161.50392 -156.21393 5.28999 2.17005 -156.66840 606.37557
5125.0000 -161.18852 -156.40231 4.78621 2.21366 -155.96352 608.11877
5130.0000 -161.37135 -156.18973 5.18163 2.20347 -156.12817 619.08579
5135.0000 -161.80677 -156.44154 5.36524 2.16699 -156.71798 584.36573
5140.0000 -160.86194 -155.79315 5.06880 2.20488 -156.10545 613.68756
5145.0000 -161.57039 -155.71863 5.85175 2.25473 -155.29948 643.98365
5150.0000 -160.36638 -155.52644 4.83995 2.25171 -155.34835 642.06837
5155.0000 -160.32467 -156.04911 4.27556 2.24095 -155.52221 624.77651
5160.0000 -160.49548 -155.86490 4.63057 2.24141 -155.51477 603.70304
5165.0000 -161.67301 -156.61774 5.05527 2.21126 -156.00227 606.94514
5170.0000 -160.82137 -156.17522 4.64615 2.19340 -156.29105 587.66154
5175.0000 -161.96780 -157.26292 4.70489 2.15255 -156.95131 550.70928
5180.0000 -162.42734 -157.55300 4.87434 2.12372 -157.41740 552.48411
5185.0000 -161.50796 -156.60660 4.90137 2.15727 -156.87505 569.30434
5190.0000 -161.78938 -156.21391 5.57548 2.17854 -156.53115 590.07881
5195.0000 -160.51031 -155.30467 5.20564 2.24309 -155.48760 651.61776
5200.0000 -161.23601 -155.76311 5.47291 2.23556 -155.60948 643.61863
5205.0000 -161.38588 -155.82125 5.56463 2.20931 -156.03370 617.34468
5210.0000 -161.16001 -156.30646 4.85355 2.21746 -155.90198 625.44969
5215.0000 -161.60690 -156.37488 5.23202 2.16939 -156.67913 599.42507
5220.0000 -161.30418 -155.59319 5.71099 2.20313 -156.13362 617.49221
5225.0000 -162.21828 -156.42788 5.79040 2.20668 -156.07628 637.20065
5230.0000 -161.73975 -156.59073 5.14903 2.19041 -156.33935 623.20605
5235.0000 -161.81576 -156.74288 5.07288 2.18235 -156.46967 591.15568
5240.0000 -161.79635 -156.14433 5.65202 2.17591 -156.57372 580.95164
5245.0000 -160.34187 -154.76996 5.57191 2.23947 -155.54625 639.21165
5250.0000 -160.64361 -156.16225 4.48136 2.18073 -156.49573 589.26158
FREEZING PROCESS: loop number 22 T-loop= 582.00000000000000
main_MD> interactions number 22 at Temperature= 582.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.03390 0.37727 2.75796
force_rgl> df(natom) 0.00555 -2.59842 -2.12054
5255.0000 -160.42507 -155.80840 4.61667 2.19139 -156.32348 598.82742
5260.0000 -161.71952 -157.05938 4.66015 2.17296 -156.62148 577.40550
5265.0000 -162.94028 -157.71528 5.22500 2.14554 -157.06466 567.79102
5270.0000 -161.65507 -156.88074 4.77434 2.13276 -157.27134 561.07888
5275.0000 -160.80097 -155.73215 5.06882 2.19111 -156.32808 582.10167
5280.0000 -160.13712 -155.48597 4.65115 2.22794 -155.73255 633.49532
5285.0000 -161.41263 -155.55260 5.86003 2.22802 -155.73131 606.55437
5290.0000 -160.73075 -155.54622 5.18453 2.25304 -155.32679 668.95054
5295.0000 -161.35873 -156.19964 5.15908 2.18764 -156.38406 579.74449
5300.0000 -161.57635 -156.28161 5.29474 2.23044 -155.69215 645.18826
5305.0000 -160.96961 -156.67295 4.29666 2.18162 -156.48148 569.26205
5310.0000 -161.11100 -155.73988 5.37113 2.21817 -155.89054 597.36212
5315.0000 -160.60284 -155.98297 4.61987 2.24953 -155.38357 629.23178
5320.0000 -161.68316 -157.08006 4.60310 2.18930 -156.35734 581.51400
5325.0000 -160.78767 -156.52342 4.26425 2.17017 -156.66646 578.19094
5330.0000 -161.00740 -156.14564 4.86176 2.17529 -156.58373 623.09792
5335.0000 -162.60414 -157.59693 5.00721 2.17939 -156.51751 624.14642
5340.0000 -161.67663 -156.33092 5.34571 2.13300 -157.26737 599.42750
5345.0000 -161.75019 -156.92875 4.82144 2.21040 -156.01610 636.35039
5350.0000 -161.17041 -156.46399 4.70641 2.17575 -156.57634 584.26866
5355.0000 -161.80503 -157.34346 4.46157 2.11451 -157.56640 550.66591
5360.0000 -162.07793 -157.39996 4.67797 2.10891 -157.65686 572.19524
5365.0000 -162.37826 -157.28331 5.09495 2.14598 -157.05764 567.93190
5370.0000 -161.62134 -156.42842 5.19292 2.13957 -157.16117 538.95742
5375.0000 -162.19785 -156.96059 5.23726 2.15538 -156.90559 563.32207
5380.0000 -162.17098 -157.08831 5.08267 2.16665 -156.72335 596.80967
5385.0000 -161.98130 -156.15207 5.82922 2.15831 -156.85827 597.68837
5390.0000 -163.11024 -158.15368 4.95655 2.13158 -157.29038 592.76419
5395.0000 -162.98416 -157.80768 5.17648 2.08551 -158.03510 545.81474
5400.0000 -161.31857 -156.65956 4.65901 2.12561 -157.38685 583.44292
5405.0000 -162.56260 -156.54062 6.02197 2.16280 -156.78571 605.05931
5410.0000 -162.04293 -157.75128 4.29165 2.10507 -157.71901 573.68276
5415.0000 -162.68046 -157.54509 5.13537 2.11716 -157.52346 568.63860
5420.0000 -161.82515 -157.15641 4.66874 2.15654 -156.88688 595.72749
5425.0000 -162.24710 -156.72125 5.52585 2.14839 -157.01860 563.01049
5430.0000 -161.94823 -156.32113 5.62710 2.17569 -156.57731 588.74536
5435.0000 -161.45468 -156.31036 5.14433 2.17527 -156.58401 586.30305
5440.0000 -161.04467 -156.63722 4.40744 2.15071 -156.98110 578.14607
5445.0000 -161.14343 -156.25125 4.89219 2.20905 -156.03791 610.54311
5450.0000 -162.66807 -157.29329 5.37478 2.18007 -156.50653 598.76219
5455.0000 -163.02626 -158.18053 4.84573 2.08908 -157.97750 543.17033
5460.0000 -161.22736 -156.16216 5.06519 2.10769 -157.67664 545.26560
5465.0000 -160.93065 -156.01460 4.91606 2.17959 -156.51426 589.69589
5470.0000 -162.09212 -156.48595 5.60617 2.17291 -156.62229 584.16140
5475.0000 -162.51457 -155.93095 6.58362 2.18514 -156.42447 630.92808
5480.0000 -161.60831 -156.79434 4.81397 2.17022 -156.66574 591.81517
5485.0000 -161.65863 -156.89218 4.76645 2.17941 -156.51720 596.24727
5490.0000 -161.62819 -156.03028 5.59790 2.18598 -156.41086 605.19353
5495.0000 -162.01277 -156.71387 5.29889 2.18381 -156.44604 608.19993
5500.0000 -161.61775 -156.01305 5.60471 2.16861 -156.69174 595.06445
FREEZING PROCESS: loop number 23 T-loop= 557.00000000000000
main_MD> interactions number 23 at Temperature= 557.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.76027 1.04032 1.28106
force_rgl> df(natom) -0.16435 3.86855 0.80132
5505.0000 -161.08607 -156.03496 5.05111 2.19601 -156.24886 608.69511
5510.0000 -161.16748 -156.62573 4.54175 2.21050 -156.01452 605.61527
5515.0000 -161.71470 -156.41058 5.30412 2.19447 -156.27374 611.05918
5520.0000 -162.59887 -157.84536 4.75351 2.14801 -157.02481 563.35521
5525.0000 -162.20066 -157.61666 4.58400 2.09724 -157.84552 557.33849
5530.0000 -161.97143 -157.83630 4.13513 2.11027 -157.63487 549.17083
5535.0000 -161.57481 -156.73935 4.83546 2.12976 -157.31980 558.45623
5540.0000 -163.14784 -158.66195 4.48589 2.08889 -157.98055 547.59377
5545.0000 -162.76742 -157.85456 4.91286 2.03799 -158.80334 459.58983
5550.0000 -161.16155 -156.38566 4.77589 2.15890 -156.84865 576.93163
5555.0000 -162.19623 -157.21961 4.97661 2.19403 -156.28078 589.17679
5560.0000 -160.98394 -156.52413 4.45981 2.15344 -156.93695 558.58876
5565.0000 -161.81987 -156.96184 4.85803 2.17318 -156.61791 556.86499
5570.0000 -162.83088 -157.80897 5.02192 2.13519 -157.23198 568.75480
5575.0000 -162.16644 -157.54365 4.62278 2.09566 -157.87101 536.50800
5580.0000 -161.34438 -156.74183 4.60255 2.10917 -157.65265 542.49398
5585.0000 -161.28350 -157.22210 4.06140 2.14812 -157.02292 561.78448
5590.0000 -162.47836 -158.41388 4.06447 2.10459 -157.72666 542.68584
5595.0000 -162.88571 -157.72590 5.15981 2.05659 -158.50270 493.68812
5600.0000 -161.66598 -156.96484 4.70114 2.12274 -157.43326 564.49234
5605.0000 -162.12060 -158.06859 4.05202 2.09948 -157.80929 539.36949
5610.0000 -162.66015 -158.09035 4.56981 2.06777 -158.32202 509.10609
5615.0000 -162.00461 -156.93990 5.06471 2.13853 -157.17806 577.43193
5620.0000 -162.88739 -158.18487 4.70251 2.11313 -157.58864 554.92729
5625.0000 -162.89507 -157.95125 4.94382 2.07910 -158.13875 525.26246
5630.0000 -163.51275 -159.51343 3.99932 2.04862 -158.63145 511.25194
5635.0000 -163.17310 -158.23120 4.94190 2.02459 -159.02005 509.56389
5640.0000 -161.74578 -157.81420 3.93158 2.07141 -158.26309 559.94093
5645.0000 -163.49827 -158.70596 4.79232 2.06441 -158.37630 540.15312
5650.0000 -163.13432 -158.49542 4.63890 2.03991 -158.77236 521.38954
5655.0000 -163.54379 -159.11742 4.42637 2.06219 -158.41220 542.63614
5660.0000 -163.42928 -158.42999 4.99929 2.03753 -158.81079 538.01285
5665.0000 -162.68474 -158.04019 4.64455 2.09481 -157.88477 564.52176
5670.0000 -162.57609 -158.26991 4.30618 2.09601 -157.86534 575.03364
5675.0000 -162.55710 -158.47150 4.08560 2.05085 -158.59555 546.10503
5680.0000 -162.98535 -158.25432 4.73103 2.05811 -158.47807 542.10788
5685.0000 -162.55109 -157.71848 4.83261 2.10312 -157.75053 530.11552
5690.0000 -161.99945 -157.69597 4.30348 2.15883 -156.84983 589.20399
5695.0000 -162.84081 -158.18010 4.66072 2.08714 -158.00875 518.76031
5700.0000 -162.42047 -157.98058 4.43989 2.10055 -157.79208 531.89057
5705.0000 -162.70959 -157.71192 4.99766 2.10527 -157.71570 534.42503
5710.0000 -162.29746 -157.74714 4.55033 2.10383 -157.73895 543.23416
5715.0000 -161.73999 -157.23315 4.50684 2.12994 -157.31686 567.74859
5720.0000 -161.25011 -156.54879 4.70132 2.16967 -156.67453 594.80411
5725.0000 -161.61088 -156.87065 4.74023 2.17291 -156.62217 585.92628
5730.0000 -161.24956 -156.33177 4.91779 2.13920 -157.16725 545.30028
5735.0000 -162.18337 -157.30383 4.87954 2.19550 -156.25702 599.83295
5740.0000 -161.91819 -157.78191 4.13629 2.09260 -157.92061 519.00533
5745.0000 -161.48386 -156.69747 4.78639 2.16223 -156.79482 559.10264
5750.0000 -161.29906 -156.11867 5.18040 2.19165 -156.31928 579.00506
FREEZING PROCESS: loop number 24 T-loop= 532.00000000000000
main_MD> interactions number 24 at Temperature= 532.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.13947 -0.37047 1.12330
force_rgl> df(natom) 0.60125 2.75121 -2.24439
5755.0000 -161.13106 -156.01187 5.11919 2.25350 -155.31934 645.92389
5760.0000 -162.30859 -158.04465 4.26394 2.18316 -156.45645 584.45689
5765.0000 -162.73994 -158.20614 4.53380 2.09270 -157.91890 528.77848
5770.0000 -162.41610 -157.61622 4.79988 2.09530 -157.87681 548.36230
5775.0000 -162.30765 -157.83438 4.47327 2.11002 -157.63900 569.40390
5780.0000 -163.57433 -159.89268 3.68164 2.04854 -158.63282 526.29577
5785.0000 -163.03329 -158.46894 4.56435 2.00835 -159.28259 489.84472
5790.0000 -162.60515 -158.15577 4.44938 2.08573 -158.03154 552.29573
5795.0000 -161.95268 -157.59613 4.35654 2.09971 -157.80563 560.91131
5800.0000 -163.62366 -159.31706 4.30661 2.06780 -158.32151 533.34435
5805.0000 -163.56788 -159.28987 4.27800 2.02260 -159.05214 504.73846
5810.0000 -161.49009 -157.18146 4.30863 2.05482 -158.53137 528.40449
5815.0000 -163.40977 -158.29734 5.11243 2.11664 -157.53188 577.90397
5820.0000 -162.41003 -157.75783 4.65220 2.06951 -158.29374 527.80182
5825.0000 -162.14166 -157.70337 4.43829 2.10703 -157.68724 550.68225
5830.0000 -162.13401 -157.05857 5.07544 2.11525 -157.55431 552.50747
5835.0000 -162.35000 -157.91510 4.43490 2.11441 -157.56801 552.72398
5840.0000 -161.84990 -157.44506 4.40484 2.10917 -157.65262 523.02473
5845.0000 -162.91732 -158.26727 4.65005 2.13879 -157.17381 578.53775
5850.0000 -162.54398 -158.19501 4.34897 2.05794 -158.48084 520.67995
5855.0000 -162.63613 -158.23023 4.40590 2.06596 -158.35116 489.66154
5860.0000 -163.28556 -158.81004 4.47552 2.06253 -158.40672 531.34290
5865.0000 -162.96551 -158.56278 4.40272 2.02990 -158.93416 504.48037
5870.0000 -162.65717 -158.51531 4.14186 2.06146 -158.42402 521.41104
5875.0000 -162.53519 -157.67076 4.86442 2.06255 -158.40641 513.63244
5880.0000 -162.99565 -158.43437 4.56128 2.06934 -158.29658 545.41128
5885.0000 -162.97009 -158.81574 4.15434 2.03434 -158.86234 516.54324
5890.0000 -162.57537 -158.21632 4.35905 2.06002 -158.44721 525.69552
5895.0000 -162.80493 -158.75232 4.05261 2.04498 -158.69040 520.47096
5900.0000 -162.47783 -158.63290 3.84492 2.03852 -158.79487 508.36473
5905.0000 -163.45051 -158.72078 4.72973 2.05185 -158.57929 532.43973
5910.0000 -163.20194 -158.80291 4.39903 2.04103 -158.75430 510.93360
5915.0000 -163.54354 -158.47109 5.07244 2.05671 -158.50073 540.55659
5920.0000 -162.98060 -159.10138 3.87922 2.05403 -158.54405 524.09876
5925.0000 -162.88719 -158.51092 4.37627 2.05935 -158.45802 510.86502
5930.0000 -161.94626 -158.21967 3.72659 2.06365 -158.38857 509.36941
5935.0000 -162.60845 -158.29157 4.31688 2.06331 -158.39398 529.61374
5940.0000 -163.25707 -158.52788 4.72919 2.05894 -158.46468 528.15207
5945.0000 -162.77941 -158.00453 4.77488 2.06164 -158.42105 489.60911
5950.0000 -162.39855 -157.99166 4.40689 2.08307 -158.07467 508.10265
5955.0000 -162.77967 -158.16764 4.61204 2.12138 -157.45520 553.53564
5960.0000 -163.03498 -158.36379 4.67119 2.09327 -157.90967 544.18831
5965.0000 -163.21071 -159.12557 4.08514 2.05278 -158.56423 504.10457
5970.0000 -163.50835 -158.86558 4.64278 2.05128 -158.58853 535.48401
5975.0000 -162.51202 -158.22155 4.29047 2.07595 -158.18967 551.51423
5980.0000 -162.10988 -157.87020 4.23968 2.06927 -158.29773 516.25710
5985.0000 -162.47306 -157.59082 4.88224 2.09678 -157.85291 547.06304
5990.0000 -162.65817 -158.65827 3.99990 2.06854 -158.30950 540.22278
5995.0000 -163.60871 -159.42725 4.18145 2.02047 -159.08664 510.37966
6000.0000 -164.49943 -160.47812 4.02131 1.95376 -160.16502 469.65795
FREEZING PROCESS: loop number 25 T-loop= 507.00000000000000
main_MD> interactions number 25 at Temperature= 507.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.32731 0.96446 0.35482
force_rgl> df(natom) -2.05602 -1.72190 -0.06251
6005.0000 -164.44613 -161.22277 3.22336 1.93152 -160.52463 456.57980
6010.0000 -164.00352 -159.98786 4.01566 1.95902 -160.08008 479.97048
6015.0000 -163.89161 -160.16811 3.72350 1.98182 -159.71140 500.83189
6020.0000 -163.71956 -158.83100 4.88857 1.96309 -160.01428 481.50791
6025.0000 -164.55855 -160.36378 4.19477 1.96086 -160.05034 480.64764
6030.0000 -163.53359 -159.79622 3.73737 1.94427 -160.31852 460.25314
6035.0000 -163.01481 -158.75746 4.25735 1.98836 -159.60574 499.91118
6040.0000 -164.18686 -159.12703 5.05983 2.03802 -158.80295 523.37142
6045.0000 -163.05874 -158.29172 4.76703 2.04679 -158.66118 526.79032
6050.0000 -163.78621 -159.56952 4.21669 2.03777 -158.80697 536.65492
6055.0000 -162.70002 -158.41421 4.28581 2.01854 -159.11784 493.01407
6060.0000 -162.17734 -158.38071 3.79663 2.06270 -158.40391 526.73906
6065.0000 -162.70758 -158.18934 4.51825 2.06599 -158.35069 525.90535
6070.0000 -163.70377 -160.02323 3.68054 2.00538 -159.33053 500.47164
6075.0000 -163.90669 -159.47497 4.43172 1.98950 -159.58727 476.76681
6080.0000 -163.85433 -159.42154 4.43278 2.00959 -159.26250 498.14383
6085.0000 -163.58349 -159.39476 4.18873 1.99311 -159.52886 489.75213
6090.0000 -163.97271 -160.02935 3.94336 1.96232 -160.02672 468.21934
6095.0000 -163.64543 -159.76630 3.87913 1.95817 -160.09384 461.24771
6100.0000 -163.87595 -159.50389 4.37206 1.98108 -159.72343 473.80366
6105.0000 -163.09227 -159.15265 3.93962 1.99934 -159.42818 490.48341
6110.0000 -163.65471 -159.74827 3.90644 2.00135 -159.39563 472.23203
6115.0000 -164.66176 -160.58846 4.07330 1.93512 -160.46639 443.13519
6120.0000 -163.70436 -159.99545 3.70891 1.93006 -160.54827 446.39483
6125.0000 -164.08593 -159.73665 4.34927 1.95977 -160.06797 468.65664
6130.0000 -163.52210 -159.91182 3.61028 1.99146 -159.55561 478.92580
6135.0000 -164.14686 -160.08451 4.06235 1.96792 -159.93613 470.12979
6140.0000 -164.19547 -160.43521 3.76026 1.95154 -160.20087 450.38789
6145.0000 -163.62928 -159.51532 4.11396 1.94505 -160.30579 450.36158
6150.0000 -163.77842 -159.85190 3.92652 1.96669 -159.95599 461.49139
6155.0000 -163.97781 -160.44688 3.53093 1.94880 -160.24518 457.45533
6160.0000 -163.90401 -160.29084 3.61317 1.92938 -160.55920 454.61628
6165.0000 -164.19726 -160.65210 3.54516 1.93071 -160.53764 443.68761
6170.0000 -162.76843 -158.10328 4.66514 1.99587 -159.48426 493.43134
6175.0000 -162.95411 -159.13274 3.82137 2.04904 -158.62467 539.47890
6180.0000 -162.70328 -157.96531 4.73797 2.03492 -158.85296 526.47186
6185.0000 -163.30019 -158.76087 4.53932 2.06570 -158.35541 532.27328
6190.0000 -162.53358 -158.03927 4.49431 2.05111 -158.59125 533.24422
6195.0000 -164.13675 -159.88788 4.24888 2.02122 -159.07454 499.00283
6200.0000 -164.27564 -159.27082 5.00481 1.99405 -159.51377 492.23883
6205.0000 -163.25763 -158.70919 4.54844 2.03898 -158.78741 524.76896
6210.0000 -163.39036 -159.67087 3.71950 2.02508 -159.01205 507.26875
6215.0000 -162.64927 -158.15089 4.49838 2.01448 -159.18350 467.11243
6220.0000 -162.16070 -157.60652 4.55418 2.07037 -158.27993 517.66866
6225.0000 -163.19073 -158.94544 4.24529 2.08020 -158.12106 512.08013
6230.0000 -163.05669 -159.73289 3.32380 2.01065 -159.24540 477.23772
6235.0000 -162.66916 -159.08954 3.57962 2.02812 -158.96292 491.08264
6240.0000 -163.49606 -159.21434 4.28173 2.02314 -159.04343 494.00970
6245.0000 -163.36716 -159.49034 3.87682 2.00082 -159.40434 481.05735
6250.0000 -163.73742 -159.75747 3.97996 1.97784 -159.77579 434.86057
FREEZING PROCESS: loop number 26 T-loop= 482.00000000000000
main_MD> interactions number 26 at Temperature= 482.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.46517 2.10252 1.61202
force_rgl> df(natom) -1.32356 -0.19037 0.48881
6255.0000 -164.06128 -160.14257 3.91870 1.96020 -160.06102 421.45058
6260.0000 -163.08558 -159.42492 3.66067 1.98361 -159.68251 441.63338
6265.0000 -163.05496 -158.73893 4.31603 2.02655 -158.98827 486.25732
6270.0000 -163.07550 -158.84426 4.23123 2.03677 -158.82311 485.21991
6275.0000 -162.88669 -158.69754 4.18915 2.04940 -158.61888 511.47898
6280.0000 -161.93052 -158.23811 3.69241 2.02594 -158.99819 486.55490
6285.0000 -161.82527 -156.93943 4.88585 2.14044 -157.14706 574.62018
6290.0000 -161.67718 -157.24383 4.43335 2.13069 -157.30482 562.89822
6295.0000 -162.58943 -157.64464 4.94479 2.10306 -157.75146 547.49351
6300.0000 -162.52545 -158.28574 4.23971 2.08142 -158.10129 523.18785
6305.0000 -162.85756 -158.81161 4.04594 2.04524 -158.68622 492.75811
6310.0000 -162.64673 -158.26401 4.38272 2.05294 -158.56162 512.88637
6315.0000 -162.62179 -157.92874 4.69305 2.07305 -158.23661 522.51179
6320.0000 -163.07119 -158.75425 4.31694 2.09911 -157.81535 518.29283
6325.0000 -163.51418 -159.08326 4.43092 2.05116 -158.59043 512.23704
6330.0000 -163.15992 -159.68402 3.47590 2.00263 -159.37505 475.92320
6335.0000 -163.49894 -159.70509 3.79385 1.96663 -159.95696 438.24050
6340.0000 -162.63091 -158.53027 4.10064 2.02488 -159.01534 496.93651
6345.0000 -163.88281 -159.46314 4.41968 2.02418 -159.02671 489.27285
6350.0000 -163.38744 -158.85257 4.53487 1.99732 -159.46093 464.85561
6355.0000 -162.78377 -158.54335 4.24042 2.05059 -158.59968 527.08262
6360.0000 -164.26153 -159.92761 4.33391 2.00938 -159.26583 515.73270
6365.0000 -164.59514 -159.76193 4.83322 1.98368 -159.68129 509.14520
6370.0000 -162.50717 -158.36234 4.14484 2.02055 -159.08534 532.66160
6375.0000 -163.85818 -159.74529 4.11289 1.99804 -159.44918 508.61720
6380.0000 -163.03981 -159.13538 3.90443 1.99142 -159.55628 488.98198
6385.0000 -163.73207 -159.60512 4.12695 1.98873 -159.59966 487.64290
6390.0000 -163.51165 -158.91131 4.60034 2.01218 -159.22055 513.21987
6395.0000 -163.97029 -159.27891 4.69139 2.02328 -159.04115 532.45639
6400.0000 -164.08595 -159.06114 5.02481 2.00077 -159.40511 511.99964
6405.0000 -164.01553 -159.89378 4.12175 2.02846 -158.95751 524.90172
6410.0000 -164.09944 -160.60337 3.49608 1.95581 -160.13193 462.48609
6415.0000 -163.51314 -159.19168 4.32145 1.96163 -160.03788 455.11999
6420.0000 -163.08813 -158.45459 4.63354 2.02259 -159.05225 505.67963
6425.0000 -163.41298 -159.11382 4.29916 1.99550 -159.49028 478.83362
6430.0000 -163.01795 -158.71612 4.30183 2.00330 -159.36425 478.16988
6435.0000 -163.08574 -158.26900 4.81674 2.04978 -158.61270 518.84091
6440.0000 -162.70818 -158.29356 4.41462 2.07031 -158.28084 533.75175
6445.0000 -163.79713 -159.08538 4.71175 2.05076 -158.59693 545.71898
6450.0000 -164.01956 -159.25280 4.76676 2.02904 -158.94807 525.05328
6455.0000 -163.68849 -159.72378 3.96471 1.98280 -159.69556 511.78723
6460.0000 -163.61735 -159.89320 3.72415 1.99268 -159.53591 509.94753
6465.0000 -163.02172 -158.28379 4.73793 2.02513 -159.01130 497.94923
6470.0000 -163.18609 -159.79565 3.39043 2.02215 -159.05949 517.23798
6475.0000 -164.01823 -160.58616 3.43206 1.92965 -160.55490 444.90491
6480.0000 -164.07147 -160.34102 3.73045 1.92698 -160.59797 458.73324
6485.0000 -164.82418 -161.07344 3.75074 1.91295 -160.82487 445.32011
6490.0000 -164.57430 -160.46478 4.10952 1.92494 -160.63102 449.51045
6495.0000 -164.00713 -159.93756 4.06957 1.96403 -159.99906 486.53230
6500.0000 -164.15197 -160.83483 3.31714 1.94904 -160.24131 475.53932
FREEZING PROCESS: loop number 27 T-loop= 457.00000000000000
main_MD> interactions number 27 at Temperature= 457.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 4.04859 -0.03717 -0.77364
force_rgl> df(natom) 0.74500 -1.81513 -1.43196
6505.0000 -164.84784 -161.35257 3.49527 1.87377 -161.45813 401.58229
6510.0000 -165.38768 -162.04809 3.33958 1.88377 -161.29648 411.58253
6515.0000 -164.32597 -160.90019 3.42578 1.88553 -161.26811 410.70478
6520.0000 -164.61719 -160.70724 3.90995 1.93595 -160.45304 462.72101
6525.0000 -165.12921 -161.17971 3.94950 1.89009 -161.19444 424.11411
6530.0000 -165.17052 -161.58267 3.58785 1.88546 -161.26927 420.98015
6535.0000 -164.74211 -160.96435 3.77775 1.86593 -161.58499 408.60637
6540.0000 -164.60057 -161.42950 3.17107 1.88198 -161.32553 419.54582
6545.0000 -164.32243 -160.74494 3.57750 1.89707 -161.08158 432.08709
6550.0000 -164.57501 -160.50119 4.07382 1.91789 -160.74500 446.79217
6555.0000 -164.33093 -159.96462 4.36631 1.94034 -160.38208 446.56467
6560.0000 -164.39205 -159.88557 4.50648 1.96393 -160.00065 472.61878
6565.0000 -164.75069 -160.97464 3.77605 1.92610 -160.61226 446.01498
6570.0000 -164.90478 -161.02690 3.87787 1.88960 -161.20224 426.86106
6575.0000 -164.15009 -160.76448 3.38560 1.91081 -160.85932 440.34604
6580.0000 -164.08336 -160.76395 3.31941 1.91448 -160.80003 445.88821
6585.0000 -163.91569 -159.63992 4.27577 1.94581 -160.29363 470.31549
6590.0000 -163.66581 -159.64263 4.02318 2.00687 -159.30646 522.24885
6595.0000 -163.96225 -160.69501 3.26724 1.95832 -160.09137 471.99241
6600.0000 -163.42180 -159.82541 3.59639 1.98006 -159.73985 478.90135
6605.0000 -163.76079 -159.75502 4.00577 2.00819 -159.28518 480.38706
6610.0000 -163.73883 -159.53998 4.19885 2.00777 -159.29189 496.35670
6615.0000 -164.38923 -160.60794 3.78130 1.97023 -159.89872 468.67199
6620.0000 -163.99620 -159.55863 4.43758 1.95432 -160.15601 454.77065
6625.0000 -164.22091 -159.72554 4.49537 1.99540 -159.49183 491.54082
6630.0000 -163.62111 -159.78359 3.83752 1.99754 -159.45731 479.23647
6635.0000 -163.15527 -159.12578 4.02949 1.98503 -159.65958 479.20208
6640.0000 -164.09748 -160.98646 3.11102 1.95844 -160.08946 459.82275
6645.0000 -164.14686 -160.19881 3.94805 1.93289 -160.50237 430.69568
6650.0000 -162.56158 -158.48652 4.07506 2.02146 -159.07061 504.69073
6655.0000 -163.62205 -159.78609 3.83596 2.02648 -158.98948 482.95636
6660.0000 -163.44564 -159.70529 3.74035 1.98621 -159.64050 454.16924
6665.0000 -163.18006 -158.62685 4.55321 2.00869 -159.27708 476.59700
6670.0000 -163.61816 -159.75198 3.86618 2.01176 -159.22740 473.34907
6675.0000 -163.25113 -160.15825 3.09288 1.99566 -159.48771 458.55841
6680.0000 -163.64591 -159.29505 4.35086 1.97298 -159.85428 435.47243
6685.0000 -163.16914 -159.75331 3.41583 1.99115 -159.56066 446.62401
6690.0000 -162.64068 -158.84867 3.79202 2.00331 -159.36396 459.97817
6695.0000 -162.85259 -158.93869 3.91390 2.04287 -158.72447 497.61251
6700.0000 -162.96610 -159.77377 3.19232 1.99082 -159.56597 447.24930
6705.0000 -163.99377 -160.08146 3.91231 1.99762 -159.45594 451.87476
6710.0000 -164.03128 -159.76607 4.26520 1.96386 -160.00183 427.69867
6715.0000 -164.29965 -160.67867 3.62098 1.95236 -160.18764 447.77528
6720.0000 -163.79918 -159.52869 4.27049 1.95536 -160.13921 445.73991
6725.0000 -163.32918 -159.90620 3.42298 1.97209 -159.86876 456.05334
6730.0000 -163.44178 -159.51812 3.92365 1.96455 -159.99055 458.24543
6735.0000 -163.67686 -160.08382 3.59305 1.99185 -159.54925 479.36930
6740.0000 -164.19541 -160.74817 3.44724 1.93367 -160.48991 431.72916
6745.0000 -163.82736 -160.22311 3.60425 1.91316 -160.82138 420.81222
6750.0000 -164.17793 -160.60271 3.57522 1.93190 -160.51845 436.39743
FREEZING PROCESS: loop number 28 T-loop= 432.00000000000000
main_MD> interactions number 28 at Temperature= 432.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.30770 0.05979 1.85145
force_rgl> df(natom) 3.05848 -0.30151 -1.38103
6755.0000 -164.62558 -161.42117 3.20441 1.92680 -160.60089 436.86381
6760.0000 -164.92528 -161.36786 3.55742 1.87424 -161.45058 403.82170
6765.0000 -163.86804 -159.87751 3.99053 1.88894 -161.21302 407.79923
6770.0000 -164.25529 -160.74336 3.51194 1.94562 -160.29672 464.58262
6775.0000 -164.76237 -160.92947 3.83290 1.90355 -160.97669 442.72143
6780.0000 -164.83130 -160.92715 3.90415 1.90758 -160.91161 431.25640
6785.0000 -164.92551 -161.47783 3.44769 1.88959 -161.20238 415.25975
6790.0000 -164.37612 -161.06338 3.31275 1.86113 -161.66257 395.68867
6795.0000 -164.62954 -160.75572 3.87382 1.91371 -160.81251 431.35947
6800.0000 -163.40310 -159.75132 3.65178 1.96228 -160.02725 476.20704
6805.0000 -163.94206 -159.83379 4.10826 1.97085 -159.88884 475.95363
6810.0000 -163.96496 -159.67223 4.29273 1.98219 -159.70540 487.52920
6815.0000 -164.39448 -160.50140 3.89307 1.95404 -160.16059 470.59386
6820.0000 -163.98961 -160.37405 3.61556 1.93747 -160.42844 455.49708
6825.0000 -165.07262 -160.95053 4.12209 1.90486 -160.95557 428.46659
6830.0000 -165.30039 -161.57463 3.72576 1.89509 -161.11345 434.41601
6835.0000 -164.96188 -161.97980 2.98208 1.86485 -161.60247 395.91055
6840.0000 -164.58176 -161.18787 3.39389 1.86409 -161.61465 394.00414
6845.0000 -164.20033 -160.13922 4.06111 1.94731 -160.26934 462.30456
6850.0000 -163.83783 -160.91419 2.92364 1.92487 -160.63206 425.45729
6855.0000 -163.71553 -160.07568 3.63985 1.92571 -160.61844 416.34680
6860.0000 -164.76305 -160.86769 3.89536 1.95922 -160.07674 445.65758
6865.0000 -164.06057 -160.06719 3.99338 1.96010 -160.06262 452.11834
6870.0000 -164.25099 -160.17697 4.07402 1.97366 -159.84342 475.48669
6875.0000 -164.49830 -160.61470 3.88360 1.95050 -160.21774 461.01944
6880.0000 -164.30575 -160.99077 3.31498 1.92518 -160.62713 444.11973
6885.0000 -163.76608 -160.29586 3.47022 1.91412 -160.80587 432.07344
6890.0000 -164.86420 -160.99698 3.86721 1.93233 -160.51147 441.83098
6895.0000 -164.18436 -160.89104 3.29332 1.91098 -160.85669 430.28632
6900.0000 -164.82748 -161.17313 3.65435 1.92006 -160.70987 434.72876
6905.0000 -164.50728 -160.85594 3.65134 1.91087 -160.85841 435.38897
6910.0000 -164.91944 -161.54700 3.37243 1.89855 -161.05766 429.99916
6915.0000 -164.67600 -161.63011 3.04590 1.88332 -161.30384 411.95362
6920.0000 -164.36749 -160.44860 3.91889 1.90216 -160.99926 426.18447
6925.0000 -164.19923 -160.19591 4.00332 1.94624 -160.28666 467.25745
6930.0000 -164.19396 -160.85363 3.34034 1.93541 -160.46178 438.22658
6935.0000 -164.61780 -160.89197 3.72583 1.89603 -161.09829 408.49469
6940.0000 -164.93089 -160.56060 4.37029 1.94037 -160.38150 462.76543
6945.0000 -164.71665 -160.97709 3.73956 1.89869 -161.05535 419.94514
6950.0000 -164.59495 -160.84868 3.74627 1.89491 -161.11637 426.37177
6955.0000 -163.96687 -160.57305 3.39382 1.91197 -160.84060 441.99999
6960.0000 -165.09121 -161.51725 3.57396 1.91073 -160.86073 432.13481
6965.0000 -164.88199 -161.41054 3.47145 1.87370 -161.45931 414.77715
6970.0000 -164.69438 -160.88667 3.80771 1.90629 -160.93247 452.07632
6975.0000 -164.62475 -160.82500 3.79975 1.89808 -161.06512 432.90709
6980.0000 -165.03470 -161.13691 3.89780 1.90421 -160.96604 434.28685
6985.0000 -164.72153 -160.78992 3.93161 1.90421 -160.96604 434.80400
6990.0000 -164.84909 -161.01841 3.83067 1.90478 -160.95691 443.18875
6995.0000 -164.96236 -161.41282 3.54954 1.89993 -161.03533 434.38896
7000.0000 -164.68023 -160.76760 3.91263 1.87905 -161.37287 422.14550
FREEZING PROCESS: loop number 29 T-loop= 407.00000000000000
main_MD> interactions number 29 at Temperature= 407.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.90212 1.91751 0.55140
force_rgl> df(natom) -2.61314 -1.66811 2.56569
7005.0000 -164.63771 -161.51954 3.11816 1.88600 -161.26043 428.88917
7010.0000 -164.93283 -161.84806 3.08477 1.85911 -161.69518 401.21692
7015.0000 -164.95647 -161.69739 3.25908 1.85990 -161.68247 407.54551
7020.0000 -165.86974 -162.64774 3.22200 1.82727 -162.20989 380.45638
7025.0000 -165.46338 -162.78773 2.67565 1.80458 -162.57666 359.79186
7030.0000 -164.87171 -161.90230 2.96940 1.82719 -162.21118 373.02506
7035.0000 -165.43718 -162.43132 3.00587 1.84021 -162.00081 384.95319
7040.0000 -165.00467 -161.83327 3.17140 1.83697 -162.05308 381.78207
7045.0000 -164.64699 -160.90739 3.73959 1.90236 -160.99605 437.86286
7050.0000 -164.88327 -161.17301 3.71026 1.89244 -161.15631 424.12180
7055.0000 -164.32822 -160.85203 3.47620 1.91938 -160.72081 447.52710
7060.0000 -164.93748 -161.78043 3.15705 1.87536 -161.43242 413.51361
7065.0000 -164.27433 -160.87945 3.39488 1.89342 -161.14049 416.51626
7070.0000 -165.49887 -162.46248 3.03639 1.84430 -161.93456 381.81174
7075.0000 -164.81661 -161.70507 3.11153 1.83919 -162.01721 377.56970
7080.0000 -164.45624 -160.67885 3.77739 1.87584 -161.42473 409.26814
7085.0000 -165.38746 -161.53758 3.84989 1.89726 -161.07849 428.42894
7090.0000 -164.88950 -161.07398 3.81551 1.89117 -161.17687 420.88055
7095.0000 -164.13220 -160.65195 3.48025 1.90749 -160.91306 436.37089
7100.0000 -164.25387 -160.88474 3.36914 1.93059 -160.53963 451.40725
7105.0000 -164.76485 -161.15257 3.61229 1.89339 -161.14102 421.65620
7110.0000 -164.71865 -161.10326 3.61539 1.88608 -161.25920 418.01960
7115.0000 -164.39523 -161.12011 3.27512 1.90428 -160.96493 435.49625
7120.0000 -165.46928 -162.16188 3.30740 1.86865 -161.54100 399.92058
7125.0000 -164.66119 -160.82432 3.83686 1.86501 -161.59978 391.54565
7130.0000 -165.01061 -161.28773 3.72288 1.88302 -161.30872 412.28582
7135.0000 -164.87954 -161.07530 3.80424 1.88118 -161.33836 411.85545
7140.0000 -164.84150 -161.47250 3.36900 1.90626 -160.93288 433.72602
7145.0000 -164.68890 -161.59192 3.09697 1.87021 -161.51580 394.99998
7150.0000 -164.91401 -161.27139 3.64262 1.86910 -161.53376 394.81302
7155.0000 -164.92738 -161.41785 3.50953 1.86965 -161.52474 402.68975
7160.0000 -164.70952 -161.10168 3.60784 1.88131 -161.33634 405.45210
7165.0000 -165.21364 -161.36929 3.84435 1.88291 -161.31050 409.36121
7170.0000 -164.81372 -161.83482 2.97890 1.87182 -161.48976 396.47460
7175.0000 -163.86878 -161.01537 2.85342 1.87804 -161.38923 399.67129
7180.0000 -164.74544 -161.49644 3.24900 1.86416 -161.61356 389.98844
7185.0000 -165.04299 -161.05452 3.98847 1.91460 -160.79816 435.21010
7190.0000 -164.02340 -160.33866 3.68474 1.91155 -160.84737 422.45577
7195.0000 -164.61579 -160.87010 3.74568 1.91208 -160.83889 435.14167
7200.0000 -164.83445 -160.63215 4.20230 1.92622 -160.61028 443.16852
7205.0000 -164.92279 -160.72086 4.20193 1.93193 -160.51798 450.60473
7210.0000 -164.66020 -161.01888 3.64131 1.90471 -160.95793 434.66509
7215.0000 -164.83199 -161.50426 3.32773 1.86757 -161.55839 380.11256
7220.0000 -164.08426 -160.67083 3.41343 1.88178 -161.32872 390.10877
7225.0000 -164.21747 -160.83423 3.38323 1.91790 -160.74480 423.70654
7230.0000 -164.10950 -160.84769 3.26181 1.91175 -160.84427 405.76535
7235.0000 -163.57842 -159.99281 3.58561 1.93226 -160.51264 429.01596
7240.0000 -164.09462 -159.61090 4.48371 1.99068 -159.56812 498.96193
7245.0000 -164.36879 -161.36853 3.00026 1.93079 -160.53634 449.07763
7250.0000 -165.46094 -162.24398 3.21697 1.85621 -161.74203 394.11524
FREEZING PROCESS: loop number 30 T-loop= 382.00000000000000
main_MD> interactions number 30 at Temperature= 382.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.47903 -0.19578 0.65915
force_rgl> df(natom) 0.19703 -5.06609 -1.98416
7255.0000 -165.83427 -163.37825 2.45602 1.79391 -162.74918 341.60271
7260.0000 -165.29065 -162.37561 2.91504 1.80142 -162.62788 345.93520
7265.0000 -164.60197 -161.22336 3.37861 1.86890 -161.53694 390.75837
7270.0000 -164.99278 -161.89339 3.09939 1.84931 -161.85365 376.95216
7275.0000 -164.76078 -160.92036 3.84042 1.87536 -161.43241 404.15140
7280.0000 -165.20416 -161.62204 3.58213 1.90303 -160.98517 419.15291
7285.0000 -165.36041 -162.14816 3.21225 1.85245 -161.80287 373.48470
7290.0000 -164.21928 -161.19546 3.02381 1.86191 -161.64995 385.14130
7295.0000 -165.87607 -162.81513 3.06094 1.84418 -161.93647 377.41026
7300.0000 -165.55052 -162.58040 2.97012 1.79328 -162.75947 342.56908
7305.0000 -164.99701 -162.19555 2.80146 1.83735 -162.04703 369.22830
7310.0000 -164.76300 -161.93471 2.82830 1.82582 -162.23341 356.45502
7315.0000 -164.62532 -161.77353 2.85179 1.85482 -161.76460 380.69041
7320.0000 -164.65465 -161.73685 2.91780 1.86358 -161.62292 383.67419
7325.0000 -165.02329 -161.85717 3.16612 1.83728 -162.04805 363.60905
7330.0000 -165.38908 -162.51308 2.87599 1.83744 -162.04547 362.47012
7335.0000 -164.72641 -161.38164 3.34477 1.84476 -161.92721 366.03543
7340.0000 -165.41676 -161.63099 3.78577 1.86252 -161.64012 383.27502
7345.0000 -163.73095 -160.87346 2.85749 1.84781 -161.87790 369.75486
7350.0000 -164.31171 -161.41757 2.89414 1.89712 -161.08066 411.14149
7355.0000 -164.93582 -161.99340 2.94242 1.87384 -161.45699 393.77404
7360.0000 -164.70515 -161.81382 2.89133 1.84328 -161.95106 375.61759
7365.0000 -164.91800 -161.81642 3.10158 1.83136 -162.14373 359.86964
7370.0000 -165.38383 -162.59784 2.78598 1.82968 -162.17097 365.18229
7375.0000 -165.30911 -162.07122 3.23789 1.81285 -162.44299 346.57494
7380.0000 -165.52217 -162.19758 3.32459 1.83387 -162.10325 366.19609
7385.0000 -165.40158 -162.19359 3.20799 1.84386 -161.94166 384.76229
7390.0000 -165.15278 -161.57163 3.58115 1.82411 -162.26100 370.77815
7395.0000 -165.32808 -161.70551 3.62257 1.85792 -161.71440 401.06534
7400.0000 -165.61527 -162.02894 3.58633 1.83982 -162.00699 392.98114
7405.0000 -165.44817 -162.57664 2.87153 1.80699 -162.53784 359.47885
7410.0000 -165.53839 -161.84162 3.69677 1.82774 -162.20227 378.67277
7415.0000 -165.41354 -162.59629 2.81725 1.82808 -162.19681 373.06978
7420.0000 -165.27298 -162.25775 3.01523 1.84371 -161.94409 382.64126
7425.0000 -165.22986 -162.04078 3.18909 1.83945 -162.01297 388.56996
7430.0000 -165.65329 -162.06648 3.58681 1.83450 -162.09297 380.99183
7435.0000 -165.43816 -161.61414 3.82402 1.84964 -161.84836 399.12864
7440.0000 -164.84497 -161.75103 3.09394 1.84651 -161.89881 390.62320
7445.0000 -164.56689 -161.14055 3.42634 1.87166 -161.49228 407.05533
7450.0000 -165.37342 -161.53699 3.83643 1.85866 -161.70252 397.19809
7455.0000 -165.71319 -162.60181 3.11138 1.83683 -162.05542 389.19541
7460.0000 -165.76249 -162.54826 3.21424 1.80405 -162.58533 355.10406
7465.0000 -165.14602 -162.44638 2.69964 1.82187 -162.29720 374.10060
7470.0000 -164.76847 -161.02361 3.74486 1.85412 -161.77585 406.75651
7475.0000 -164.77386 -161.56020 3.21365 1.87336 -161.46477 413.69503
7480.0000 -165.61757 -162.57781 3.03975 1.82077 -162.31498 367.82729
7485.0000 -165.89435 -162.84742 3.04693 1.79794 -162.68406 353.11402
7490.0000 -165.38478 -162.44322 2.94156 1.81768 -162.36491 367.65126
7495.0000 -165.58434 -162.83333 2.75101 1.80774 -162.52567 365.34732
7500.0000 -165.76909 -162.82922 2.93988 1.79298 -162.76422 350.07741
FREEZING PROCESS: loop number 31 T-loop= 357.00000000000000
main_MD> interactions number 31 at Temperature= 357.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.68000 -1.96801 -3.87502
force_rgl> df(natom) -2.51071 -1.70895 -0.77690
7505.0000 -165.19530 -162.57775 2.61755 1.79503 -162.73113 343.01650
7510.0000 -165.41562 -162.17245 3.24318 1.81304 -162.43994 360.70578
7515.0000 -165.34580 -161.88187 3.46393 1.82153 -162.30270 368.90730
7520.0000 -165.37156 -161.72937 3.64219 1.84068 -161.99314 387.47106
7525.0000 -165.63315 -162.43915 3.19400 1.83914 -162.01809 385.35033
7530.0000 -165.28204 -162.16542 3.11662 1.81686 -162.37827 371.76865
7535.0000 -165.00212 -161.94817 3.05395 1.82284 -162.28152 374.62800
7540.0000 -165.45271 -162.28204 3.17067 1.84245 -161.96460 384.97515
7545.0000 -165.45979 -162.65396 2.80583 1.82376 -162.26668 365.23301
7550.0000 -165.82496 -162.52098 3.30399 1.81404 -162.42377 355.20144
7555.0000 -165.65170 -162.70728 2.94442 1.82116 -162.30862 369.53525
7560.0000 -165.90949 -163.05733 2.85216 1.79157 -162.78699 342.03466
7565.0000 -165.06403 -162.08695 2.97708 1.80841 -162.51476 364.83775
7570.0000 -166.09296 -163.19404 2.89892 1.80048 -162.64294 362.97245
7575.0000 -166.28994 -162.67838 3.61155 1.78479 -162.89669 342.85280
7580.0000 -166.33083 -163.54279 2.78804 1.76088 -163.28325 318.26080
7585.0000 -165.81241 -163.00760 2.80481 1.74469 -163.54501 310.02260
7590.0000 -165.48854 -162.64858 2.83996 1.78932 -162.82343 348.90210
7595.0000 -165.77478 -162.90016 2.87461 1.79200 -162.78011 346.29555
7600.0000 -165.80522 -162.64749 3.15774 1.76034 -163.29197 320.78668
7605.0000 -165.52196 -162.40966 3.11229 1.82603 -162.22992 377.93567
7610.0000 -164.78749 -161.81657 2.97092 1.84370 -161.94426 384.98319
7615.0000 -164.72791 -161.73805 2.98986 1.86918 -161.53241 410.14106
7620.0000 -165.01470 -162.07755 2.93715 1.84354 -161.94682 386.62141
7625.0000 -165.60234 -163.07805 2.52429 1.80723 -162.53390 359.63789
7630.0000 -166.23851 -163.58701 2.65150 1.75834 -163.32430 318.37954
7635.0000 -165.85804 -162.87648 2.98155 1.78370 -162.91429 336.63065
7640.0000 -165.62869 -162.66306 2.96563 1.78728 -162.85646 335.21370
7645.0000 -165.81928 -162.93940 2.87988 1.79636 -162.70956 348.14594
7650.0000 -166.08748 -163.41060 2.67688 1.77738 -163.01644 331.69575
7655.0000 -165.54644 -163.21322 2.33322 1.74886 -163.47745 315.07890
7660.0000 -165.22143 -162.05880 3.16263 1.78883 -162.83139 342.97492
7665.0000 -165.63839 -162.40013 3.23825 1.82802 -162.19787 374.29711
7670.0000 -165.43993 -162.53971 2.90022 1.79718 -162.69641 354.15402
7675.0000 -165.86273 -162.52292 3.33981 1.79703 -162.69872 348.27092
7680.0000 -165.83129 -161.77852 4.05276 1.84091 -161.98938 393.12211
7685.0000 -165.96452 -162.46918 3.49534 1.82300 -162.27892 378.37807
7690.0000 -165.47525 -161.93648 3.53877 1.81046 -162.48171 363.43725
7695.0000 -165.99525 -162.64097 3.35428 1.81609 -162.39066 368.83846
7700.0000 -165.26714 -162.03929 3.22785 1.80754 -162.52881 364.75449
7705.0000 -165.51038 -162.32691 3.18347 1.81636 -162.38624 365.64562
7710.0000 -165.65545 -162.65390 3.00154 1.80003 -162.65031 354.29301
7715.0000 -165.33065 -162.59989 2.73076 1.79668 -162.70437 353.24157
7720.0000 -165.55996 -162.08847 3.47149 1.80415 -162.58376 354.32944
7725.0000 -165.77655 -163.14175 2.63480 1.79330 -162.75914 344.77860
7730.0000 -165.20065 -162.22404 2.97661 1.78016 -162.97151 330.95610
7735.0000 -165.35841 -162.21249 3.14592 1.81939 -162.33727 373.76866
7740.0000 -165.95301 -162.96701 2.98601 1.80966 -162.49465 363.50848
7745.0000 -165.54107 -162.68203 2.85904 1.80136 -162.62885 359.23473
7750.0000 -165.45537 -162.86600 2.58937 1.79149 -162.78833 343.52356
FREEZING PROCESS: loop number 32 T-loop= 332.00000000000000
main_MD> interactions number 32 at Temperature= 332.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.41970 0.49883 4.75146
force_rgl> df(natom) 2.56841 -1.28252 -0.82057
7755.0000 -165.52634 -163.07376 2.45258 1.77773 -163.01074 335.29938
7760.0000 -165.66744 -162.84468 2.82276 1.77499 -163.05512 330.36943
7765.0000 -165.61286 -162.96698 2.64589 1.78240 -162.93530 333.75862
7770.0000 -165.62614 -161.85189 3.77425 1.81886 -162.34582 372.59347
7775.0000 -165.64073 -162.45348 3.18726 1.82344 -162.27191 372.03221
7780.0000 -165.59822 -162.38704 3.21118 1.81768 -162.36502 366.24346
7785.0000 -165.54898 -162.25283 3.29616 1.80771 -162.52619 357.98429
7790.0000 -165.40227 -162.15065 3.25163 1.83269 -162.12238 381.70150
7795.0000 -165.27604 -162.02541 3.25063 1.84156 -161.97894 387.42094
7800.0000 -165.02717 -161.87212 3.15505 1.83298 -162.11756 384.64499
7805.0000 -165.55824 -162.12653 3.43171 1.81239 -162.45047 362.05965
7810.0000 -166.43018 -163.82196 2.60822 1.78203 -162.94122 333.59581
7815.0000 -166.39729 -163.69520 2.70209 1.72640 -163.84053 285.10227
7820.0000 -166.29959 -163.53833 2.76125 1.73316 -163.73137 295.13891
7825.0000 -165.83090 -163.35297 2.47793 1.75914 -163.31132 315.65709
7830.0000 -166.28007 -163.80546 2.47461 1.75232 -163.42164 310.35735
7835.0000 -166.17689 -163.54580 2.63109 1.74178 -163.59191 300.18988
7840.0000 -165.63422 -162.70733 2.92689 1.76799 -163.16819 324.11841
7845.0000 -165.95389 -162.87958 3.07431 1.79346 -162.75649 344.19857
7850.0000 -165.58359 -162.94935 2.63424 1.79377 -162.75143 338.81293
7855.0000 -165.25419 -162.47742 2.77677 1.78911 -162.82681 339.86952
7860.0000 -166.03567 -163.09284 2.94283 1.78397 -162.90992 328.14316
7865.0000 -165.67205 -163.32015 2.35190 1.77552 -163.04658 323.50168
7870.0000 -165.67385 -162.94787 2.72598 1.77887 -162.99242 326.24322
7875.0000 -166.12374 -163.07308 3.05066 1.78209 -162.94036 331.82673
7880.0000 -165.82187 -163.25817 2.56370 1.78620 -162.87382 332.68962
7885.0000 -165.86417 -162.97492 2.88925 1.77598 -163.03905 320.54312
7890.0000 -165.38285 -162.69873 2.68411 1.78735 -162.85526 334.79230
7895.0000 -165.09810 -161.93566 3.16244 1.83161 -162.13976 378.03592
7900.0000 -166.06406 -162.99306 3.07100 1.81540 -162.40184 359.71571
7905.0000 -165.83661 -163.16896 2.66765 1.78193 -162.94288 332.36082
7910.0000 -165.76852 -163.65121 2.11731 1.74362 -163.56229 297.42511
7915.0000 -166.39911 -163.14652 3.25259 1.75645 -163.35478 308.52810
7920.0000 -164.82071 -162.26900 2.55171 1.79198 -162.78040 340.05836
7925.0000 -165.94699 -162.67843 3.26857 1.83234 -162.12797 376.46402
7930.0000 -166.24051 -163.62178 2.61873 1.78172 -162.94624 331.90833
7935.0000 -165.83715 -163.16942 2.66773 1.75352 -163.40210 308.81905
7940.0000 -165.84381 -163.20135 2.64246 1.76944 -163.14477 322.01021
7945.0000 -165.76309 -162.86394 2.89915 1.77530 -163.05009 327.18429
7950.0000 -165.51458 -162.48297 3.03161 1.78486 -162.89550 333.71065
7955.0000 -165.05333 -162.47129 2.58203 1.81806 -162.35878 360.34744
7960.0000 -165.80527 -162.11365 3.69162 1.82363 -162.26879 366.88421
7965.0000 -166.11185 -163.02937 3.08248 1.81194 -162.45769 353.13632
7970.0000 -165.86407 -163.86691 1.99716 1.74645 -163.51645 295.99540
7975.0000 -166.23401 -163.44577 2.78825 1.74225 -163.58433 298.57268
7980.0000 -165.83163 -162.95477 2.87686 1.76484 -163.21919 314.34507
7985.0000 -166.18182 -163.55984 2.62199 1.74472 -163.54438 298.95770
7990.0000 -166.42232 -163.68324 2.73908 1.73979 -163.62411 291.98999
7995.0000 -165.62030 -162.71480 2.90550 1.76613 -163.19826 311.20248
8000.0000 -165.52632 -162.89752 2.62880 1.78782 -162.84765 332.75493
FREEZING PROCESS: loop number 33 T-loop= 307.00000000000000
main_MD> interactions number 33 at Temperature= 307.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.70843 2.64224 1.01860
force_rgl> df(natom) 0.34440 -1.15606 3.00636
8005.0000 -165.93463 -163.50051 2.43412 1.77029 -163.13108 318.68955
8010.0000 -165.70995 -162.94423 2.76573 1.75549 -163.37039 305.64443
8015.0000 -165.75031 -163.08788 2.66243 1.76652 -163.19207 315.03830
8020.0000 -165.98059 -164.04329 1.93730 1.74224 -163.58461 285.33264
8025.0000 -165.87167 -163.15945 2.71222 1.73344 -163.72673 285.04117
8030.0000 -166.24903 -163.06294 3.18609 1.76732 -163.17914 313.55453
8035.0000 -166.16577 -163.84046 2.32531 1.76227 -163.26070 309.33527
8040.0000 -165.95667 -163.34393 2.61275 1.75468 -163.38345 297.38261
8045.0000 -165.96625 -163.05881 2.90744 1.76209 -163.26360 307.05000
8050.0000 -165.55417 -163.22094 2.33323 1.76030 -163.29260 305.37751
8055.0000 -165.72453 -163.64282 2.08172 1.75933 -163.30830 304.56243
8060.0000 -166.24185 -163.46224 2.77960 1.75259 -163.41729 311.27347
8065.0000 -166.02764 -163.58159 2.44605 1.73469 -163.70656 294.23743
8070.0000 -165.86829 -163.52718 2.34112 1.72766 -163.82029 290.92619
8075.0000 -166.68558 -163.95282 2.73275 1.73615 -163.68306 289.98808
8080.0000 -165.92668 -163.84080 2.08588 1.72495 -163.86409 287.96521
8085.0000 -165.60932 -162.98422 2.62509 1.73754 -163.66054 299.96795
8090.0000 -166.12220 -163.40114 2.72106 1.77931 -162.98530 340.93707
8095.0000 -166.17635 -163.79883 2.37752 1.73301 -163.73373 294.69980
8100.0000 -166.18416 -163.24100 2.94317 1.76263 -163.25497 320.64872
8105.0000 -165.78135 -163.62232 2.15902 1.74836 -163.48565 309.12463
8110.0000 -166.25763 -163.38795 2.86968 1.75447 -163.38683 313.66738
8115.0000 -166.21874 -163.59391 2.62483 1.74071 -163.60926 296.11365
8120.0000 -166.20380 -163.28220 2.92160 1.75393 -163.39553 309.91320
8125.0000 -165.56212 -162.37571 3.18641 1.78627 -162.87268 335.52491
8130.0000 -165.54866 -163.16083 2.38783 1.79568 -162.72058 334.77417
8135.0000 -165.41695 -162.97810 2.43885 1.75568 -163.36719 306.26284
8140.0000 -165.82290 -162.96459 2.85831 1.77369 -163.07604 323.42934
8145.0000 -165.15282 -162.70101 2.45182 1.77441 -163.06448 332.87767
8150.0000 -165.87302 -163.02259 2.85043 1.76874 -163.15608 325.68006
8155.0000 -165.56200 -163.49862 2.06339 1.74164 -163.59431 303.14708
8160.0000 -166.40698 -163.71206 2.69492 1.74280 -163.57544 310.60103
8165.0000 -165.94780 -163.78445 2.16335 1.74855 -163.48256 306.47740
8170.0000 -165.84111 -163.66443 2.17668 1.73227 -163.74574 289.82446
8175.0000 -166.36637 -164.29442 2.07195 1.72080 -163.93111 280.91903
8180.0000 -166.47362 -164.01731 2.45631 1.70299 -164.21904 266.95596
8185.0000 -166.15405 -163.58868 2.56537 1.75715 -163.34354 320.21207
8190.0000 -165.91147 -163.73805 2.17342 1.73847 -163.64544 297.19872
8195.0000 -165.88137 -163.29340 2.58797 1.74236 -163.58258 298.34372
8200.0000 -166.34283 -163.73347 2.60936 1.74411 -163.55438 300.82926
8205.0000 -166.11967 -163.64210 2.47757 1.73517 -163.69876 296.33509
8210.0000 -166.44960 -163.88531 2.56428 1.73441 -163.71112 297.49627
8215.0000 -166.15006 -163.66561 2.48445 1.72415 -163.87700 285.37806
8220.0000 -166.06744 -163.39412 2.67332 1.74343 -163.56537 306.50379
8225.0000 -166.16749 -163.65816 2.50934 1.72855 -163.80586 290.05817
8230.0000 -165.68438 -162.79167 2.89270 1.75812 -163.32782 315.57024
8235.0000 -165.79199 -162.92249 2.86950 1.79619 -162.71235 340.10167
8240.0000 -165.96527 -163.27687 2.68840 1.78702 -162.86066 341.37300
8245.0000 -165.78826 -162.70536 3.08290 1.77354 -163.07855 320.25252
8250.0000 -165.97080 -163.36646 2.60434 1.79369 -162.75281 328.36723
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 14 [min], 48.9104168 [s].
main_MD> Deallocating global variables
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