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nanoparticlesims/growth_Melting_Silver_ICO_2451/freezeSims/run_71/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_71.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 = 71 ntipo2 = 0
read_input> Finish reading input
main_MD> Allocating global variables
main_MD> Number of outputs that will be created: 1750
main_MD> Size of nv and nvoiz: 71 7100
main_MD> Size of nv and nvoiz: 71 7100
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 = 71
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> 5.4006990398590617E-002 -7.5114907628457211E-002 -0.13306788328283614 initial drift of cluster / NP1 for coalescence
init> 0.34702073541184003 0.35568886358688223 0.32358503550298695 scaling for velocity /for coalescence NP1
init.f90 > facguy = 3.6974725442979264E-003
preparo> IN BIGVOI : LIMIT 1.2247448652052084 1.2247448652052084 1.2247448652052084
preparo> END t=0 TIME STEP
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.19805 -1.07102 2.88772
force_rgl> df(natom) 3.46719 0.25720 -4.08811
preparo> THERMALIZATION PROCESS AT 1187.3673558085061
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -158.14120484082497 10.546307803776749 -168.68751264460172 6.3364756177586865E-004
preparo> END THERMALISATION ON NPAST DEFINE IN PARACLUSTER MODULE
main_MD> Time-loop is starting for freezing
main_MD> Now the computation of EXECUTION TIME starts
main_MD> Running from loop 1 to 35
FREEZING PROCESS: loop number 1 T-loop= 1161.0000000000000
main_MD> interactions number 1 at Temperature= 1161.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.45319 -0.61127 1.49207
force_rgl> df(natom) 0.69777 0.82662 0.76337
5.0000 -168.62172 -158.30851 10.31320 3.04964 -157.15977 1110.91976
10.0000 -168.80385 -159.34579 9.45806 2.97353 -158.46472 1078.03738
15.0000 -168.22892 -157.16988 11.05904 3.06894 -156.82888 1195.23128
20.0000 -167.17838 -156.46819 10.71019 3.05241 -157.11232 1146.32197
25.0000 -167.07650 -158.19778 8.87872 2.98893 -158.20075 1109.64173
30.0000 -167.53950 -157.90618 9.63333 3.01559 -157.74357 1133.04070
35.0000 -167.80417 -158.62567 9.17850 2.97028 -158.52049 1101.48371
40.0000 -167.96585 -157.93479 10.03107 2.95967 -158.70240 1075.38575
45.0000 -168.86096 -156.61808 12.24288 3.07801 -156.67337 1154.21466
50.0000 -167.17900 -156.62997 10.54903 3.12077 -155.94011 1186.42035
55.0000 -168.06336 -157.21737 10.84598 3.07341 -156.75224 1110.13849
60.0000 -165.35187 -155.11930 10.23257 3.13185 -155.75019 1222.88117
65.0000 -167.58061 -156.31034 11.27027 3.11278 -156.07715 1168.96625
70.0000 -164.59047 -153.25648 11.33399 3.17125 -155.07451 1224.87117
75.0000 -166.35880 -152.62945 13.72935 3.35234 -151.96955 1343.38423
80.0000 -164.02619 -152.78205 11.24414 3.26947 -153.39037 1248.94541
85.0000 -162.02603 -150.45529 11.57074 3.36203 -151.80337 1372.22977
90.0000 -165.80453 -153.74468 12.05985 3.36725 -151.71385 1324.67931
95.0000 -167.02338 -157.64607 9.37731 3.06722 -156.85839 1178.61813
100.0000 -165.92456 -155.03123 10.89333 3.06196 -156.94842 1110.61398
105.0000 -167.15135 -156.04347 11.10788 3.11164 -156.09667 1173.03754
110.0000 -167.27368 -156.40723 10.86645 3.08003 -156.63861 1158.04850
115.0000 -166.14896 -155.31520 10.83376 3.18123 -154.90340 1238.69887
120.0000 -167.30939 -156.68326 10.62613 3.14332 -155.55340 1206.61539
125.0000 -166.74658 -154.80064 11.94594 3.15929 -155.27958 1210.56169
130.0000 -165.37392 -154.36294 11.01098 3.15873 -155.28932 1203.31527
135.0000 -165.79944 -154.77129 11.02814 3.22797 -154.10202 1243.52921
140.0000 -165.97922 -154.70795 11.27128 3.17424 -155.02324 1248.80353
145.0000 -165.14794 -155.94718 9.20075 3.12957 -155.78923 1215.73481
150.0000 -166.78488 -155.62195 11.16292 3.08739 -156.51243 1150.93355
155.0000 -166.74737 -154.90325 11.84412 3.08546 -156.54561 1151.07013
160.0000 -169.25974 -157.95326 11.30648 3.07868 -156.66179 1156.18885
165.0000 -167.03956 -156.27806 10.76150 3.03501 -157.41054 1129.55153
170.0000 -167.43060 -155.98664 11.44397 3.12623 -155.84657 1250.73035
175.0000 -167.38787 -154.26889 13.11898 3.09068 -156.45614 1227.67677
180.0000 -167.60163 -156.42795 11.17368 3.11693 -156.00600 1207.80167
185.0000 -166.77035 -155.56332 11.20703 3.17709 -154.97436 1245.56986
190.0000 -166.43709 -155.27420 11.16289 3.11956 -155.96087 1203.70915
195.0000 -169.62098 -160.03907 9.58191 3.01589 -157.73844 1093.47638
200.0000 -167.12445 -157.71314 9.41130 3.00467 -157.93074 1128.22403
205.0000 -167.66173 -157.60648 10.05526 3.04363 -157.26274 1155.19073
210.0000 -165.90438 -156.07424 9.83014 3.10064 -156.28528 1161.58159
215.0000 -166.82117 -157.00221 9.81897 3.12187 -155.92126 1195.17537
220.0000 -166.06557 -155.83203 10.23353 3.07046 -156.80277 1177.09789
225.0000 -166.11960 -156.14214 9.97746 3.12546 -155.85977 1213.47677
230.0000 -166.78853 -155.31052 11.47801 3.09483 -156.38497 1178.93004
235.0000 -168.88188 -159.32617 9.55571 3.07873 -156.66088 1162.87864
240.0000 -170.68535 -160.08441 10.60094 2.98151 -158.32791 1070.54816
245.0000 -167.68283 -157.88295 9.79988 2.94052 -159.03083 1098.36457
250.0000 -167.15969 -157.09969 10.06000 3.06077 -156.96882 1146.82422
FREEZING PROCESS: loop number 2 T-loop= 1136.0000000000000
main_MD> interactions number 2 at Temperature= 1136.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.58568 -0.03736 -0.33088
force_rgl> df(natom) -0.60449 2.28470 1.32931
255.0000 -166.59345 -156.74041 9.85304 3.11156 -156.09810 1187.59501
260.0000 -166.27596 -154.35420 11.92176 3.14477 -155.52862 1220.28751
265.0000 -165.18201 -152.09365 13.08836 3.25744 -153.59664 1274.91954
270.0000 -166.83775 -155.70060 11.13715 3.15633 -155.33036 1208.24714
275.0000 -167.25798 -154.88958 12.36840 3.17757 -154.96622 1206.76346
280.0000 -165.77442 -154.58304 11.19138 3.18066 -154.91317 1213.00899
285.0000 -163.48590 -152.39380 11.09210 3.25087 -153.70934 1238.52507
290.0000 -164.02655 -154.70244 9.32412 3.26383 -153.48719 1240.24360
295.0000 -166.22019 -156.84263 9.37756 3.08125 -156.61776 1167.03373
300.0000 -166.01436 -154.49861 11.51575 3.08152 -156.61313 1194.84255
305.0000 -166.93764 -156.78496 10.15268 3.10681 -156.17955 1192.70285
310.0000 -166.70769 -156.66487 10.04282 3.13307 -155.72922 1209.00500
315.0000 -168.23651 -157.72182 10.51469 3.07431 -156.73674 1199.01403
320.0000 -166.46347 -154.87212 11.59134 3.12653 -155.84138 1228.39949
325.0000 -168.04342 -156.88373 11.15969 3.16018 -155.26435 1189.96105
330.0000 -167.70924 -157.08406 10.62518 3.04632 -157.21660 1124.69362
335.0000 -166.90372 -155.56781 11.33591 3.07296 -156.75994 1166.93625
340.0000 -165.98692 -155.00105 10.98587 3.14096 -155.59390 1221.45499
345.0000 -168.25206 -156.97756 11.27450 3.11410 -156.05453 1170.56493
350.0000 -167.40938 -157.03874 10.37063 3.05264 -157.10834 1145.51746
355.0000 -167.79470 -157.86319 9.93151 3.08479 -156.55702 1126.03503
360.0000 -169.21479 -157.80602 11.40877 2.96943 -158.53500 1112.08431
365.0000 -167.58950 -158.01293 9.57657 3.01301 -157.78774 1134.66010
370.0000 -167.62940 -157.67427 9.95513 2.98032 -158.34835 1092.09790
375.0000 -167.29499 -154.01405 13.28094 3.17026 -155.09149 1231.97529
380.0000 -168.48002 -158.36170 10.11832 3.08873 -156.48956 1163.76437
385.0000 -171.00111 -157.46979 13.53131 2.96470 -158.61622 1113.30801
390.0000 -167.61443 -156.62903 10.98540 3.05691 -157.03501 1180.11617
395.0000 -165.47888 -155.51057 9.96830 3.07411 -156.74021 1165.64547
400.0000 -168.40896 -157.41113 10.99782 3.09824 -156.32641 1167.79556
405.0000 -166.56932 -156.27435 10.29497 3.14318 -155.55585 1194.24669
410.0000 -167.58355 -158.15104 9.43251 3.00529 -157.92019 1091.66265
415.0000 -168.34639 -156.77941 11.56698 3.01583 -157.73953 1138.19279
420.0000 -166.25791 -154.44860 11.80931 3.08358 -156.57788 1164.24367
425.0000 -167.81607 -157.23191 10.58416 3.18613 -154.81937 1258.66439
430.0000 -168.88308 -156.95594 11.92713 3.07641 -156.70068 1154.94917
435.0000 -166.96397 -157.23891 9.72507 3.06746 -156.85418 1183.55221
440.0000 -164.12660 -153.70862 10.41798 3.10214 -156.25952 1180.00469
445.0000 -167.94096 -156.53160 11.40936 3.17543 -155.00295 1197.69952
450.0000 -168.57494 -158.30935 10.26559 3.01954 -157.67585 1144.18477
455.0000 -168.00264 -155.66611 12.33653 3.13842 -155.63752 1203.07708
460.0000 -168.03193 -158.58518 9.44675 3.06297 -156.93113 1175.31594
465.0000 -169.26807 -158.49000 10.77807 2.98612 -158.24893 1127.35126
470.0000 -166.27160 -156.01936 10.25224 3.02465 -157.58818 1117.64762
475.0000 -168.03020 -159.37590 8.65430 2.97962 -158.36033 1071.37810
480.0000 -168.47739 -158.74867 9.72873 3.02184 -157.63642 1127.94346
485.0000 -168.88017 -159.21552 9.66465 2.90586 -159.62511 1042.31640
490.0000 -168.97267 -159.13095 9.84172 2.96366 -158.63403 1096.00942
495.0000 -169.92736 -160.55586 9.37151 2.91830 -159.41169 1031.42629
500.0000 -170.03929 -160.04425 9.99504 2.88852 -159.92237 1031.18533
FREEZING PROCESS: loop number 3 T-loop= 1111.0000000000000
main_MD> interactions number 3 at Temperature= 1111.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.14629 3.94430 -6.05891
force_rgl> df(natom) 0.23531 1.08957 -0.59449
505.0000 -170.24043 -161.47230 8.76813 2.84240 -160.71312 1033.35027
510.0000 -169.70825 -161.60857 8.09968 2.82561 -161.00099 1026.13816
515.0000 -166.63407 -157.41366 9.22041 2.92512 -159.29476 1056.77543
520.0000 -166.61557 -156.80475 9.81083 2.97728 -158.40050 1086.02963
525.0000 -169.17561 -159.45770 9.71791 3.02723 -157.54403 1110.96767
530.0000 -167.10049 -157.28430 9.81620 2.97971 -158.35870 1095.31173
535.0000 -169.05566 -159.18039 9.87527 2.95224 -158.82985 1069.37503
540.0000 -170.39509 -160.63470 9.76039 2.90580 -159.62606 1059.99353
545.0000 -168.80704 -157.30649 11.50055 2.98077 -158.34056 1119.56840
550.0000 -170.91005 -161.04982 9.86023 2.97324 -158.46974 1107.24037
555.0000 -167.49793 -157.21770 10.28023 2.94127 -159.01782 1097.11000
560.0000 -168.11390 -156.96129 11.15261 3.07926 -156.65188 1161.30484
565.0000 -168.59284 -157.92524 10.66760 3.04880 -157.17406 1118.78272
570.0000 -167.41598 -156.32467 11.09131 3.05655 -157.04124 1174.32288
575.0000 -169.50337 -158.96157 10.54180 3.01407 -157.76969 1137.60605
580.0000 -168.89993 -158.59137 10.30856 2.94075 -159.02677 1108.97867
585.0000 -169.12193 -160.46646 8.65546 2.94659 -158.92669 1074.86679
590.0000 -167.18663 -158.34794 8.83869 2.91217 -159.51684 1074.83260
595.0000 -168.26583 -157.89661 10.36922 3.01390 -157.77264 1146.05525
600.0000 -168.63157 -158.08978 10.54179 2.99109 -158.16372 1117.20565
605.0000 -168.86411 -157.58875 11.27536 2.98917 -158.19655 1082.55789
610.0000 -169.30885 -159.29505 10.01379 2.93820 -159.07054 1073.48670
615.0000 -167.99534 -156.56026 11.43508 3.01427 -157.76629 1106.86693
620.0000 -167.37067 -158.37123 8.99944 3.04436 -157.25026 1140.95574
625.0000 -170.23054 -160.54389 9.68665 2.88028 -160.06359 998.02261
630.0000 -168.31208 -158.53586 9.77622 2.92619 -159.27651 1050.20794
635.0000 -169.63930 -160.48293 9.15637 2.91850 -159.40835 1052.89998
640.0000 -170.18329 -160.08982 10.09347 2.90422 -159.65313 1047.00697
645.0000 -169.23718 -158.43249 10.80469 2.90171 -159.69614 1052.64539
650.0000 -167.01705 -156.19324 10.82381 3.02150 -157.64228 1123.45529
655.0000 -167.24178 -155.63145 11.61033 3.09877 -156.31735 1156.76162
660.0000 -168.22855 -156.83120 11.39735 3.04958 -157.16079 1126.64475
665.0000 -167.30714 -153.73561 13.57153 3.06936 -156.82165 1136.32080
670.0000 -164.82983 -152.71558 12.11425 3.26541 -153.46006 1276.74758
675.0000 -168.20909 -157.61537 10.59371 3.18205 -154.88943 1266.48557
680.0000 -169.50510 -159.81756 9.68754 2.92966 -159.21688 1073.15774
685.0000 -169.19478 -159.16123 10.03355 2.90349 -159.66562 1067.98162
690.0000 -169.11812 -159.16955 9.94857 2.90335 -159.66801 1049.37346
695.0000 -168.06382 -158.53942 9.52440 2.91440 -159.47863 1056.12078
700.0000 -170.47171 -160.57607 9.89564 2.93092 -159.19529 1071.48756
705.0000 -168.96132 -159.31311 9.64821 2.93996 -159.04032 1099.72346
710.0000 -169.24395 -159.15840 10.08555 2.91163 -159.52604 1037.97064
715.0000 -167.02808 -155.88399 11.14409 3.02237 -157.62728 1117.45231
720.0000 -168.06037 -156.54761 11.51276 3.12533 -155.86195 1183.81007
725.0000 -166.80114 -155.64672 11.15441 3.09977 -156.30027 1173.42085
730.0000 -165.75054 -154.93026 10.82028 3.08147 -156.61390 1172.68806
735.0000 -168.01688 -156.40058 11.61630 3.10474 -156.21502 1196.30968
740.0000 -169.00942 -159.89034 9.11908 2.99967 -158.01663 1079.64003
745.0000 -168.12754 -158.12937 9.99817 2.93463 -159.13181 1092.61332
750.0000 -167.51378 -156.37780 11.13598 3.01595 -157.73748 1099.88826
FREEZING PROCESS: loop number 4 T-loop= 1086.0000000000000
main_MD> interactions number 4 at Temperature= 1086.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.70705 -5.79845 -5.76421
force_rgl> df(natom) 3.87332 6.23380 3.53383
755.0000 -168.90885 -159.04736 9.86149 2.99984 -158.01363 1100.45601
760.0000 -168.33437 -158.11620 10.21817 2.90723 -159.60160 1057.56994
765.0000 -167.16663 -157.44624 9.72038 3.02609 -157.56359 1124.28038
770.0000 -167.65170 -156.78600 10.86570 3.00647 -157.90000 1129.40271
775.0000 -168.29315 -158.15682 10.13633 3.05248 -157.11097 1179.57695
780.0000 -168.57646 -159.07833 9.49812 2.96709 -158.57522 1124.94983
785.0000 -168.70953 -160.04477 8.66476 2.90425 -159.65257 1031.92864
790.0000 -168.39734 -159.32470 9.07265 2.89998 -159.72594 1031.05936
795.0000 -168.49674 -157.48725 11.00949 2.95501 -158.78229 1068.94473
800.0000 -166.99315 -157.95654 9.03661 2.98929 -158.19451 1111.22874
805.0000 -167.51558 -156.57938 10.93619 3.08933 -156.47923 1163.26837
810.0000 -167.24443 -156.63958 10.60485 3.07158 -156.78349 1167.06988
815.0000 -164.88065 -156.18608 8.69457 3.04894 -157.17168 1120.24239
820.0000 -168.78345 -158.47739 10.30606 3.06973 -156.81526 1166.81683
825.0000 -168.04966 -158.39085 9.65881 3.01085 -157.82486 1094.41632
830.0000 -167.70159 -158.88418 8.81741 2.95854 -158.72181 1119.79704
835.0000 -169.31756 -157.95511 11.36244 2.98703 -158.23335 1129.52788
840.0000 -169.66713 -159.24137 10.42576 2.93852 -159.06504 1064.11881
845.0000 -169.26473 -159.36827 9.89646 2.95379 -158.80328 1088.63994
850.0000 -168.85162 -158.86571 9.98591 2.95399 -158.79982 1054.22358
855.0000 -168.79817 -157.66476 11.13341 3.01683 -157.72236 1122.18404
860.0000 -170.25042 -160.05271 10.19772 2.92494 -159.29795 1076.59818
865.0000 -170.06506 -159.39214 10.67292 2.92247 -159.34031 1063.07121
870.0000 -167.98775 -158.16095 9.82680 2.95173 -158.83854 1085.06963
875.0000 -168.59345 -158.19689 10.39655 2.94752 -158.91072 1071.17723
880.0000 -167.80683 -156.62711 11.17972 3.00201 -157.97649 1096.15814
885.0000 -168.71397 -156.67026 12.04371 3.09875 -156.31774 1199.55289
890.0000 -167.29164 -158.95226 8.33938 2.99575 -158.08379 1100.66852
895.0000 -170.16799 -159.90849 10.25950 2.97087 -158.51044 1123.15026
900.0000 -168.84590 -159.67552 9.17038 2.92776 -159.24952 1040.72333
905.0000 -170.13609 -162.06073 8.07535 2.82761 -160.96679 994.90274
910.0000 -170.41427 -159.31784 11.09643 2.90891 -159.57273 1024.52439
915.0000 -168.87071 -158.58757 10.28314 2.94156 -159.01299 1083.70330
920.0000 -168.62821 -159.10455 9.52366 2.92876 -159.23235 1070.23925
925.0000 -166.45216 -156.62626 9.82590 2.97518 -158.43651 1083.28884
930.0000 -169.05557 -158.03736 11.01821 3.09685 -156.35019 1147.00350
935.0000 -170.49955 -159.97373 10.52582 2.91554 -159.45899 1046.40211
940.0000 -169.60268 -160.99829 8.60439 2.86913 -160.25490 1028.75733
945.0000 -168.97059 -159.67525 9.29535 2.83891 -160.77295 990.64079
950.0000 -170.14943 -159.38247 10.76695 2.93090 -159.19578 1041.27003
955.0000 -169.81675 -158.82976 10.98699 2.91573 -159.45588 1033.14437
960.0000 -170.30256 -161.53769 8.76487 2.88911 -159.91222 1035.93690
965.0000 -167.89035 -159.25930 8.63105 2.83906 -160.77045 1011.02530
970.0000 -168.51329 -158.94533 9.56796 2.91497 -159.46881 1046.35884
975.0000 -169.21871 -159.12058 10.09813 2.92902 -159.22793 1038.23649
980.0000 -167.26018 -158.77893 8.48125 2.95584 -158.76802 1084.58374
985.0000 -169.70810 -160.88742 8.82068 2.90697 -159.60602 1067.17866
990.0000 -169.08733 -158.87636 10.21097 2.87671 -160.12490 1035.26906
995.0000 -170.26980 -160.97542 9.29438 2.88392 -160.00129 1044.56489
1000.0000 -169.38731 -160.73349 8.65382 2.83253 -160.88232 1019.36600
FREEZING PROCESS: loop number 5 T-loop= 1061.0000000000000
main_MD> interactions number 5 at Temperature= 1061.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.38811 -2.58015 -0.36665
force_rgl> df(natom) -4.37664 -3.30848 -1.30212
1005.0000 -170.63610 -161.79421 8.84189 2.81124 -161.24751 978.49091
1010.0000 -169.34587 -160.87880 8.46707 2.79158 -161.58449 930.73422
1015.0000 -170.13553 -160.43108 9.70444 2.84290 -160.70464 991.81493
1020.0000 -170.33183 -161.37618 8.95565 2.81935 -161.10839 999.66795
1025.0000 -170.26827 -159.28771 10.98056 2.87698 -160.12021 1030.88592
1030.0000 -170.22859 -160.42613 9.80245 2.87814 -160.10033 1025.40800
1035.0000 -168.01844 -160.13764 7.88080 2.84292 -160.70429 988.13954
1040.0000 -169.15232 -160.22968 8.92264 2.87335 -160.18251 984.64398
1045.0000 -168.39686 -159.05529 9.34157 2.93319 -159.15639 1057.70080
1050.0000 -169.54016 -159.57342 9.96673 2.90485 -159.64230 1051.61774
1055.0000 -170.78572 -160.99757 9.78815 2.86279 -160.36357 1010.22338
1060.0000 -167.34489 -158.35745 8.98744 2.92608 -159.27835 1059.46866
1065.0000 -168.13835 -159.08131 9.05704 2.98167 -158.32525 1110.57659
1070.0000 -168.92004 -159.87167 9.04837 2.93646 -159.10042 1085.49626
1075.0000 -169.42679 -158.88202 10.54477 2.92101 -159.36525 1042.54283
1080.0000 -167.30460 -158.29639 9.00821 3.00141 -157.98669 1090.42547
1085.0000 -168.31392 -158.96793 9.34599 2.96273 -158.64999 1035.57620
1090.0000 -168.80980 -159.09180 9.71801 2.94982 -158.87127 1067.78742
1095.0000 -169.42858 -158.90638 10.52220 2.98630 -158.24575 1090.79247
1100.0000 -168.27138 -159.60206 8.66932 2.87693 -160.12109 1016.97011
1105.0000 -169.76529 -161.39560 8.36969 2.88052 -160.05948 1043.92924
1110.0000 -167.38025 -157.10264 10.27761 2.95251 -158.82509 1083.97456
1115.0000 -168.92340 -157.77626 11.14714 2.98516 -158.26533 1092.19539
1120.0000 -169.98307 -160.51369 9.46937 2.91029 -159.54917 1053.52551
1125.0000 -170.83957 -160.01477 10.82480 2.80487 -161.35664 977.96684
1130.0000 -166.56129 -157.97302 8.58826 2.92254 -159.33897 1072.33752
1135.0000 -168.14746 -157.64370 10.50376 2.99883 -158.03103 1112.09053
1140.0000 -170.08085 -159.92573 10.15511 2.98327 -158.29770 1061.02042
1145.0000 -171.00118 -160.60195 10.39923 2.83033 -160.92003 989.40670
1150.0000 -170.91841 -162.17650 8.74191 2.82368 -161.03421 1007.13084
1155.0000 -167.65351 -159.77252 7.88100 2.82629 -160.98942 1022.34431
1160.0000 -171.12685 -162.31967 8.80718 2.83209 -160.89000 995.00787
1165.0000 -172.40076 -163.28115 9.11961 2.68829 -163.35556 921.14942
1170.0000 -172.18612 -162.54158 9.64454 2.72533 -162.72042 948.64480
1175.0000 -169.42079 -159.93152 9.48928 2.84568 -160.65685 1017.97537
1180.0000 -169.38444 -160.03650 9.34794 2.87325 -160.18416 1042.29518
1185.0000 -169.33420 -159.56444 9.76976 2.92331 -159.32593 1037.59977
1190.0000 -169.09391 -157.35563 11.73829 2.89371 -159.83338 1063.15271
1195.0000 -169.15226 -158.32300 10.82926 2.98987 -158.18464 1134.98166
1200.0000 -167.96534 -157.48920 10.47614 2.97704 -158.40465 1081.07892
1205.0000 -167.78347 -159.70894 8.07453 2.93453 -159.13346 1026.88850
1210.0000 -170.20009 -158.60541 11.59469 2.96204 -158.66177 1068.32081
1215.0000 -168.87035 -159.27181 9.59854 2.96764 -158.56579 1119.91875
1220.0000 -169.56116 -159.19871 10.36245 2.94405 -158.97031 1094.01291
1225.0000 -167.25757 -156.01147 11.24610 3.00825 -157.86940 1088.18447
1230.0000 -166.90537 -156.59857 10.30680 3.15076 -155.42590 1251.19764
1235.0000 -168.83281 -158.92960 9.90321 2.96904 -158.54167 1060.15405
1240.0000 -166.65021 -157.30008 9.35013 2.99219 -158.14488 1103.89576
1245.0000 -168.02604 -157.58663 10.43941 3.02481 -157.58542 1127.64611
1250.0000 -166.87169 -157.08836 9.78333 3.06668 -156.86749 1168.41082
FREEZING PROCESS: loop number 6 T-loop= 1036.0000000000000
main_MD> interactions number 6 at Temperature= 1036.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.91072 -0.01252 1.76155
force_rgl> df(natom) 1.96484 2.37706 -0.75912
1255.0000 -167.86346 -157.84081 10.02265 2.99675 -158.06661 1086.58803
1260.0000 -170.16492 -159.62404 10.54089 3.00775 -157.87808 1116.23220
1265.0000 -168.15163 -159.42568 8.72595 2.95936 -158.70765 1101.01384
1270.0000 -168.79551 -158.03462 10.76089 2.93204 -159.17607 1074.39803
1275.0000 -168.98743 -157.49576 11.49167 2.98790 -158.21833 1110.14828
1280.0000 -167.12611 -156.36064 10.76548 3.03560 -157.40045 1143.91546
1285.0000 -168.45535 -159.07399 9.38136 3.02705 -157.54707 1141.44718
1290.0000 -168.15623 -157.28476 10.87147 2.98632 -158.24551 1108.37782
1295.0000 -169.44784 -158.34535 11.10248 3.01479 -157.75737 1131.86893
1300.0000 -169.29325 -160.05610 9.23716 2.95692 -158.74955 1095.99546
1305.0000 -169.48630 -160.74683 8.73947 2.87912 -160.08349 1038.64964
1310.0000 -168.99249 -159.85179 9.14070 2.82439 -161.02199 1007.11887
1315.0000 -169.13953 -160.95396 8.18557 2.81916 -161.11167 1003.14474
1320.0000 -169.82903 -161.07096 8.75807 2.80695 -161.32099 982.32114
1325.0000 -171.43098 -162.71572 8.71526 2.80821 -161.29935 1005.23406
1330.0000 -170.21905 -160.84191 9.37715 2.77859 -161.80731 944.23333
1335.0000 -169.78188 -162.23711 7.54477 2.83688 -160.80785 997.97667
1340.0000 -167.71586 -159.38376 8.33209 2.87027 -160.23536 1009.45399
1345.0000 -169.88757 -162.27956 7.60801 2.87060 -160.22955 1023.14684
1350.0000 -170.35000 -159.81986 10.53014 2.82228 -161.05806 1014.71851
1355.0000 -169.36714 -160.30781 9.05934 2.93896 -159.05753 1049.67847
1360.0000 -168.45747 -160.08963 8.36784 2.89154 -159.87050 1071.99493
1365.0000 -170.69066 -162.39653 8.29413 2.78849 -161.63748 976.63884
1370.0000 -170.90348 -161.77689 9.12659 2.81571 -161.17083 1007.25523
1375.0000 -169.98749 -159.79957 10.18792 2.80611 -161.33539 1011.08753
1380.0000 -170.58228 -162.48188 8.10040 2.80496 -161.35505 1016.30372
1385.0000 -169.15029 -158.76015 10.39014 2.88604 -159.96488 1028.29968
1390.0000 -169.09977 -159.46738 9.63239 2.87536 -160.14804 985.07637
1395.0000 -169.50010 -159.92477 9.57532 2.92616 -159.27706 1054.39749
1400.0000 -169.29039 -158.42429 10.86609 2.97438 -158.45010 1089.66023
1405.0000 -168.74961 -158.46010 10.28951 2.95489 -158.78444 1094.35315
1410.0000 -169.69810 -161.04033 8.65777 2.86864 -160.26316 1033.86975
1415.0000 -169.00185 -159.17700 9.82486 2.80582 -161.34029 995.92380
1420.0000 -169.00838 -160.11395 8.89443 2.89944 -159.73508 1041.22138
1425.0000 -168.99396 -160.01358 8.98038 2.88876 -159.91825 1030.05978
1430.0000 -169.58504 -160.41426 9.17078 2.90516 -159.63709 1050.91505
1435.0000 -170.42419 -160.16445 10.25974 2.82197 -161.06347 1003.96569
1440.0000 -168.70830 -159.83255 8.87575 2.87754 -160.11059 1019.55983
1445.0000 -168.05036 -159.11007 8.94029 2.92447 -159.30602 1029.28927
1450.0000 -168.51490 -159.85662 8.65828 2.97936 -158.36483 1119.61785
1455.0000 -169.06267 -159.55701 9.50566 2.84544 -160.66105 1015.20418
1460.0000 -171.12385 -160.25645 10.86739 2.81066 -161.25746 1007.01169
1465.0000 -169.86129 -160.30634 9.55495 2.82299 -161.04592 1015.02817
1470.0000 -169.20467 -158.82956 10.37512 3.01495 -157.75448 1120.31732
1475.0000 -169.59509 -158.10003 11.49506 2.95839 -158.72428 1063.77553
1480.0000 -169.09117 -160.20676 8.88441 2.90565 -159.62872 1052.05094
1485.0000 -172.00392 -163.65508 8.34883 2.79520 -161.52244 976.56538
1490.0000 -169.65870 -158.39298 11.26572 2.83052 -160.91679 1012.02719
1495.0000 -169.31881 -160.02189 9.29692 2.93371 -159.14755 1044.57957
1500.0000 -169.09606 -160.44248 8.65358 2.82584 -160.99716 1001.50450
FREEZING PROCESS: loop number 7 T-loop= 1011.0000000000000
main_MD> interactions number 7 at Temperature= 1011.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.48885 1.06392 -0.69067
force_rgl> df(natom) 0.57745 1.23284 2.79124
1505.0000 -169.83967 -161.75285 8.08682 2.82280 -161.04929 997.20676
1510.0000 -172.67890 -163.11597 9.56293 2.70027 -163.15023 922.88875
1515.0000 -170.02934 -160.31239 9.71695 2.80995 -161.26955 995.99854
1520.0000 -171.57383 -162.16692 9.40692 2.80195 -161.40676 1000.81025
1525.0000 -171.47175 -161.91153 9.56022 2.75091 -162.28190 967.14861
1530.0000 -171.91762 -163.90873 8.00888 2.73534 -162.54881 962.37487
1535.0000 -171.26820 -162.00025 9.26795 2.78066 -161.77173 969.79215
1540.0000 -169.24000 -160.64178 8.59822 2.82154 -161.07088 1003.88663
1545.0000 -169.36618 -160.25193 9.11425 2.82928 -160.93810 1001.65145
1550.0000 -168.58395 -159.57806 9.00589 2.86823 -160.27030 1045.10909
1555.0000 -171.43181 -162.77299 8.65882 2.82374 -161.03302 1016.12699
1560.0000 -169.40677 -161.35803 8.04874 2.77117 -161.93455 964.43560
1565.0000 -170.66976 -160.20228 10.46748 2.82825 -160.95579 1008.17339
1570.0000 -167.24026 -157.99107 9.24919 2.90859 -159.57820 1065.68308
1575.0000 -166.86556 -158.21177 8.65379 2.99758 -158.05237 1154.20859
1580.0000 -170.11213 -159.39649 10.71564 3.03630 -157.38849 1158.50564
1585.0000 -170.09384 -161.24440 8.84944 2.86727 -160.28674 1045.08525
1590.0000 -171.45915 -162.29885 9.16031 2.77668 -161.83997 977.79792
1595.0000 -169.43145 -159.45611 9.97535 2.86866 -160.26287 1013.30227
1600.0000 -170.77233 -160.41199 10.36035 2.79443 -161.53563 979.35387
1605.0000 -171.26564 -161.75177 9.51387 2.80824 -161.29893 976.68951
1610.0000 -171.38242 -162.17177 9.21065 2.79199 -161.57743 943.32117
1615.0000 -169.69560 -161.53115 8.16445 2.77374 -161.89046 967.19634
1620.0000 -171.70764 -161.72620 9.98144 2.75996 -162.12662 957.55675
1625.0000 -169.47293 -160.68913 8.78380 2.77716 -161.83185 957.08433
1630.0000 -170.74077 -161.88565 8.85512 2.80879 -161.28953 982.09564
1635.0000 -170.43959 -162.10827 8.33132 2.74735 -162.34286 936.79375
1640.0000 -171.37236 -162.68261 8.68976 2.73276 -162.59314 938.95937
1645.0000 -169.04345 -159.73346 9.30999 2.77789 -161.81919 968.23567
1650.0000 -169.25553 -159.60406 9.65148 2.91664 -159.44024 1089.49374
1655.0000 -168.92389 -157.67979 11.24410 2.92669 -159.26791 1049.08215
1660.0000 -169.84889 -159.48317 10.36572 2.99057 -158.17265 1120.74934
1665.0000 -168.43432 -159.07319 9.36112 2.89528 -159.80639 1026.60762
1670.0000 -169.58506 -158.52674 11.05832 3.00515 -157.92261 1146.05932
1675.0000 -169.00331 -159.05175 9.95156 2.95941 -158.70679 1101.15347
1680.0000 -166.31824 -155.50722 10.81102 3.07372 -156.74690 1151.17487
1685.0000 -168.95343 -158.39739 10.55604 3.07127 -156.78885 1169.29570
1690.0000 -169.67175 -161.44558 8.22618 2.90246 -159.68341 1016.35190
1695.0000 -167.18451 -158.84558 8.33893 2.82522 -161.00772 980.21120
1700.0000 -168.77555 -159.84087 8.93469 2.93376 -159.14658 1087.28428
1705.0000 -170.43372 -160.40321 10.03051 2.86774 -160.27869 1054.72145
1710.0000 -167.65506 -158.57038 9.08468 2.90338 -159.66755 1055.76267
1715.0000 -170.94877 -162.00359 8.94517 2.88416 -159.99705 1028.22594
1720.0000 -169.24632 -160.96880 8.27752 2.81675 -161.15299 990.73247
1725.0000 -168.87844 -158.96709 9.91135 2.82365 -161.03460 997.21582
1730.0000 -168.44831 -159.51439 8.93392 2.90078 -159.71210 1019.86564
1735.0000 -171.13986 -161.67759 9.46227 2.92447 -159.30595 1036.85098
1740.0000 -171.05843 -161.52411 9.53432 2.81954 -161.10504 962.00156
1745.0000 -169.62853 -160.06088 9.56765 2.88076 -160.05550 995.81495
1750.0000 -169.54951 -161.62208 7.92743 2.85897 -160.42907 1040.43039
FREEZING PROCESS: loop number 8 T-loop= 986.00000000000000
main_MD> interactions number 8 at Temperature= 986.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.48832 0.08263 0.24027
force_rgl> df(natom) -2.93936 1.55894 -1.34500
1755.0000 -169.75062 -161.71498 8.03564 2.78733 -161.65745 968.16482
1760.0000 -170.48240 -160.84783 9.63456 2.81767 -161.13715 1004.40178
1765.0000 -170.14818 -162.78553 7.36265 2.78568 -161.68566 961.92620
1770.0000 -170.26212 -161.37602 8.88610 2.78231 -161.74353 919.14807
1775.0000 -169.23038 -160.47838 8.75200 2.81524 -161.17891 964.83395
1780.0000 -169.73870 -161.31956 8.41915 2.84794 -160.61809 981.57140
1785.0000 -170.46858 -161.16731 9.30127 2.75626 -162.19011 968.24072
1790.0000 -170.54850 -162.44794 8.10056 2.78226 -161.74440 1003.34124
1795.0000 -170.69533 -161.39063 9.30470 2.84201 -160.71984 983.01652
1800.0000 -169.65868 -161.93339 7.72529 2.77402 -161.88562 938.48341
1805.0000 -171.29529 -163.31298 7.98231 2.68315 -163.44378 870.57057
1810.0000 -170.84674 -162.15656 8.69018 2.81943 -161.10696 962.14822
1815.0000 -169.71590 -161.10221 8.61369 2.77872 -161.80498 944.14470
1820.0000 -170.14688 -161.25664 8.89024 2.75920 -162.13973 910.56835
1825.0000 -170.82617 -162.22516 8.60102 2.76525 -162.03593 940.11310
1830.0000 -169.12413 -160.17645 8.94768 2.85540 -160.49021 976.58111
1835.0000 -170.10626 -159.52806 10.57821 2.89289 -159.84736 1038.80949
1840.0000 -169.45038 -160.60749 8.84289 2.86180 -160.38053 1013.39091
1845.0000 -168.84735 -158.30004 10.54732 2.90803 -159.58777 1026.14259
1850.0000 -170.64977 -160.01227 10.63750 2.93915 -159.05416 1080.88708
1855.0000 -169.23462 -159.94863 9.28599 2.86788 -160.27634 1027.98378
1860.0000 -168.15293 -160.65636 7.49656 2.90167 -159.69685 1040.97844
1865.0000 -169.21110 -159.62850 9.58260 2.83996 -160.75495 1011.00460
1870.0000 -168.82234 -157.82656 10.99577 2.97023 -158.52130 1093.54146
1875.0000 -170.78458 -161.64923 9.13534 2.85338 -160.52494 1037.73993
1880.0000 -171.30506 -162.48345 8.82161 2.79453 -161.53395 994.13705
1885.0000 -171.77463 -162.43870 9.33593 2.70348 -163.09510 896.88204
1890.0000 -169.92368 -161.66905 8.25463 2.82725 -160.97290 991.43971
1895.0000 -170.71826 -161.47463 9.24363 2.74344 -162.41002 946.25737
1900.0000 -169.77744 -159.86728 9.91016 2.84866 -160.60577 977.19535
1905.0000 -171.20236 -161.21637 9.98598 2.78870 -161.63389 979.97842
1910.0000 -170.66063 -160.47436 10.18626 2.80924 -161.28177 998.08215
1915.0000 -169.90173 -159.81284 10.08889 2.90096 -159.70906 1049.55261
1920.0000 -169.74890 -160.83501 8.91389 2.87296 -160.18921 1018.77607
1925.0000 -168.93927 -160.10410 8.83517 2.88224 -160.02998 1012.77345
1930.0000 -167.82951 -157.44599 10.38352 2.89019 -159.89374 1057.12611
1935.0000 -169.22127 -159.77039 9.45088 2.98718 -158.23067 1116.89204
1940.0000 -168.64590 -160.18422 8.46167 2.88586 -159.96796 1040.09845
1945.0000 -171.11808 -161.15751 9.96058 2.84161 -160.72664 1022.44926
1950.0000 -170.66801 -161.65846 9.00955 2.83043 -160.91843 1034.67508
1955.0000 -170.67310 -160.03799 10.63511 2.84437 -160.67936 1023.60099
1960.0000 -170.98214 -160.33600 10.64614 2.85689 -160.46475 1015.36061
1965.0000 -172.40111 -163.41102 8.99009 2.79832 -161.46888 1004.41200
1970.0000 -171.10253 -161.14589 9.95665 2.81803 -161.13103 964.12342
1975.0000 -169.26946 -160.30227 8.96719 2.83617 -160.81990 983.93292
1980.0000 -168.10154 -158.29881 9.80272 2.96951 -158.53374 1053.42579
1985.0000 -170.41688 -161.65909 8.75779 2.91422 -159.48178 1023.14525
1990.0000 -169.52520 -160.92230 8.60290 2.78027 -161.77851 969.01893
1995.0000 -169.74749 -158.93215 10.81534 2.91408 -159.48403 1038.35745
2000.0000 -168.07580 -158.13380 9.94200 2.96031 -158.69147 1060.59967
FREEZING PROCESS: loop number 9 T-loop= 961.00000000000000
main_MD> interactions number 9 at Temperature= 961.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -4.09651 1.62933 -1.31177
force_rgl> df(natom) 5.35269 1.55623 -4.42224
2005.0000 -169.51357 -160.61561 8.89796 2.92179 -159.35194 1060.08556
2010.0000 -169.46770 -160.88286 8.58484 2.83026 -160.92123 1000.02500
2015.0000 -170.53034 -161.37639 9.15396 2.82824 -160.95597 992.96709
2020.0000 -171.05077 -161.26615 9.78462 2.77064 -161.94366 961.20291
2025.0000 -169.43928 -160.74491 8.69438 2.80061 -161.42973 978.63364
2030.0000 -170.17532 -161.18195 8.99337 2.85961 -160.41803 1009.54702
2035.0000 -169.47479 -160.95788 8.51691 2.78980 -161.61509 982.10017
2040.0000 -169.98176 -163.21318 6.76858 2.74102 -162.45153 938.78602
2045.0000 -172.38292 -164.63394 7.74898 2.64998 -164.01240 876.64439
2050.0000 -171.81235 -163.97607 7.83628 2.63427 -164.28185 882.07750
2055.0000 -170.44031 -162.27653 8.16378 2.71381 -162.91799 940.75147
2060.0000 -171.38403 -162.59445 8.78958 2.77735 -161.82855 992.69397
2065.0000 -167.75958 -158.91601 8.84356 2.79807 -161.47328 995.50386
2070.0000 -170.99735 -161.50669 9.49066 2.84556 -160.65891 992.13503
2075.0000 -170.88748 -162.15456 8.73292 2.77922 -161.79654 955.35458
2080.0000 -170.06437 -160.19621 9.86816 2.80116 -161.42019 966.82849
2085.0000 -171.31717 -161.84200 9.47517 2.79592 -161.51006 969.82116
2090.0000 -171.31547 -161.28048 10.03499 2.80183 -161.40875 988.07559
2095.0000 -170.15442 -160.76113 9.39330 2.78297 -161.73221 928.02986
2100.0000 -169.72595 -161.12631 8.59965 2.83913 -160.76922 1004.31400
2105.0000 -169.14861 -160.79859 8.35002 2.83325 -160.87012 947.49355
2110.0000 -171.84925 -162.28338 9.56587 2.79328 -161.55544 945.30014
2115.0000 -172.76902 -163.33203 9.43699 2.73383 -162.57472 933.39364
2120.0000 -170.98623 -160.72457 10.26166 2.75092 -162.28177 947.99212
2125.0000 -170.99544 -162.67030 8.32513 2.77098 -161.93782 976.01607
2130.0000 -171.51212 -162.52388 8.98824 2.71884 -162.83177 925.41539
2135.0000 -172.03988 -163.91637 8.12351 2.70930 -162.99526 933.38413
2140.0000 -172.64202 -164.39389 8.24814 2.64415 -164.11246 877.54241
2145.0000 -169.86164 -160.96424 8.89740 2.72968 -162.64590 937.48624
2150.0000 -169.86329 -160.05663 9.80665 2.88319 -160.01374 1009.80018
2155.0000 -169.58084 -160.48123 9.09961 2.86677 -160.29524 1031.68945
2160.0000 -170.08114 -161.53053 8.55060 2.83385 -160.85979 1013.60998
2165.0000 -170.73059 -161.69014 9.04045 2.78324 -161.72756 984.74858
2170.0000 -172.71189 -162.17701 10.53487 2.81501 -161.18286 989.17912
2175.0000 -172.93779 -163.98940 8.94838 2.69962 -163.16124 904.89909
2180.0000 -171.04848 -162.16385 8.88463 2.68228 -163.45862 910.66333
2185.0000 -171.30486 -162.92206 8.38280 2.72867 -162.66322 952.34645
2190.0000 -172.05523 -164.48487 7.57036 2.67097 -163.65264 879.86214
2195.0000 -171.85492 -164.06403 7.79090 2.62980 -164.35849 856.41645
2200.0000 -171.62642 -163.32226 8.30416 2.67362 -163.60717 889.41856
2205.0000 -172.86460 -164.32912 8.53548 2.68425 -163.42487 920.85776
2210.0000 -172.25312 -162.65987 9.59325 2.66857 -163.69379 867.97687
2215.0000 -170.14438 -163.28969 6.85470 2.72619 -162.70568 933.53568
2220.0000 -170.60946 -162.79589 7.81357 2.69910 -163.17019 920.73271
2225.0000 -171.72975 -161.31586 10.41389 2.75927 -162.13856 959.28160
2230.0000 -171.27848 -161.10709 10.17140 2.75504 -162.21114 946.04557
2235.0000 -168.59102 -158.26473 10.32629 2.88765 -159.93723 1040.66630
2240.0000 -168.75525 -160.55819 8.19706 2.91442 -159.47834 1052.94612
2245.0000 -173.16848 -163.82409 9.34439 2.77850 -161.80875 975.88582
2250.0000 -170.61145 -161.92552 8.68593 2.75660 -162.18429 963.87959
FREEZING PROCESS: loop number 10 T-loop= 936.00000000000000
main_MD> interactions number 10 at Temperature= 936.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.37142 6.35619 7.39239
force_rgl> df(natom) 2.93327 0.11741 -1.62698
2255.0000 -171.35072 -164.21504 7.13568 2.65552 -163.91750 901.06253
2260.0000 -171.34631 -161.89755 9.44876 2.69101 -163.30893 902.79862
2265.0000 -172.22282 -163.61570 8.60712 2.77319 -161.89978 944.33724
2270.0000 -169.63720 -162.22860 7.40861 2.72063 -162.80101 922.62902
2275.0000 -169.78861 -161.78826 8.00035 2.71581 -162.88366 908.27293
2280.0000 -172.88928 -165.11781 7.77147 2.64952 -164.02031 878.82161
2285.0000 -173.52804 -167.23728 6.29075 2.51415 -166.34148 817.69396
2290.0000 -172.38813 -164.80021 7.58792 2.58862 -165.06457 839.47063
2295.0000 -172.68993 -165.24622 7.44371 2.62861 -164.37880 866.67878
2300.0000 -173.15409 -164.97145 8.18264 2.61520 -164.60873 857.12122
2305.0000 -170.61865 -162.73575 7.88290 2.63379 -164.29012 889.93105
2310.0000 -170.10715 -160.99577 9.11138 2.74429 -162.39535 908.75836
2315.0000 -170.22582 -162.76829 7.45753 2.80248 -161.39766 966.47219
2320.0000 -171.73531 -163.92671 7.80860 2.72651 -162.70031 930.94512
2325.0000 -170.40613 -161.47685 8.92928 2.73685 -162.52297 936.18730
2330.0000 -172.50523 -162.59817 9.90706 2.75904 -162.14248 963.20377
2335.0000 -172.30901 -164.37633 7.93268 2.74292 -162.41879 966.42877
2340.0000 -172.40583 -164.00907 8.39676 2.63175 -164.32507 880.69958
2345.0000 -172.49481 -164.45061 8.04420 2.60664 -164.75554 838.51169
2350.0000 -171.44258 -161.70923 9.73335 2.72456 -162.73365 922.23846
2355.0000 -169.26849 -160.19535 9.07313 2.81338 -161.21081 972.01623
2360.0000 -170.61374 -161.61454 8.99920 2.81250 -161.22583 973.66001
2365.0000 -170.08455 -160.94248 9.14207 2.79034 -161.60582 977.45040
2370.0000 -171.24784 -161.20615 10.04169 2.80175 -161.41008 952.40408
2375.0000 -171.31009 -162.39513 8.91496 2.80236 -161.39968 990.00514
2380.0000 -170.25920 -161.84203 8.41717 2.77545 -161.86118 978.17292
2385.0000 -172.20253 -161.83348 10.36905 2.76711 -162.00415 982.61727
2390.0000 -171.02047 -161.89318 9.12729 2.79122 -161.59064 982.28570
2395.0000 -172.00636 -163.37143 8.63494 2.76384 -162.06017 954.72563
2400.0000 -171.09325 -162.94828 8.14497 2.69702 -163.20591 915.61912
2405.0000 -170.70964 -162.45856 8.25108 2.70542 -163.06178 904.04666
2410.0000 -168.93612 -160.42077 8.51535 2.76214 -162.08933 948.13906
2415.0000 -171.03670 -162.55787 8.47883 2.78462 -161.70390 959.25670
2420.0000 -171.95872 -162.85947 9.09925 2.73469 -162.55997 940.06472
2425.0000 -172.01387 -164.30912 7.70475 2.69163 -163.29825 915.36652
2430.0000 -171.48881 -163.94049 7.54833 2.64744 -164.05607 898.96448
2435.0000 -171.70270 -164.09836 7.60434 2.59795 -164.90467 860.64062
2440.0000 -171.07730 -162.11960 8.95770 2.72869 -162.66279 910.23575
2445.0000 -169.39799 -161.64210 7.75588 2.84528 -160.66382 1025.89274
2450.0000 -169.12449 -160.26036 8.86413 2.88432 -159.99443 1016.45335
2455.0000 -171.09425 -162.52282 8.57143 2.78684 -161.66585 969.08765
2460.0000 -170.84021 -163.40181 7.43840 2.72809 -162.67309 933.49449
2465.0000 -172.19750 -163.59293 8.60457 2.71324 -162.92782 937.71185
2470.0000 -170.91525 -162.56103 8.35422 2.67646 -163.55834 900.22308
2475.0000 -172.22013 -164.01985 8.20028 2.66777 -163.70741 901.24909
2480.0000 -171.81079 -164.04622 7.76457 2.66466 -163.76074 905.38850
2485.0000 -172.08415 -162.30502 9.77913 2.68866 -163.34927 923.88153
2490.0000 -171.57548 -162.59220 8.98328 2.78739 -161.65634 1003.15217
2495.0000 -170.60185 -162.41296 8.18889 2.70555 -163.05972 922.23295
2500.0000 -171.20452 -162.49578 8.70875 2.74504 -162.38255 955.64139
FREEZING PROCESS: loop number 11 T-loop= 911.00000000000000
main_MD> interactions number 11 at Temperature= 911.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.47657 -5.81335 1.05867
force_rgl> df(natom) 2.52050 -0.32698 0.48327
2505.0000 -171.26529 -163.51467 7.75062 2.70226 -163.11605 922.17904
2510.0000 -174.04495 -165.53520 8.50975 2.66272 -163.79393 907.88581
2515.0000 -174.83657 -167.16132 7.67525 2.51643 -166.30240 822.23325
2520.0000 -172.93030 -164.80898 8.12132 2.53181 -166.03861 811.55410
2525.0000 -172.31432 -164.31195 8.00237 2.64827 -164.04178 895.71918
2530.0000 -169.20991 -159.14764 10.06227 2.73940 -162.47929 926.30287
2535.0000 -170.27986 -162.17527 8.10459 2.84983 -160.58571 1015.91108
2540.0000 -170.42343 -160.50456 9.91888 2.81712 -161.14658 977.75750
2545.0000 -170.86603 -162.10161 8.76442 2.76127 -162.10422 940.12084
2550.0000 -171.02335 -162.32020 8.70315 2.77011 -161.95272 939.93179
2555.0000 -172.34784 -164.30306 8.04479 2.71566 -162.88634 947.55349
2560.0000 -172.79603 -164.52853 8.26750 2.63035 -164.34906 878.02463
2565.0000 -172.22177 -164.00489 8.21688 2.61705 -164.57717 861.25385
2570.0000 -174.10755 -165.20903 8.89852 2.61065 -164.68691 864.15395
2575.0000 -173.36075 -165.00143 8.35932 2.59635 -164.93207 826.77122
2580.0000 -171.82892 -163.58947 8.23945 2.65023 -164.00810 872.10385
2585.0000 -172.68101 -166.03399 6.64702 2.62330 -164.47000 849.33175
2590.0000 -171.95377 -164.49302 7.46075 2.57444 -165.30778 808.26585
2595.0000 -172.19858 -163.91229 8.28629 2.60406 -164.79988 870.74359
2600.0000 -171.72702 -163.41026 8.31676 2.72686 -162.69418 921.46887
2605.0000 -171.46295 -163.62902 7.83393 2.63490 -164.27096 860.85229
2610.0000 -172.49485 -163.39404 9.10081 2.66524 -163.75075 893.17102
2615.0000 -172.48454 -164.65127 7.83326 2.62071 -164.51425 876.21253
2620.0000 -172.73700 -165.05289 7.68411 2.59962 -164.87590 865.70057
2625.0000 -172.29328 -163.88717 8.40611 2.63195 -164.32162 885.35693
2630.0000 -170.51828 -163.24599 7.27229 2.65019 -164.00881 884.92358
2635.0000 -171.21027 -164.13944 7.07083 2.64863 -164.03561 864.27412
2640.0000 -172.77837 -165.49991 7.27846 2.67646 -163.55842 910.23230
2645.0000 -171.79224 -162.77213 9.02011 2.65219 -163.97458 872.96512
2650.0000 -171.83882 -162.82013 9.01869 2.76655 -162.01365 957.44279
2655.0000 -171.97640 -164.24122 7.73518 2.67132 -163.64654 873.48486
2660.0000 -172.42699 -164.64038 7.78661 2.64064 -164.17256 862.08492
2665.0000 -172.00299 -164.07207 7.93093 2.67373 -163.60525 893.21067
2670.0000 -171.72778 -164.23197 7.49580 2.64712 -164.06153 898.74605
2675.0000 -172.36013 -164.04146 8.31867 2.61117 -164.67790 873.41498
2680.0000 -171.94919 -163.26981 8.67937 2.66990 -163.67090 908.05653
2685.0000 -171.53165 -163.26320 8.26846 2.71877 -162.83288 899.32968
2690.0000 -171.78563 -164.11987 7.66575 2.62966 -164.36095 874.19299
2695.0000 -174.33337 -165.82672 8.50665 2.62872 -164.37704 865.45247
2700.0000 -172.38318 -163.16224 9.22094 2.64305 -164.13132 884.10194
2705.0000 -171.12176 -161.14164 9.98012 2.72731 -162.68657 933.98800
2710.0000 -170.63117 -162.16459 8.46657 2.82358 -161.03579 980.27366
2715.0000 -169.80960 -160.04233 9.76727 2.85727 -160.45825 999.83806
2720.0000 -171.17886 -161.70142 9.47745 2.84070 -160.74237 988.14170
2725.0000 -169.75341 -161.61078 8.14263 2.74838 -162.32527 930.05616
2730.0000 -169.51143 -160.96902 8.54241 2.78755 -161.65361 957.21637
2735.0000 -170.05746 -160.93459 9.12287 2.84636 -160.64519 1012.44640
2740.0000 -170.89245 -161.82821 9.06424 2.79489 -161.52776 984.33380
2745.0000 -168.68516 -160.03663 8.64853 2.81705 -161.14783 976.20929
2750.0000 -171.78286 -163.08676 8.69611 2.74514 -162.38078 950.07687
FREEZING PROCESS: loop number 12 T-loop= 886.00000000000000
main_MD> interactions number 12 at Temperature= 886.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.78622 0.43295 -2.17723
force_rgl> df(natom) -1.66408 0.11495 -4.02609
2755.0000 -170.86536 -163.67594 7.18943 2.77245 -161.91259 918.09435
2760.0000 -172.51435 -165.24164 7.27271 2.61391 -164.63087 832.62234
2765.0000 -172.83653 -165.36843 7.46809 2.57848 -165.23844 854.71080
2770.0000 -170.85580 -162.83306 8.02274 2.59284 -164.99226 816.29122
2775.0000 -169.15809 -160.07107 9.08703 2.81651 -161.15707 980.33808
2780.0000 -170.11638 -162.13234 7.98404 2.80568 -161.34276 972.48574
2785.0000 -171.87687 -162.93679 8.94008 2.71457 -162.90505 901.56677
2790.0000 -170.64308 -161.95532 8.68776 2.74708 -162.34763 926.28508
2795.0000 -170.23886 -162.08070 8.15817 2.75636 -162.18847 947.60479
2800.0000 -171.71999 -163.78698 7.93301 2.67504 -163.58285 887.69857
2805.0000 -172.59973 -164.81874 7.78099 2.62501 -164.44052 852.48956
2810.0000 -170.86526 -162.33870 8.52656 2.60430 -164.79577 873.23856
2815.0000 -171.67719 -163.47743 8.19976 2.73007 -162.63920 933.93787
2820.0000 -171.58177 -163.66989 7.91188 2.65607 -163.90809 885.47237
2825.0000 -171.78943 -164.12622 7.66321 2.66900 -163.68639 884.77247
2830.0000 -173.48221 -164.72599 8.75622 2.64109 -164.16497 860.75842
2835.0000 -173.59567 -166.30980 7.28586 2.59252 -164.99775 848.32631
2840.0000 -171.87012 -164.15151 7.71861 2.54150 -165.87252 812.43475
2845.0000 -171.19378 -162.90712 8.28667 2.65936 -163.85165 897.43543
2850.0000 -171.20574 -162.50640 8.69934 2.77167 -161.92592 983.78949
2855.0000 -173.41967 -164.50039 8.91928 2.62441 -164.45090 870.22515
2860.0000 -173.88135 -166.46156 7.41980 2.54388 -165.83175 845.65987
2865.0000 -171.65399 -163.34621 8.30777 2.61123 -164.67688 837.31043
2870.0000 -172.59948 -164.70409 7.89540 2.64731 -164.05826 878.09264
2875.0000 -170.28905 -163.70141 6.58764 2.60178 -164.83883 844.70755
2880.0000 -172.64188 -163.99935 8.64252 2.65272 -163.96556 883.99862
2885.0000 -172.33716 -163.40515 8.93201 2.65962 -163.84709 886.51341
2890.0000 -172.25698 -164.06619 8.19078 2.67998 -163.49804 870.41789
2895.0000 -171.21417 -162.94824 8.26593 2.71755 -162.85381 917.80101
2900.0000 -173.22775 -165.38164 7.84611 2.64463 -164.10416 855.43976
2905.0000 -173.20193 -165.70917 7.49276 2.60323 -164.81398 847.76769
2910.0000 -172.57569 -165.78223 6.79346 2.55103 -165.70903 793.54224
2915.0000 -172.22125 -165.33526 6.88599 2.55454 -165.64888 815.20173
2920.0000 -170.80873 -162.97637 7.83236 2.63060 -164.34481 854.25448
2925.0000 -171.65829 -161.82710 9.83119 2.77528 -161.86403 943.87583
2930.0000 -170.01389 -162.56267 7.45121 2.75708 -162.17605 957.64866
2935.0000 -172.07471 -163.37978 8.69493 2.74784 -162.33454 931.27233
2940.0000 -169.97429 -161.73231 8.24199 2.72878 -162.66128 954.54284
2945.0000 -171.93800 -163.45904 8.47896 2.78627 -161.67551 993.13486
2950.0000 -172.02089 -164.39501 7.62588 2.68672 -163.38247 905.32541
2955.0000 -173.23361 -166.01314 7.22047 2.56631 -165.44707 853.64593
2960.0000 -173.54080 -165.19658 8.34422 2.59037 -165.03447 855.51477
2965.0000 -172.82510 -164.69464 8.13046 2.61999 -164.52661 858.12715
2970.0000 -173.01140 -164.30582 8.70558 2.62041 -164.51939 874.73786
2975.0000 -172.26104 -165.09833 7.16271 2.59768 -164.90919 856.97796
2980.0000 -173.59768 -165.00137 8.59631 2.57334 -165.32654 825.32146
2985.0000 -172.28805 -164.73000 7.55805 2.66472 -163.75968 891.26945
2990.0000 -171.69011 -163.50281 8.18730 2.62624 -164.41951 897.10488
2995.0000 -172.03674 -164.59482 7.44192 2.61905 -164.54272 896.93079
3000.0000 -172.30143 -164.26003 8.04139 2.59779 -164.90735 872.88032
FREEZING PROCESS: loop number 13 T-loop= 861.00000000000000
main_MD> interactions number 13 at Temperature= 861.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.97459 0.23414 1.31747
force_rgl> df(natom) 2.36783 0.06627 1.55715
3005.0000 -171.75955 -163.54517 8.21438 2.64858 -164.03640 867.82721
3010.0000 -172.58226 -164.22540 8.35686 2.64175 -164.15349 857.77623
3015.0000 -173.31125 -165.28878 8.02247 2.60613 -164.76426 859.67669
3020.0000 -173.05941 -163.87140 9.18801 2.60748 -164.74115 858.95027
3025.0000 -171.24246 -163.00262 8.23983 2.72116 -162.79194 916.13013
3030.0000 -171.77194 -164.41131 7.36062 2.66367 -163.77769 872.03369
3035.0000 -172.90935 -164.30675 8.60261 2.61026 -164.69353 869.64318
3040.0000 -171.25274 -164.04855 7.20419 2.65633 -163.90358 906.02107
3045.0000 -171.60448 -163.64513 7.95934 2.66066 -163.82936 897.20032
3050.0000 -173.01418 -165.65628 7.35789 2.59582 -164.94116 846.91179
3055.0000 -171.56835 -165.01545 6.55291 2.55628 -165.61913 818.89658
3060.0000 -170.71127 -163.22557 7.48569 2.59283 -164.99233 852.67231
3065.0000 -171.76370 -164.23866 7.52504 2.67573 -163.57091 903.06082
3070.0000 -171.66615 -165.03170 6.63445 2.60049 -164.86111 865.54083
3075.0000 -174.18551 -167.13024 7.05528 2.53203 -166.03482 798.69769
3080.0000 -173.69986 -165.54352 8.15634 2.50270 -166.53777 779.49898
3085.0000 -170.78644 -163.79589 6.99055 2.59915 -164.88405 840.21859
3090.0000 -171.70699 -164.38473 7.32226 2.65693 -163.89328 857.01913
3095.0000 -173.25641 -164.84135 8.41506 2.60189 -164.83700 847.81886
3100.0000 -173.09084 -163.95022 9.14061 2.65981 -163.84397 897.84744
3105.0000 -172.03555 -164.45017 7.58538 2.64441 -164.10802 886.96428
3110.0000 -172.30691 -166.16109 6.14582 2.64059 -164.17341 886.99154
3115.0000 -172.18998 -164.21733 7.97264 2.63351 -164.29486 863.63973
3120.0000 -172.20818 -163.67465 8.53353 2.60603 -164.76603 861.86495
3125.0000 -171.33338 -163.60206 7.73132 2.69986 -163.15724 910.69913
3130.0000 -172.55080 -164.68945 7.86136 2.66208 -163.80491 893.73684
3135.0000 -172.54557 -163.73216 8.81341 2.66476 -163.75906 892.97961
3140.0000 -170.83228 -164.19220 6.64008 2.67095 -163.65295 842.80356
3145.0000 -171.06121 -163.55101 7.51020 2.68657 -163.38515 882.80212
3150.0000 -172.49909 -166.09425 6.40484 2.62356 -164.46540 828.93363
3155.0000 -172.80602 -164.49516 8.31086 2.57528 -165.29337 841.33855
3160.0000 -172.74197 -165.74551 6.99645 2.59111 -165.02185 856.33547
3165.0000 -174.16134 -165.95463 8.20671 2.52244 -166.19931 810.71591
3170.0000 -173.92938 -164.99091 8.93847 2.56888 -165.40306 842.97515
3175.0000 -174.15849 -165.56203 8.59646 2.55989 -165.55712 824.59872
3180.0000 -171.79615 -163.75617 8.03998 2.61830 -164.55567 886.10977
3185.0000 -170.62437 -160.78557 9.83881 2.74032 -162.46339 945.20876
3190.0000 -170.80965 -162.25862 8.55103 2.75835 -162.15429 956.41801
3195.0000 -171.22222 -163.23201 7.99021 2.75169 -162.26853 933.37057
3200.0000 -170.76266 -162.21692 8.54574 2.67427 -163.59600 881.21141
3205.0000 -171.95280 -163.28892 8.66388 2.68804 -163.35985 903.40245
3210.0000 -172.11917 -163.34746 8.77172 2.68380 -163.43252 896.81561
3215.0000 -171.14722 -164.17368 6.97355 2.70693 -163.03592 940.73603
3220.0000 -173.05571 -165.68263 7.37307 2.59459 -164.96226 838.07531
3225.0000 -171.91898 -164.38474 7.53424 2.56390 -165.48847 824.57449
3230.0000 -173.38973 -166.33310 7.05663 2.62705 -164.40570 859.36351
3235.0000 -172.05023 -164.94285 7.10738 2.58220 -165.17471 831.02993
3240.0000 -172.33066 -164.34515 7.98551 2.61902 -164.54329 856.39145
3245.0000 -172.16442 -165.17714 6.98727 2.59985 -164.87203 839.23853
3250.0000 -170.75338 -163.43885 7.31453 2.69768 -163.19450 870.71623
FREEZING PROCESS: loop number 14 T-loop= 836.00000000000000
main_MD> interactions number 14 at Temperature= 836.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.26838 -0.41859 0.87847
force_rgl> df(natom) -1.96090 0.36146 -1.96387
3255.0000 -171.14174 -163.55567 7.58607 2.64789 -164.04832 880.67874
3260.0000 -171.92554 -164.46209 7.46345 2.61580 -164.59858 863.95437
3265.0000 -173.08394 -166.13530 6.94864 2.58934 -165.05213 809.59904
3270.0000 -173.52420 -165.84403 7.68017 2.54134 -165.87517 802.34804
3275.0000 -173.18449 -165.86862 7.31587 2.55100 -165.70967 845.59375
3280.0000 -173.42609 -165.87860 7.54748 2.53559 -165.97384 805.17524
3285.0000 -172.80238 -165.43889 7.36349 2.57039 -165.37712 809.47097
3290.0000 -172.14329 -164.29754 7.84574 2.61267 -164.65220 821.53956
3295.0000 -170.62788 -163.58442 7.04345 2.69509 -163.23893 916.37937
3300.0000 -171.47327 -162.54202 8.93125 2.72427 -162.73858 937.47309
3305.0000 -171.48315 -164.46277 7.02039 2.72113 -162.79244 911.64177
3310.0000 -173.28895 -166.19934 7.08961 2.55383 -165.66105 827.68813
3315.0000 -172.73629 -164.89482 7.84147 2.60446 -164.79303 863.44579
3320.0000 -172.43345 -165.45585 6.97760 2.57955 -165.22007 827.24661
3325.0000 -173.85579 -165.29453 8.56126 2.56196 -165.52176 816.45840
3330.0000 -173.00399 -164.92295 8.08104 2.59680 -164.92429 861.21402
3335.0000 -170.77425 -163.44719 7.32707 2.60877 -164.71906 870.16020
3340.0000 -172.98904 -165.47954 7.50949 2.62125 -164.50499 852.08748
3345.0000 -173.28016 -166.91650 6.36366 2.47791 -166.96279 764.62401
3350.0000 -172.17631 -164.30596 7.87036 2.58513 -165.12446 843.89842
3355.0000 -172.06521 -164.96743 7.09779 2.61213 -164.66153 872.17703
3360.0000 -171.17939 -163.88922 7.29017 2.59574 -164.94250 846.86582
3365.0000 -171.77797 -164.42455 7.35342 2.62355 -164.46560 871.42580
3370.0000 -172.33380 -164.30051 8.03329 2.64963 -164.01841 881.35599
3375.0000 -171.96328 -163.09649 8.86679 2.64874 -164.03373 876.71234
3380.0000 -172.17592 -163.68349 8.49243 2.66726 -163.71623 888.77940
3385.0000 -173.07792 -164.99069 8.08723 2.62186 -164.49463 874.56272
3390.0000 -174.52846 -166.58813 7.94033 2.51644 -166.30225 794.18420
3395.0000 -171.90663 -164.54589 7.36074 2.56137 -165.53173 839.51297
3400.0000 -172.59445 -165.07928 7.51517 2.64149 -164.15803 857.87214
3405.0000 -173.57583 -165.74878 7.82704 2.56352 -165.49498 817.73615
3410.0000 -172.22557 -164.63814 7.58743 2.56889 -165.40293 838.16384
3415.0000 -171.95834 -163.72751 8.23083 2.64567 -164.08643 884.99810
3420.0000 -172.56567 -164.91909 7.64659 2.63569 -164.25755 859.89168
3425.0000 -173.73890 -166.10907 7.62983 2.63471 -164.27431 837.40332
3430.0000 -174.38911 -165.54634 8.84276 2.51763 -166.28177 791.24761
3435.0000 -174.12598 -166.28120 7.84478 2.52707 -166.11994 813.21453
3440.0000 -172.78224 -164.51673 8.26551 2.55350 -165.66672 822.38166
3445.0000 -173.44713 -166.09095 7.35617 2.58798 -165.07554 859.57737
3450.0000 -173.74226 -166.20218 7.54008 2.54790 -165.76283 826.22152
3455.0000 -174.10647 -167.08001 7.02647 2.49240 -166.71439 775.65308
3460.0000 -172.03441 -163.60641 8.42800 2.61496 -164.61295 835.09797
3465.0000 -172.06674 -163.62420 8.44253 2.65003 -164.01159 874.27416
3470.0000 -172.47280 -164.14237 8.33043 2.61057 -164.68825 840.90022
3475.0000 -171.49507 -163.22070 8.27437 2.68112 -163.47856 897.63804
3480.0000 -171.08995 -163.09181 7.99814 2.74561 -162.37268 919.13006
3485.0000 -171.26778 -161.15277 10.11502 2.75325 -162.24168 954.59914
3490.0000 -171.42770 -163.06054 8.36716 2.74115 -162.44916 949.33010
3495.0000 -171.86768 -163.04436 8.82332 2.72114 -162.79228 915.69420
3500.0000 -171.73947 -164.06370 7.67577 2.63091 -164.33949 875.12000
FREEZING PROCESS: loop number 15 T-loop= 811.00000000000000
main_MD> interactions number 15 at Temperature= 811.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.42686 -1.17149 -1.05352
force_rgl> df(natom) -8.86583 -1.37527 2.38417
3505.0000 -173.41328 -165.19823 8.21505 2.60105 -164.85148 853.25410
3510.0000 -173.85895 -166.91958 6.93937 2.51880 -166.26173 788.07119
3515.0000 -174.28436 -165.93801 8.34636 2.49810 -166.61667 782.66563
3520.0000 -172.95482 -166.23559 6.71922 2.52053 -166.23209 810.37741
3525.0000 -173.29886 -167.41284 5.88602 2.49708 -166.63414 787.05471
3530.0000 -174.51771 -167.58532 6.93239 2.47993 -166.92816 769.76321
3535.0000 -175.19482 -167.99173 7.20309 2.43658 -167.67154 734.79477
3540.0000 -173.06009 -166.29020 6.76990 2.48488 -166.84338 775.48837
3545.0000 -174.10384 -166.76605 7.33779 2.52713 -166.11890 789.63900
3550.0000 -172.85433 -165.85487 6.99946 2.52701 -166.12096 790.43700
3555.0000 -172.03868 -164.11478 7.92390 2.64072 -164.17117 874.89710
3560.0000 -172.84353 -165.35341 7.49012 2.63219 -164.31756 877.18775
3565.0000 -172.51969 -164.46490 8.05479 2.60319 -164.81481 857.48350
3570.0000 -173.00609 -164.69664 8.30945 2.57881 -165.23277 843.16499
3575.0000 -174.26402 -167.12350 7.14051 2.49841 -166.61134 786.28566
3580.0000 -173.40188 -166.47342 6.92846 2.52664 -166.12727 795.20129
3585.0000 -173.61831 -166.96488 6.65344 2.51037 -166.40618 788.08625
3590.0000 -172.45272 -164.46385 7.98886 2.55675 -165.61110 814.48466
3595.0000 -173.47082 -165.87827 7.59255 2.61473 -164.61682 848.13564
3600.0000 -171.85025 -164.27756 7.57269 2.55769 -165.59483 813.93059
3605.0000 -174.03154 -167.62435 6.40719 2.53497 -165.98441 795.05473
3610.0000 -174.10604 -166.70153 7.40450 2.48480 -166.84474 781.02356
3615.0000 -173.09226 -166.44343 6.64883 2.52348 -166.18155 784.35059
3620.0000 -171.44923 -163.96217 7.48706 2.57769 -165.25190 814.42620
3625.0000 -172.26098 -164.25862 8.00236 2.63776 -164.22206 831.88453
3630.0000 -172.30385 -164.85388 7.44998 2.65493 -163.92763 879.31707
3635.0000 -171.75654 -164.15270 7.60384 2.66366 -163.77795 896.76348
3640.0000 -173.20862 -165.14341 8.06521 2.62635 -164.41761 863.51497
3645.0000 -173.81204 -166.48313 7.32891 2.55281 -165.67849 801.38330
3650.0000 -174.43746 -167.46144 6.97601 2.50204 -166.54901 812.46973
3655.0000 -173.82894 -166.70613 7.12281 2.46808 -167.13142 786.70479
3660.0000 -174.17356 -166.27821 7.89535 2.45804 -167.30360 734.19504
3665.0000 -174.15456 -166.61376 7.54080 2.51056 -166.40306 796.78463
3670.0000 -172.93788 -165.88975 7.04814 2.50336 -166.52647 782.24859
3675.0000 -172.83556 -165.87565 6.95990 2.53281 -166.02142 801.19916
3680.0000 -173.79554 -167.52064 6.27491 2.53448 -165.99289 812.64324
3685.0000 -172.75048 -164.80209 7.94839 2.49834 -166.61248 778.34437
3690.0000 -172.97798 -165.13611 7.84187 2.60783 -164.73526 817.06161
3695.0000 -173.13170 -166.49212 6.63958 2.56358 -165.49396 784.35265
3700.0000 -172.36076 -164.53814 7.82262 2.56632 -165.44686 813.66540
3705.0000 -172.11524 -165.08479 7.03045 2.60013 -164.86723 833.91051
3710.0000 -172.77898 -165.91956 6.85942 2.57865 -165.23545 865.75245
3715.0000 -172.80038 -164.94410 7.85628 2.56127 -165.53350 832.71691
3720.0000 -173.91043 -165.86824 8.04219 2.56748 -165.42705 839.82543
3725.0000 -174.17913 -165.88925 8.28988 2.52380 -166.17605 802.66789
3730.0000 -171.27750 -163.58409 7.69341 2.60799 -164.73243 867.37240
3735.0000 -171.86821 -164.67034 7.19787 2.64749 -164.05520 882.50924
3740.0000 -173.47646 -167.01873 6.45772 2.52108 -166.22260 822.65194
3745.0000 -174.56243 -168.37258 6.18986 2.49329 -166.69916 787.64712
3750.0000 -172.84783 -165.71494 7.13290 2.52743 -166.11379 803.70040
FREEZING PROCESS: loop number 16 T-loop= 786.00000000000000
main_MD> interactions number 16 at Temperature= 786.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.79195 -1.46678 0.35105
force_rgl> df(natom) -0.34416 0.42221 -3.33147
3755.0000 -173.05576 -165.84466 7.21111 2.52670 -166.12629 771.30670
3760.0000 -174.61199 -166.11456 8.49743 2.56145 -165.53036 797.17755
3765.0000 -173.62589 -165.50202 8.12387 2.56004 -165.55466 822.94310
3770.0000 -174.48200 -165.75695 8.72505 2.52800 -166.10403 795.22109
3775.0000 -172.80708 -164.34967 8.45741 2.54567 -165.80107 808.27970
3780.0000 -174.95437 -167.38646 7.56791 2.52055 -166.23164 803.38660
3785.0000 -173.26125 -165.84624 7.41501 2.49233 -166.71553 768.58244
3790.0000 -172.95701 -165.36045 7.59656 2.56751 -165.42650 810.23903
3795.0000 -172.42841 -163.99278 8.43562 2.57686 -165.26612 818.03116
3800.0000 -172.92451 -166.56355 6.36095 2.54421 -165.82596 783.89158
3805.0000 -174.66960 -166.54724 8.12237 2.51911 -166.25644 781.32212
3810.0000 -173.34049 -165.92025 7.42024 2.49368 -166.69248 795.26572
3815.0000 -173.38539 -165.50872 7.87667 2.54710 -165.77650 820.06324
3820.0000 -173.10515 -165.19532 7.90983 2.57166 -165.35528 831.41928
3825.0000 -173.11485 -165.91638 7.19848 2.61869 -164.54903 854.83033
3830.0000 -173.46953 -165.70224 7.76729 2.54259 -165.85374 808.16344
3835.0000 -174.21298 -167.42580 6.78718 2.47315 -167.04441 745.89301
3840.0000 -175.74609 -167.46054 8.28555 2.48844 -166.78221 767.84473
3845.0000 -173.75844 -166.43234 7.32610 2.43921 -167.62634 726.39063
3850.0000 -174.40491 -167.96079 6.44412 2.44112 -167.59370 741.78296
3855.0000 -173.31900 -166.23795 7.08105 2.46451 -167.19255 738.32119
3860.0000 -173.94420 -166.90276 7.04144 2.49896 -166.60184 768.53964
3865.0000 -173.39106 -165.60649 7.78457 2.45942 -167.27984 753.94409
3870.0000 -173.45893 -167.19888 6.26005 2.54556 -165.80290 776.97798
3875.0000 -173.06462 -166.63024 6.43438 2.46685 -167.15250 752.63643
3880.0000 -172.51947 -165.68440 6.83507 2.55691 -165.60834 787.74833
3885.0000 -171.92949 -165.50434 6.42515 2.59406 -164.97130 829.30024
3890.0000 -172.44326 -165.29745 7.14581 2.53949 -165.90695 792.50002
3895.0000 -173.28173 -166.85818 6.42355 2.55763 -165.59593 791.50732
3900.0000 -174.48800 -168.33705 6.15096 2.49039 -166.74886 763.99758
3905.0000 -174.62507 -168.97194 5.65313 2.41260 -168.08266 718.85357
3910.0000 -175.77619 -169.66899 6.10721 2.34865 -169.17925 687.55207
3915.0000 -175.08479 -168.06774 7.01705 2.36664 -168.87069 714.29747
3920.0000 -177.89836 -170.41705 7.48132 2.32192 -169.63747 697.99117
3925.0000 -175.24216 -167.73968 7.50248 2.38400 -168.57312 724.24853
3930.0000 -174.74696 -167.67503 7.07193 2.44190 -167.58029 759.66403
3935.0000 -173.51799 -166.78535 6.73264 2.48541 -166.83426 759.51840
3940.0000 -173.31810 -165.41453 7.90357 2.51624 -166.30564 806.03229
3945.0000 -174.37684 -165.83653 8.54031 2.54860 -165.75068 827.58320
3950.0000 -174.95647 -168.21722 6.73925 2.47465 -167.01874 770.23216
3955.0000 -172.60494 -166.56710 6.03784 2.45864 -167.29324 756.44056
3960.0000 -173.59464 -168.10609 5.48854 2.45370 -167.37788 732.38640
3965.0000 -174.94877 -168.50898 6.43979 2.43055 -167.77489 731.23584
3970.0000 -174.21848 -167.37801 6.84047 2.41598 -168.02464 751.59591
3975.0000 -173.24212 -166.17470 7.06742 2.48608 -166.82278 762.24035
3980.0000 -174.20747 -166.45662 7.75085 2.47518 -167.00965 766.89589
3985.0000 -174.51552 -167.37508 7.14044 2.47857 -166.95154 776.04727
3990.0000 -174.61030 -167.14837 7.46193 2.45084 -167.42695 729.26618
3995.0000 -173.86304 -167.56398 6.29907 2.46833 -167.12712 775.63609
4000.0000 -173.43807 -166.72281 6.71526 2.47549 -167.00433 776.03358
FREEZING PROCESS: loop number 17 T-loop= 761.00000000000000
main_MD> interactions number 17 at Temperature= 761.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.05781 -3.47204 -4.41271
force_rgl> df(natom) -1.99104 1.91778 0.54391
4005.0000 -172.93075 -167.56985 5.36090 2.43010 -167.78255 746.41668
4010.0000 -175.57183 -169.28127 6.29055 2.40149 -168.27314 699.14009
4015.0000 -174.79807 -167.94752 6.85055 2.38687 -168.52387 704.41838
4020.0000 -173.72384 -166.69071 7.03313 2.47381 -167.03322 752.41726
4025.0000 -176.00400 -169.10062 6.90338 2.41092 -168.11146 754.17162
4030.0000 -174.22903 -167.82234 6.40668 2.35311 -169.10265 712.54095
4035.0000 -173.76782 -167.14760 6.62022 2.44903 -167.45801 769.69410
4040.0000 -174.49270 -166.94722 7.54549 2.45405 -167.37192 767.23278
4045.0000 -174.27796 -167.31295 6.96501 2.45786 -167.30660 773.96270
4050.0000 -174.36297 -168.00028 6.36268 2.42469 -167.87532 740.72699
4055.0000 -174.95343 -169.54743 5.40600 2.40914 -168.14205 725.72899
4060.0000 -174.89642 -168.06703 6.82938 2.40268 -168.25272 701.56664
4065.0000 -173.47755 -166.41730 7.06025 2.46595 -167.16791 777.61960
4070.0000 -173.82472 -166.74142 7.08329 2.50618 -166.47815 786.23009
4075.0000 -174.24309 -167.25514 6.98795 2.52480 -166.15882 770.52983
4080.0000 -172.89012 -166.04195 6.84817 2.45071 -167.42926 738.80034
4085.0000 -175.28817 -167.45919 7.82898 2.49953 -166.59216 755.62814
4090.0000 -174.44830 -167.75882 6.68948 2.46008 -167.26847 755.69066
4095.0000 -172.04464 -166.24047 5.80416 2.45709 -167.31984 744.90719
4100.0000 -172.26737 -163.79825 8.46912 2.56965 -165.38990 825.12847
4105.0000 -171.93714 -164.85338 7.08376 2.62581 -164.42686 871.66953
4110.0000 -173.77479 -165.60679 8.16800 2.59904 -164.88598 832.19007
4115.0000 -173.93677 -167.05882 6.87794 2.47172 -167.06904 748.66870
4120.0000 -174.88661 -167.22316 7.66345 2.45488 -167.35776 746.77673
4125.0000 -173.02394 -166.21025 6.81369 2.51198 -166.37862 755.05513
4130.0000 -172.93245 -166.17817 6.75428 2.54190 -165.86568 796.94076
4135.0000 -174.91577 -169.59224 5.32352 2.42306 -167.90339 731.17897
4140.0000 -175.13284 -169.48124 5.65160 2.32307 -169.61783 639.38073
4145.0000 -175.25630 -169.34488 5.91142 2.37049 -168.80470 691.15860
4150.0000 -175.52405 -169.12809 6.39595 2.36445 -168.90825 705.55264
4155.0000 -174.21160 -168.35852 5.85309 2.39230 -168.43074 712.47478
4160.0000 -174.08330 -167.31097 6.77232 2.43664 -167.67052 743.42333
4165.0000 -174.08544 -168.15464 5.93080 2.43216 -167.74728 714.36395
4170.0000 -173.94752 -166.38261 7.56491 2.47950 -166.93551 760.32567
4175.0000 -173.10460 -165.85183 7.25277 2.55424 -165.65407 814.03585
4180.0000 -173.23131 -165.03683 8.19448 2.56715 -165.43270 833.61889
4185.0000 -174.99662 -167.86518 7.13145 2.51772 -166.28027 808.32555
4190.0000 -174.69379 -169.11910 5.57469 2.37375 -168.74881 728.58706
4195.0000 -174.86234 -168.93990 5.92244 2.37735 -168.68709 706.72956
4200.0000 -174.77466 -167.78378 6.99088 2.43656 -167.67178 738.89498
4205.0000 -174.26659 -167.71546 6.55113 2.41444 -168.05113 735.47886
4210.0000 -173.52536 -167.04575 6.47961 2.47079 -167.08489 754.89402
4215.0000 -172.68923 -164.50682 8.18241 2.53292 -166.01968 820.25381
4220.0000 -172.17588 -165.17818 6.99770 2.61897 -164.54412 848.88318
4225.0000 -172.75682 -164.88124 7.87558 2.54852 -165.75217 805.15500
4230.0000 -174.06026 -166.79634 7.26392 2.51310 -166.35941 762.47388
4235.0000 -172.70325 -165.60330 7.09995 2.52986 -166.07213 823.95422
4240.0000 -174.62758 -166.99010 7.63748 2.44597 -167.51044 765.85140
4245.0000 -174.05255 -165.53152 8.52103 2.49913 -166.59896 806.18021
4250.0000 -175.04227 -167.03007 8.01219 2.52298 -166.19011 807.49115
FREEZING PROCESS: loop number 18 T-loop= 736.00000000000000
main_MD> interactions number 18 at Temperature= 736.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.57229 0.94601 4.27905
force_rgl> df(natom) 1.19826 1.81836 -0.23022
4255.0000 -174.93554 -167.03928 7.89625 2.43326 -167.72844 752.26860
4260.0000 -174.03168 -166.86232 7.16936 2.45377 -167.37673 747.35112
4265.0000 -174.96202 -167.77447 7.18755 2.46328 -167.21374 786.12907
4270.0000 -175.05307 -168.24151 6.81156 2.41230 -168.08781 730.89120
4275.0000 -174.34012 -167.80443 6.53568 2.40972 -168.13206 741.28391
4280.0000 -175.36304 -168.67772 6.68532 2.39347 -168.41060 717.11268
4285.0000 -174.51750 -168.48355 6.03395 2.36674 -168.86895 693.86007
4290.0000 -174.78036 -168.78911 5.99125 2.42986 -167.78672 737.71066
4295.0000 -175.09433 -168.90982 6.18451 2.37674 -168.69753 675.73424
4300.0000 -175.38838 -168.72176 6.66662 2.38875 -168.49156 711.34794
4305.0000 -174.98711 -168.57698 6.41013 2.34212 -169.29116 712.84028
4310.0000 -176.25419 -170.21934 6.03484 2.31726 -169.71748 650.56756
4315.0000 -175.94165 -168.48479 7.45686 2.31575 -169.74325 657.89997
4320.0000 -174.95234 -169.29030 5.66204 2.38966 -168.47602 721.69971
4325.0000 -174.80651 -168.88403 5.92248 2.32783 -169.53618 669.35336
4330.0000 -173.50402 -166.46522 7.03880 2.40112 -168.27945 726.86896
4335.0000 -174.58668 -167.19384 7.39284 2.44256 -167.56890 758.98796
4340.0000 -176.79202 -168.59302 8.19900 2.45069 -167.42960 743.41711
4345.0000 -174.31076 -167.43231 6.87845 2.41311 -168.07392 756.37592
4350.0000 -173.59241 -167.16405 6.42835 2.43282 -167.73594 757.59647
4355.0000 -175.51813 -167.77184 7.74629 2.44041 -167.60585 739.62092
4360.0000 -175.40186 -168.01690 7.38496 2.41590 -168.02609 742.65635
4365.0000 -175.77557 -168.32831 7.44726 2.40755 -168.16930 720.48347
4370.0000 -173.51548 -166.90730 6.60818 2.41913 -167.97065 722.27032
4375.0000 -173.81258 -165.95209 7.86049 2.50134 -166.56113 787.17544
4380.0000 -172.09820 -165.52393 6.57427 2.50853 -166.43784 788.35424
4385.0000 -174.68030 -167.23399 7.44631 2.54862 -165.75045 789.58048
4390.0000 -173.93246 -167.05851 6.87396 2.46270 -167.22368 773.33004
4395.0000 -174.21290 -166.60950 7.60341 2.48288 -166.87767 770.55556
4400.0000 -175.07523 -168.36088 6.71436 2.47506 -167.01177 744.35476
4405.0000 -176.05874 -169.21589 6.84286 2.35248 -169.11348 668.86866
4410.0000 -175.48032 -168.78750 6.69282 2.37388 -168.74658 706.27732
4415.0000 -176.10794 -169.81682 6.29113 2.38441 -168.56596 720.37560
4420.0000 -175.49154 -169.51130 5.98024 2.31598 -169.73936 671.81313
4425.0000 -175.88778 -170.20946 5.67832 2.31392 -169.77459 664.49534
4430.0000 -174.96852 -168.18718 6.78135 2.36943 -168.82285 711.41173
4435.0000 -174.07695 -168.56484 5.51212 2.37276 -168.76571 692.72495
4440.0000 -175.66201 -168.21426 7.44775 2.38034 -168.63582 698.43211
4445.0000 -174.70095 -167.77808 6.92287 2.39348 -168.41055 719.04513
4450.0000 -173.66784 -166.71505 6.95278 2.46278 -167.22228 768.25198
4455.0000 -174.42370 -167.78354 6.64016 2.49128 -166.73359 792.52309
4460.0000 -175.19104 -169.20958 5.98146 2.37357 -168.75185 733.90714
4465.0000 -174.82762 -169.30304 5.52458 2.35922 -168.99794 671.04303
4470.0000 -174.71572 -167.88579 6.82993 2.43006 -167.78325 720.39279
4475.0000 -174.11953 -167.13764 6.98189 2.44617 -167.50708 726.60875
4480.0000 -174.88822 -167.52105 7.36717 2.43317 -167.73000 738.64432
4485.0000 -173.39937 -167.05573 6.34364 2.46039 -167.26326 744.52527
4490.0000 -173.61580 -167.14204 6.47376 2.47160 -167.07103 771.28709
4495.0000 -173.19360 -166.48974 6.70386 2.43828 -167.64230 717.52375
4500.0000 -174.30744 -168.27096 6.03647 2.47685 -166.98096 756.75384
FREEZING PROCESS: loop number 19 T-loop= 711.00000000000000
main_MD> interactions number 19 at Temperature= 711.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.51836 2.25407 0.89625
force_rgl> df(natom) 3.02034 -2.46835 2.32098
4505.0000 -174.50589 -167.21309 7.29281 2.47007 -167.09733 771.26878
4510.0000 -175.84459 -168.72174 7.12285 2.41063 -168.11645 718.76106
4515.0000 -174.45668 -168.62327 5.83340 2.35811 -169.01705 706.12589
4520.0000 -175.28944 -168.42318 6.86626 2.39766 -168.33887 704.13598
4525.0000 -174.89635 -168.28748 6.60888 2.35173 -169.12636 666.68119
4530.0000 -174.85624 -168.15527 6.70097 2.40678 -168.18254 696.72145
4535.0000 -174.65763 -168.56402 6.09361 2.38758 -168.51169 686.22695
4540.0000 -174.83459 -168.65510 6.17949 2.39562 -168.37387 693.27121
4545.0000 -174.76087 -168.68693 6.07395 2.38405 -168.57222 709.26764
4550.0000 -175.93622 -169.77446 6.16177 2.36751 -168.85580 700.22327
4555.0000 -176.66732 -169.37903 7.28828 2.32123 -169.64930 669.30732
4560.0000 -174.05348 -168.08884 5.96464 2.36818 -168.84432 700.42319
4565.0000 -174.35317 -167.39107 6.96209 2.47204 -167.06355 752.55310
4570.0000 -174.17075 -167.90357 6.26718 2.49724 -166.63135 775.52040
4575.0000 -175.47840 -168.84570 6.63271 2.35380 -169.09079 678.82589
4580.0000 -175.47169 -168.45574 7.01595 2.38980 -168.47353 710.81101
4585.0000 -175.15818 -169.50156 5.65662 2.36867 -168.83588 718.46096
4590.0000 -174.89779 -169.15203 5.74577 2.32419 -169.59849 655.43403
4595.0000 -175.23135 -169.29270 5.93865 2.35475 -169.07462 689.40303
4600.0000 -175.37561 -169.34640 6.02920 2.37703 -168.69248 707.23398
4605.0000 -174.59407 -168.12984 6.46423 2.40885 -168.14700 737.61074
4610.0000 -175.50384 -167.89241 7.61143 2.40527 -168.20833 721.00462
4615.0000 -175.75001 -169.66671 6.08330 2.34817 -169.18742 716.40786
4620.0000 -175.86021 -169.65305 6.20716 2.30435 -169.93874 662.63003
4625.0000 -175.51271 -170.12795 5.38476 2.33408 -169.42896 668.87169
4630.0000 -176.18081 -170.28627 5.89454 2.26707 -170.57790 617.48127
4635.0000 -174.77963 -169.48750 5.29213 2.30722 -169.88951 646.73590
4640.0000 -176.74069 -170.92479 5.81591 2.27665 -170.41367 640.16272
4645.0000 -175.09564 -168.80366 6.29197 2.32205 -169.63523 668.64782
4650.0000 -175.01528 -167.47314 7.54214 2.40985 -168.12983 716.27837
4655.0000 -174.29544 -167.59906 6.69638 2.41613 -168.02221 726.37338
4660.0000 -173.78093 -166.49880 7.28213 2.50574 -166.48559 772.86248
4665.0000 -176.21171 -169.14557 7.06614 2.44117 -167.59276 776.11067
4670.0000 -174.40762 -168.32985 6.07777 2.32752 -169.54154 668.82036
4675.0000 -175.13351 -168.77985 6.35366 2.35087 -169.14114 679.18377
4680.0000 -175.29178 -168.56190 6.72988 2.39411 -168.39975 705.32921
4685.0000 -175.02347 -168.82812 6.19535 2.36467 -168.90454 683.31672
4690.0000 -176.13759 -169.80880 6.32878 2.33622 -169.39237 684.32855
4695.0000 -175.61305 -168.83212 6.78093 2.31889 -169.68953 683.91691
4700.0000 -174.56998 -167.14152 7.42846 2.40812 -168.15940 741.97826
4705.0000 -175.46731 -169.43412 6.03320 2.45428 -167.36800 755.85635
4710.0000 -175.26955 -168.34790 6.92164 2.36987 -168.81536 662.11243
4715.0000 -175.32159 -169.19414 6.12745 2.38850 -168.49591 711.40159
4720.0000 -174.56365 -168.35392 6.20973 2.36509 -168.89723 708.72575
4725.0000 -176.35324 -169.21757 7.13568 2.38367 -168.57870 705.30326
4730.0000 -176.10322 -169.64597 6.45725 2.32966 -169.50472 650.41864
4735.0000 -175.21983 -168.42416 6.79567 2.33623 -169.39220 669.57790
4740.0000 -174.23102 -167.22675 7.00427 2.42739 -167.82914 728.08633
4745.0000 -174.64260 -166.60313 8.03947 2.45728 -167.31653 736.56423
4750.0000 -174.99234 -167.63656 7.35579 2.45623 -167.33451 742.99039
FREEZING PROCESS: loop number 20 T-loop= 686.00000000000000
main_MD> interactions number 20 at Temperature= 686.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.46919 -1.18037 0.97963
force_rgl> df(natom) -0.71286 -0.68616 -4.09340
4755.0000 -173.97535 -167.65821 6.31714 2.43850 -167.63852 732.74389
4760.0000 -175.08502 -168.55361 6.53141 2.41276 -168.08000 708.75444
4765.0000 -175.13488 -168.42461 6.71027 2.39661 -168.35689 704.71781
4770.0000 -174.90051 -167.68860 7.21191 2.41744 -167.99970 709.98389
4775.0000 -175.05981 -168.68936 6.37045 2.39661 -168.35689 712.56625
4780.0000 -175.57206 -168.73473 6.83734 2.35106 -169.13778 695.61375
4785.0000 -175.71849 -169.60075 6.11774 2.33256 -169.45499 660.79209
4790.0000 -174.70216 -168.82717 5.87499 2.37417 -168.74166 720.19031
4795.0000 -175.41259 -168.76679 6.64580 2.40452 -168.22122 713.94656
4800.0000 -175.13136 -167.86510 7.26626 2.39575 -168.37161 716.41884
4805.0000 -174.45077 -168.64193 5.80883 2.40736 -168.17247 736.15782
4810.0000 -174.49146 -167.11750 7.37396 2.41933 -167.96735 705.95725
4815.0000 -175.57324 -168.95804 6.61520 2.42567 -167.85860 747.80030
4820.0000 -175.26440 -168.94202 6.32238 2.38600 -168.53876 703.22402
4825.0000 -175.75815 -169.22567 6.53248 2.37368 -168.74993 703.81299
4830.0000 -174.34019 -167.84588 6.49432 2.36741 -168.85759 668.63335
4835.0000 -175.70370 -169.11589 6.58781 2.39808 -168.33156 706.03541
4840.0000 -173.91374 -167.97796 5.93578 2.38566 -168.54456 690.49853
4845.0000 -176.27549 -169.85091 6.42458 2.37252 -168.76991 715.43009
4850.0000 -173.76590 -167.58090 6.18500 2.36947 -168.82218 695.96406
4855.0000 -175.30395 -168.08734 7.21661 2.44062 -167.60219 739.63105
4860.0000 -175.47466 -168.15155 7.32311 2.35989 -168.98649 709.17547
4865.0000 -174.05675 -167.97266 6.08409 2.38263 -168.59652 690.50699
4870.0000 -175.11330 -167.89968 7.21362 2.40719 -168.17548 717.16057
4875.0000 -176.91250 -170.83090 6.08161 2.32441 -169.59479 661.46971
4880.0000 -176.02066 -168.81480 7.20587 2.32824 -169.52920 670.62193
4885.0000 -175.20904 -168.36019 6.84885 2.40844 -168.15407 729.78394
4890.0000 -175.47077 -168.79646 6.67431 2.36122 -168.96372 700.00136
4895.0000 -174.87708 -167.51039 7.36669 2.41267 -168.08153 723.67429
4900.0000 -174.36639 -168.16534 6.20105 2.43780 -167.65057 737.04702
4905.0000 -174.55921 -168.28509 6.27411 2.39273 -168.42342 705.81452
4910.0000 -175.55356 -169.34689 6.20667 2.34698 -169.20789 678.91932
4915.0000 -174.41608 -167.59021 6.82587 2.40435 -168.22420 728.03699
4920.0000 -174.68822 -168.08459 6.60363 2.42114 -167.93624 701.94530
4925.0000 -175.33827 -169.74432 5.59395 2.34508 -169.24038 676.08533
4930.0000 -175.37035 -168.50226 6.86809 2.35899 -169.00181 696.46553
4935.0000 -174.97389 -168.23768 6.73621 2.38698 -168.52187 698.17277
4940.0000 -175.75429 -168.08113 7.67316 2.35354 -169.09532 691.37142
4945.0000 -174.34099 -168.31319 6.02780 2.38365 -168.57905 706.50094
4950.0000 -175.44503 -169.17907 6.26596 2.36747 -168.85640 712.23714
4955.0000 -176.94962 -171.09137 5.85825 2.30397 -169.94521 666.28470
4960.0000 -176.00723 -170.40138 5.60586 2.24623 -170.93535 642.18727
4965.0000 -176.37056 -170.25983 6.11073 2.23801 -171.07622 610.90347
4970.0000 -175.93282 -169.44499 6.48782 2.27650 -170.41628 627.68147
4975.0000 -174.96423 -169.27120 5.69303 2.35903 -169.00120 695.58158
4980.0000 -176.20956 -170.94852 5.26104 2.32532 -169.57926 680.16019
4985.0000 -176.01211 -170.17826 5.83385 2.27445 -170.45142 640.93577
4990.0000 -174.35007 -168.21793 6.13214 2.35353 -169.09552 664.95031
4995.0000 -175.70346 -168.42639 7.27707 2.40123 -168.27765 704.54040
5000.0000 -174.29672 -168.15046 6.14625 2.43306 -167.73183 732.53144
FREEZING PROCESS: loop number 21 T-loop= 661.00000000000000
main_MD> interactions number 21 at Temperature= 661.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.77892 -0.74312 -0.47051
force_rgl> df(natom) 0.44286 -1.56428 1.74968
5005.0000 -175.77269 -170.07255 5.70014 2.35769 -169.02424 708.45148
5010.0000 -174.91005 -169.44571 5.46434 2.35380 -169.09085 697.50120
5015.0000 -174.90881 -169.08464 5.82417 2.31236 -169.80148 645.23361
5020.0000 -174.50608 -168.88125 5.62483 2.36889 -168.83218 674.35383
5025.0000 -174.95578 -167.81895 7.13683 2.43911 -167.62805 728.85379
5030.0000 -175.24391 -169.54902 5.69489 2.40277 -168.25121 738.59737
5035.0000 -176.11978 -168.91397 7.20581 2.35145 -169.13114 687.88547
5040.0000 -176.12776 -169.26489 6.86287 2.32238 -169.62969 691.66014
5045.0000 -176.06964 -169.92073 6.14891 2.31130 -169.81966 667.82239
5050.0000 -175.46713 -169.90860 5.55853 2.29924 -170.02637 641.56402
5055.0000 -176.01874 -169.01664 7.00209 2.33035 -169.49289 694.97270
5060.0000 -176.12764 -170.00683 6.12082 2.37236 -168.77272 697.27729
5065.0000 -175.97605 -170.32197 5.65407 2.30475 -169.93191 657.25232
5070.0000 -174.61111 -167.42394 7.18717 2.39068 -168.45845 702.05844
5075.0000 -173.93283 -168.34167 5.59117 2.43552 -167.68972 743.76803
5080.0000 -175.37260 -168.91850 6.45409 2.38748 -168.51344 692.25650
5085.0000 -175.20763 -170.05077 5.15686 2.32229 -169.63115 629.78847
5090.0000 -175.50915 -170.38070 5.12846 2.29794 -170.04865 635.07722
5095.0000 -175.42698 -169.77083 5.65616 2.29547 -170.09110 645.75083
5100.0000 -176.48705 -170.82521 5.66184 2.31723 -169.71793 664.33595
5105.0000 -177.09433 -171.85477 5.23957 2.27527 -170.43735 617.21131
5110.0000 -176.14118 -170.71577 5.42541 2.22609 -171.28060 603.40966
5115.0000 -177.53926 -170.84854 6.69072 2.24885 -170.89033 609.15992
5120.0000 -175.94918 -170.97981 4.96937 2.26617 -170.59347 646.19040
5125.0000 -176.37185 -170.63503 5.73682 2.26369 -170.63588 625.50604
5130.0000 -176.06587 -171.11253 4.95333 2.27173 -170.49801 618.74519
5135.0000 -177.49799 -172.23349 5.26450 2.18683 -171.95382 588.64797
5140.0000 -175.56222 -169.36599 6.19623 2.27567 -170.43047 651.52179
5145.0000 -177.21663 -171.23513 5.98150 2.26046 -170.69123 620.90202
5150.0000 -174.55891 -168.25185 6.30706 2.32520 -169.58119 666.27968
5155.0000 -175.52516 -169.57491 5.95025 2.33051 -169.49019 686.34566
5160.0000 -175.59679 -170.10011 5.49667 2.29429 -170.11129 639.47095
5165.0000 -176.43628 -170.18085 6.25542 2.33323 -169.44359 680.89483
5170.0000 -174.90192 -168.86110 6.04082 2.29697 -170.06524 637.42274
5175.0000 -174.97476 -168.85998 6.11477 2.34665 -169.21339 685.12864
5180.0000 -175.86973 -169.53590 6.33382 2.35915 -168.99914 673.00296
5185.0000 -176.12101 -170.87929 5.24172 2.29152 -170.15883 651.66628
5190.0000 -176.16684 -170.33625 5.83059 2.23873 -171.06392 612.73382
5195.0000 -175.33306 -169.46276 5.87031 2.31863 -169.69392 649.99024
5200.0000 -176.05802 -169.83918 6.21884 2.30718 -169.89028 656.69742
5205.0000 -176.31716 -169.46740 6.84976 2.34059 -169.31736 668.08271
5210.0000 -176.17824 -170.13332 6.04492 2.31919 -169.68433 657.01114
5215.0000 -176.31113 -170.63521 5.67593 2.27706 -170.40663 611.10880
5220.0000 -175.18029 -169.37892 5.80137 2.31918 -169.68440 642.55001
5225.0000 -174.57378 -168.47781 6.09596 2.34992 -169.15740 673.36460
5230.0000 -175.98636 -169.44168 6.54468 2.37831 -168.67070 705.29640
5235.0000 -174.07210 -166.59137 7.48073 2.42284 -167.90713 717.51473
5240.0000 -174.98910 -169.04623 5.94287 2.44965 -167.44736 748.28850
5245.0000 -175.61204 -170.22650 5.38555 2.29278 -170.13710 618.07071
5250.0000 -175.92704 -168.79662 7.13042 2.35572 -169.05797 655.06509
FREEZING PROCESS: loop number 22 T-loop= 636.00000000000000
main_MD> interactions number 22 at Temperature= 636.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.14687 -2.35688 -0.70280
force_rgl> df(natom) 0.01911 -0.25658 0.62674
5255.0000 -174.07708 -167.49634 6.58074 2.38705 -168.52077 700.37473
5260.0000 -174.89879 -168.62467 6.27413 2.40972 -168.13198 706.99069
5265.0000 -175.73518 -169.06446 6.67072 2.37668 -168.69862 689.84573
5270.0000 -175.13725 -169.38260 5.75465 2.32603 -169.56694 678.00711
5275.0000 -175.98464 -168.82381 7.16082 2.36107 -168.96626 713.03974
5280.0000 -175.53931 -169.39052 6.14879 2.33211 -169.46278 668.53771
5285.0000 -176.47942 -169.70738 6.77204 2.32232 -169.63063 672.36592
5290.0000 -175.72176 -170.52126 5.20049 2.27276 -170.48036 646.56055
5295.0000 -176.55262 -171.39500 5.15761 2.28173 -170.32661 668.98403
5300.0000 -176.77130 -171.79536 4.97594 2.24741 -170.91515 619.82248
5305.0000 -177.20993 -171.22970 5.98024 2.25710 -170.74893 642.08239
5310.0000 -174.69134 -168.06037 6.63097 2.36316 -168.93035 706.30337
5315.0000 -176.29374 -170.45557 5.83817 2.34990 -169.15770 657.20784
5320.0000 -176.30011 -169.73600 6.56412 2.31766 -169.71052 650.54872
5325.0000 -175.42018 -169.70032 5.71986 2.34322 -169.27223 656.27081
5330.0000 -175.94853 -169.02156 6.92697 2.33188 -169.46666 674.01758
5335.0000 -174.82530 -169.35401 5.47129 2.29326 -170.12889 676.80555
5340.0000 -175.28138 -169.76606 5.51532 2.34213 -169.29090 668.41381
5345.0000 -176.21612 -170.36420 5.85191 2.29989 -170.01532 630.23462
5350.0000 -175.50066 -169.54634 5.95432 2.28794 -170.22016 645.75375
5355.0000 -176.80723 -171.87685 4.93037 2.28487 -170.27275 640.33205
5360.0000 -176.76065 -170.46706 6.29359 2.25848 -170.72520 626.15792
5365.0000 -176.31632 -170.68044 5.63588 2.26854 -170.55278 627.21634
5370.0000 -176.76889 -170.92874 5.84015 2.27453 -170.45007 628.75423
5375.0000 -176.68081 -171.23949 5.44133 2.25738 -170.74411 613.81608
5380.0000 -177.40842 -171.60308 5.80534 2.23829 -171.07141 626.33684
5385.0000 -177.37196 -171.96284 5.40912 2.19344 -171.84044 578.81267
5390.0000 -176.35792 -171.02580 5.33212 2.20876 -171.57783 597.38443
5395.0000 -176.51278 -171.33681 5.17597 2.24262 -170.99727 614.61835
5400.0000 -177.56651 -171.34240 6.22412 2.20898 -171.57396 608.69148
5405.0000 -176.38846 -169.56654 6.82192 2.31099 -169.82483 675.11551
5410.0000 -176.53913 -171.27245 5.26668 2.31488 -169.75823 660.46794
5415.0000 -175.39291 -169.29843 6.09449 2.31083 -169.82759 677.25260
5420.0000 -174.41568 -170.38403 4.03165 2.30914 -169.85655 645.83780
5425.0000 -176.38966 -170.88970 5.49995 2.29370 -170.12139 653.12170
5430.0000 -176.41921 -170.70643 5.71278 2.26027 -170.69463 624.88706
5435.0000 -175.55104 -170.64403 4.90700 2.27175 -170.49777 638.02089
5440.0000 -174.98110 -168.70917 6.27193 2.33089 -169.48368 659.71708
5445.0000 -176.58766 -170.52041 6.06725 2.29927 -170.02580 653.35094
5450.0000 -176.14068 -170.49940 5.64128 2.27827 -170.38599 617.66070
5455.0000 -176.79814 -171.15538 5.64277 2.23729 -171.08854 600.85485
5460.0000 -176.45481 -170.55979 5.89502 2.26443 -170.62327 622.46757
5465.0000 -174.82221 -168.44779 6.37442 2.32076 -169.65737 661.04939
5470.0000 -175.45146 -169.71145 5.74001 2.38106 -168.62346 698.32785
5475.0000 -175.36506 -170.66692 4.69814 2.29638 -170.07550 646.11511
5480.0000 -175.61273 -170.03836 5.57437 2.31438 -169.76686 627.76732
5485.0000 -175.96361 -170.59687 5.36673 2.27632 -170.41935 630.42002
5490.0000 -175.48633 -169.82420 5.66214 2.29558 -170.08911 648.17179
5495.0000 -176.02371 -169.31812 6.70559 2.33328 -169.44265 671.96094
5500.0000 -174.61870 -168.77300 5.84570 2.31598 -169.73936 646.22755
FREEZING PROCESS: loop number 23 T-loop= 611.00000000000000
main_MD> interactions number 23 at Temperature= 611.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.72719 -0.76521 1.44194
force_rgl> df(natom) -1.36120 -1.05601 2.30444
5505.0000 -176.95382 -171.42752 5.52631 2.28241 -170.31495 621.73542
5510.0000 -177.35342 -170.97361 6.37981 2.21171 -171.52725 577.40179
5515.0000 -176.55992 -171.33839 5.22153 2.19354 -171.83877 590.24425
5520.0000 -177.25553 -172.04881 5.20671 2.18770 -171.93889 582.81066
5525.0000 -177.35517 -171.20101 6.15416 2.20196 -171.69429 590.01506
5530.0000 -176.73673 -170.63335 6.10338 2.22079 -171.37143 593.18764
5535.0000 -176.89668 -170.19666 6.70002 2.26159 -170.67189 640.14594
5540.0000 -176.93175 -170.62443 6.30731 2.25984 -170.70191 638.14898
5545.0000 -176.72833 -170.96094 5.76739 2.23993 -171.04329 627.24424
5550.0000 -177.34014 -171.47423 5.86591 2.20245 -171.68591 593.82396
5555.0000 -176.43169 -171.44603 4.98566 2.23799 -171.07654 612.48080
5560.0000 -176.85591 -170.93823 5.91768 2.22605 -171.28126 611.63365
5565.0000 -177.02895 -171.73817 5.29079 2.22363 -171.32281 593.67691
5570.0000 -177.81896 -172.21985 5.59911 2.14035 -172.75084 550.71598
5575.0000 -176.60440 -171.49346 5.11093 2.18545 -171.97744 587.92244
5580.0000 -176.71243 -171.75119 4.96124 2.19793 -171.76349 570.97628
5585.0000 -177.54510 -172.22565 5.31944 2.19288 -171.85009 593.87713
5590.0000 -178.50419 -173.18038 5.32381 2.15450 -172.50820 580.32866
5595.0000 -177.52400 -172.19520 5.32881 2.12948 -172.93717 542.39179
5600.0000 -177.76918 -171.95121 5.81798 2.20295 -171.67737 603.26475
5605.0000 -177.43055 -172.37892 5.05162 2.19122 -171.87855 575.04804
5610.0000 -178.10004 -172.54093 5.55912 2.15233 -172.54533 560.41897
5615.0000 -176.94609 -171.22376 5.72233 2.18040 -172.06409 586.79876
5620.0000 -177.11985 -171.30292 5.81693 2.21652 -171.44467 598.82651
5625.0000 -176.94548 -171.55322 5.39227 2.19325 -171.84371 572.25545
5630.0000 -177.81680 -172.08368 5.73312 2.21829 -171.41445 597.30727
5635.0000 -177.20219 -171.95771 5.24447 2.17597 -172.14001 570.38985
5640.0000 -175.47653 -170.47634 5.00020 2.24858 -170.89507 610.40971
5645.0000 -176.54102 -170.90326 5.63777 2.25582 -170.77088 618.56958
5650.0000 -176.16759 -169.85722 6.31037 2.25984 -170.70188 607.51244
5655.0000 -174.69608 -169.34977 5.34631 2.33281 -169.45079 645.11353
5660.0000 -177.24981 -171.16697 6.08284 2.30931 -169.85380 630.69323
5665.0000 -177.65751 -172.81653 4.84098 2.19245 -171.85746 572.94602
5670.0000 -177.72242 -172.17980 5.54262 2.17911 -172.08616 567.07418
5675.0000 -177.30432 -171.88183 5.42249 2.19805 -171.76137 581.13448
5680.0000 -177.08812 -171.81173 5.27639 2.18440 -171.99548 568.37172
5685.0000 -176.14181 -171.16036 4.98145 2.22462 -171.30591 594.54991
5690.0000 -177.36604 -171.49456 5.87149 2.21576 -171.45780 600.90071
5695.0000 -175.77791 -169.87022 5.90769 2.25486 -170.78739 618.24597
5700.0000 -176.76053 -171.63438 5.12615 2.24628 -170.93442 617.33338
5705.0000 -176.37448 -171.18014 5.19434 2.18676 -171.95501 581.58686
5710.0000 -177.05656 -171.80011 5.25645 2.22663 -171.27133 613.17332
5715.0000 -177.96396 -172.53238 5.43158 2.19688 -171.78145 585.99740
5720.0000 -176.51260 -171.12994 5.38266 2.20811 -171.58898 578.26068
5725.0000 -176.56445 -170.64826 5.91619 2.26286 -170.65016 612.94354
5730.0000 -177.09776 -170.82059 6.27717 2.23022 -171.20980 621.34145
5735.0000 -177.44816 -171.66214 5.78602 2.21985 -171.38756 619.75061
5740.0000 -176.33119 -170.98287 5.34832 2.19819 -171.75909 588.01359
5745.0000 -176.72897 -170.95055 5.77842 2.26935 -170.53890 643.93542
5750.0000 -175.55120 -169.33370 6.21750 2.29881 -170.03370 627.62779
FREEZING PROCESS: loop number 24 T-loop= 586.00000000000000
main_MD> interactions number 24 at Temperature= 586.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.55413 -1.40633 0.59711
force_rgl> df(natom) 2.75303 -7.06764 -4.70188
5755.0000 -175.37209 -169.99761 5.37448 2.29759 -170.05467 619.39400
5760.0000 -175.79658 -170.01268 5.78390 2.31295 -169.79131 658.62008
5765.0000 -175.22676 -169.57876 5.64801 2.30970 -169.84695 656.06894
5770.0000 -176.11233 -170.09576 6.01657 2.28013 -170.35403 634.55515
5775.0000 -176.74391 -170.84183 5.90208 2.27301 -170.47610 642.20206
5780.0000 -177.62008 -171.93004 5.69004 2.22133 -171.36226 598.81817
5785.0000 -177.22373 -171.56724 5.65650 2.22822 -171.24418 616.90907
5790.0000 -178.77564 -172.81115 5.96448 2.15819 -172.44485 583.67161
5795.0000 -177.32137 -171.80722 5.51415 2.17856 -172.09552 560.49612
5800.0000 -177.62338 -172.80767 4.81571 2.17671 -172.12740 557.98349
5805.0000 -177.04292 -172.59417 4.44875 2.13985 -172.75925 545.86671
5810.0000 -177.31717 -171.82897 5.48820 2.21172 -171.52700 600.42631
5815.0000 -178.04512 -172.33985 5.70527 2.15668 -172.47080 566.12041
5820.0000 -176.76631 -170.96659 5.79972 2.18109 -172.05223 573.86212
5825.0000 -176.59089 -170.72292 5.86798 2.25402 -170.80167 635.25967
5830.0000 -176.35501 -170.92672 5.42829 2.22494 -171.30038 604.02833
5835.0000 -176.28937 -171.27290 5.01647 2.21880 -171.40564 586.94607
5840.0000 -176.29953 -170.57849 5.72105 2.28739 -170.22963 668.93373
5845.0000 -175.26124 -169.55284 5.70840 2.29728 -170.05995 662.52006
5850.0000 -176.22685 -169.75059 6.47626 2.30628 -169.90565 668.44980
5855.0000 -177.35910 -172.24775 5.11135 2.22212 -171.34879 606.73000
5860.0000 -177.56404 -172.71019 4.85386 2.15269 -172.53915 544.90140
5865.0000 -176.50016 -171.55287 4.94729 2.19831 -171.75687 579.35914
5870.0000 -176.05783 -170.39081 5.66702 2.25333 -170.81363 619.82523
5875.0000 -177.00032 -171.45352 5.54679 2.25996 -170.69985 619.37473
5880.0000 -176.21523 -170.45015 5.76508 2.23827 -171.07174 608.40820
5885.0000 -176.85963 -171.32953 5.53011 2.25015 -170.86811 596.09769
5890.0000 -176.74992 -171.75647 4.99345 2.20086 -171.71324 569.47611
5895.0000 -176.94738 -171.27594 5.67144 2.22540 -171.29251 611.22565
5900.0000 -175.80934 -170.19213 5.61721 2.23729 -171.08864 594.47269
5905.0000 -177.18810 -171.88475 5.30334 2.24751 -170.91335 630.26713
5910.0000 -175.20833 -170.67990 4.52843 2.23197 -171.17980 565.15206
5915.0000 -175.71008 -170.48781 5.22226 2.26357 -170.63804 598.02415
5920.0000 -177.84558 -171.63221 6.21337 2.22256 -171.34111 583.38649
5925.0000 -177.16086 -172.64831 4.51255 2.19078 -171.88607 579.20788
5930.0000 -177.70487 -173.28712 4.41775 2.13631 -172.82002 537.41811
5935.0000 -176.66681 -172.05950 4.60731 2.16238 -172.37304 542.28256
5940.0000 -177.47561 -172.15785 5.31776 2.20127 -171.70617 580.05085
5945.0000 -177.69089 -172.81754 4.87335 2.12425 -173.02679 531.50093
5950.0000 -178.70529 -174.08718 4.61812 2.10843 -173.29815 521.87562
5955.0000 -178.21678 -172.21371 6.00306 2.12454 -173.02184 546.44002
5960.0000 -178.16824 -172.72450 5.44374 2.14260 -172.71222 564.12342
5965.0000 -178.28353 -173.83433 4.44920 2.11962 -173.10624 530.66219
5970.0000 -179.31968 -173.87240 5.44728 2.09046 -173.60616 509.14896
5975.0000 -178.00342 -173.00734 4.99607 2.12138 -173.07596 541.16099
5980.0000 -177.39688 -172.38622 5.01066 2.15890 -172.43270 564.75527
5985.0000 -176.96476 -172.17749 4.78727 2.16766 -172.28242 553.06120
5990.0000 -176.40825 -171.06809 5.34017 2.20221 -171.69014 586.38967
5995.0000 -177.11060 -171.11791 5.99270 2.20399 -171.65954 601.23541
6000.0000 -177.58143 -173.00621 4.57523 2.19088 -171.88431 585.38163
FREEZING PROCESS: loop number 25 T-loop= 561.00000000000000
main_MD> interactions number 25 at Temperature= 561.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.24094 -0.75834 0.78802
force_rgl> df(natom) 1.45119 0.07660 -2.23542
6005.0000 -178.08461 -173.04650 5.03810 2.11357 -173.20998 533.97425
6010.0000 -178.33289 -173.40326 4.92963 2.12259 -173.05530 569.12911
6015.0000 -177.18384 -172.72301 4.46083 2.11650 -173.15976 536.55224
6020.0000 -177.00838 -170.73316 6.27521 2.21385 -171.49044 617.95325
6025.0000 -177.23340 -172.10959 5.12381 2.26057 -170.68936 634.07283
6030.0000 -176.25380 -171.68146 4.57233 2.15528 -172.49477 534.16776
6035.0000 -177.36041 -171.91880 5.44161 2.20407 -171.65827 591.42825
6040.0000 -177.30015 -172.24508 5.05508 2.19014 -171.89702 583.52726
6045.0000 -177.27739 -171.61918 5.65820 2.19605 -171.79575 577.87180
6050.0000 -176.83181 -171.53504 5.29677 2.20502 -171.64183 572.27184
6055.0000 -177.54941 -172.92285 4.62655 2.16788 -172.27879 562.69698
6060.0000 -178.34409 -173.48597 4.85811 2.10788 -173.30758 514.68841
6065.0000 -177.96090 -173.18910 4.77180 2.11114 -173.25159 532.72242
6070.0000 -177.99803 -173.23739 4.76065 2.09639 -173.50451 520.21754
6075.0000 -177.15681 -172.58110 4.57570 2.14300 -172.70528 539.53404
6080.0000 -177.26970 -172.77051 4.49918 2.19771 -171.76725 591.37146
6085.0000 -178.65234 -174.71036 3.94198 2.09183 -173.58277 519.33808
6090.0000 -179.23201 -174.06944 5.16257 2.04814 -174.33189 505.78161
6095.0000 -177.87419 -172.29071 5.58348 2.14129 -172.73458 556.20908
6100.0000 -177.86778 -172.31198 5.55580 2.15476 -172.50369 558.16136
6105.0000 -177.74039 -172.06369 5.67669 2.13541 -172.83551 537.89555
6110.0000 -177.88834 -172.80217 5.08617 2.15984 -172.41660 551.63807
6115.0000 -177.51020 -172.16216 5.34804 2.17759 -172.11219 573.01324
6120.0000 -178.13343 -172.56396 5.56947 2.17477 -172.16051 554.78834
6125.0000 -176.83899 -171.58943 5.24956 2.19990 -171.72972 563.21980
6130.0000 -176.83285 -170.83967 5.99318 2.21385 -171.49052 574.76848
6135.0000 -176.78418 -171.90214 4.88203 2.20425 -171.65517 572.44659
6140.0000 -176.94620 -171.63809 5.30811 2.19222 -171.86132 575.80682
6145.0000 -177.82155 -172.33862 5.48294 2.17685 -172.12498 553.74636
6150.0000 -177.10273 -171.60794 5.49479 2.16338 -172.35586 542.46457
6155.0000 -176.78566 -171.18477 5.60089 2.20926 -171.56918 601.69214
6160.0000 -177.10665 -171.74565 5.36100 2.18422 -171.99852 584.02660
6165.0000 -176.44429 -171.97278 4.47151 2.17309 -172.18942 573.27401
6170.0000 -177.64535 -172.50601 5.13934 2.17153 -172.21611 592.22689
6175.0000 -178.97171 -174.22898 4.74273 2.10675 -173.32696 545.06194
6180.0000 -178.97297 -174.33506 4.63791 2.05683 -174.18287 510.18172
6185.0000 -179.05397 -173.89376 5.16022 2.08983 -173.61699 542.29566
6190.0000 -178.64371 -173.39529 5.24842 2.07264 -173.91178 548.13995
6195.0000 -178.58330 -173.80908 4.77421 2.10640 -173.33282 565.89909
6200.0000 -179.67649 -174.07720 5.59930 2.08581 -173.68595 541.11256
6205.0000 -177.94344 -172.90230 5.04114 2.07025 -173.95266 516.31597
6210.0000 -177.34131 -172.50428 4.83703 2.16281 -172.36562 551.50953
6215.0000 -177.64044 -172.38945 5.25099 2.18312 -172.01736 562.92081
6220.0000 -177.39145 -171.24252 6.14893 2.18780 -171.93717 579.93652
6225.0000 -176.23670 -171.01736 5.21934 2.27620 -170.42137 633.47852
6230.0000 -177.31018 -172.48822 4.82196 2.18795 -171.93462 570.34017
6235.0000 -178.07193 -172.69547 5.37645 2.14402 -172.68779 545.44375
6240.0000 -176.96000 -171.52628 5.43373 2.16998 -172.24268 570.67071
6245.0000 -177.19603 -171.97311 5.22292 2.17664 -172.12854 566.04069
6250.0000 -177.48571 -172.51164 4.97407 2.16034 -172.40804 540.32382
FREEZING PROCESS: loop number 26 T-loop= 536.00000000000000
main_MD> interactions number 26 at Temperature= 536.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.49106 1.27661 -2.19361
force_rgl> df(natom) -3.55966 -0.07433 2.66906
6255.0000 -177.91289 -172.10911 5.80378 2.14026 -172.75222 545.37132
6260.0000 -178.30242 -173.76098 4.54144 2.12040 -173.09282 539.79988
6265.0000 -177.98907 -172.53676 5.45230 2.11089 -173.25590 531.84855
6270.0000 -178.20107 -172.95271 5.24835 2.10793 -173.30666 540.91470
6275.0000 -177.41082 -173.05210 4.35872 2.10605 -173.33894 524.48091
6280.0000 -177.37666 -173.24435 4.13231 2.14030 -172.75169 513.50880
6285.0000 -178.45092 -173.42738 5.02354 2.14054 -172.74756 541.05436
6290.0000 -177.88759 -173.16346 4.72414 2.12223 -173.06145 533.09113
6295.0000 -178.30065 -173.13495 5.16570 2.11883 -173.11979 528.86603
6300.0000 -178.04957 -173.32567 4.72390 2.09539 -173.52173 512.63880
6305.0000 -177.75066 -173.32618 4.42448 2.09525 -173.52403 509.43858
6310.0000 -177.96072 -173.24208 4.71865 2.10440 -173.36719 535.17978
6315.0000 -178.70924 -173.18612 5.52313 2.11189 -173.23881 536.32459
6320.0000 -178.69661 -173.60724 5.08937 2.11238 -173.23028 525.62921
6325.0000 -178.16151 -172.83946 5.32205 2.09352 -173.55374 525.55816
6330.0000 -178.74146 -173.36893 5.37253 2.11216 -173.23412 535.13316
6335.0000 -179.08069 -174.84349 4.23719 2.06286 -174.07946 518.58355
6340.0000 -178.65614 -173.73494 4.92120 2.01958 -174.82153 487.87577
6345.0000 -179.28311 -174.32776 4.95535 2.06206 -174.09308 521.27964
6350.0000 -179.15244 -174.83376 4.31868 2.03132 -174.62026 505.85250
6355.0000 -177.68445 -172.86707 4.81737 2.08196 -173.75191 534.48268
6360.0000 -177.68030 -173.09896 4.58134 2.13317 -172.87394 529.66059
6365.0000 -178.22260 -173.77346 4.44915 2.11104 -173.25324 519.28050
6370.0000 -178.26102 -172.50762 5.75340 2.09960 -173.44949 524.55811
6375.0000 -177.72450 -172.25517 5.46934 2.19238 -171.85863 608.58214
6380.0000 -179.06697 -173.50247 5.56451 2.14441 -172.68110 568.22635
6385.0000 -178.22948 -173.70571 4.52377 2.09869 -173.46503 554.55483
6390.0000 -177.84718 -172.85182 4.99536 2.09870 -173.46489 543.31950
6395.0000 -178.24537 -174.40216 3.84320 2.08093 -173.76957 507.59828
6400.0000 -178.33356 -173.44583 4.88773 2.08767 -173.65401 510.51063
6405.0000 -177.67318 -172.74366 4.92953 2.10415 -173.37148 510.29683
6410.0000 -176.64770 -170.95829 5.68942 2.16094 -172.39764 548.38478
6415.0000 -178.45196 -173.09882 5.35314 2.19113 -171.88003 563.00698
6420.0000 -179.03216 -174.12572 4.90644 2.09630 -173.50614 503.05648
6425.0000 -178.54613 -173.38143 5.16471 2.08223 -173.74731 528.16704
6430.0000 -178.20727 -174.22813 3.97914 2.08366 -173.72271 491.91707
6435.0000 -178.34654 -173.05289 5.29364 2.07535 -173.86527 474.90805
6440.0000 -178.40646 -173.09363 5.31282 2.12846 -172.95462 540.86003
6445.0000 -177.24140 -172.63057 4.61083 2.14666 -172.64257 554.50377
6450.0000 -177.48261 -173.15912 4.32349 2.16374 -172.34977 550.90539
6455.0000 -177.77328 -172.37269 5.40059 2.12376 -173.03530 523.80810
6460.0000 -178.00627 -173.83510 4.17117 2.10287 -173.39348 523.77877
6465.0000 -178.02921 -173.42076 4.60845 2.06848 -173.98302 495.12624
6470.0000 -179.08877 -173.31411 5.77466 2.10189 -173.41024 525.99505
6475.0000 -177.34162 -172.66047 4.68115 2.14493 -172.67219 561.78234
6480.0000 -177.51173 -172.93966 4.57207 2.13729 -172.80323 545.73883
6485.0000 -177.68466 -172.32390 5.36076 2.16626 -172.30642 567.69874
6490.0000 -177.61277 -172.50381 5.10896 2.18294 -172.02055 547.34747
6495.0000 -176.99964 -171.36142 5.63822 2.19153 -171.87322 567.60477
6500.0000 -177.68581 -172.43282 5.25299 2.19743 -171.77210 581.39563
FREEZING PROCESS: loop number 27 T-loop= 511.00000000000000
main_MD> interactions number 27 at Temperature= 511.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.84605 1.54170 5.24308
force_rgl> df(natom) -3.53376 -6.18228 0.00068
6505.0000 -177.26242 -172.22142 5.04101 2.16070 -172.40183 554.86993
6510.0000 -178.50045 -174.28386 4.21659 2.09711 -173.49223 518.03770
6515.0000 -178.83030 -174.61731 4.21299 2.06248 -174.08603 478.26075
6520.0000 -177.95298 -173.46448 4.48849 2.07280 -173.90896 498.61396
6525.0000 -177.99830 -173.33775 4.66055 2.11210 -173.23519 520.67761
6530.0000 -178.09678 -173.55546 4.54132 2.09146 -173.58907 505.98710
6535.0000 -177.89850 -173.87290 4.02559 2.10632 -173.33432 525.14073
6540.0000 -178.64263 -174.37945 4.26317 2.06315 -174.07440 495.91107
6545.0000 -178.25825 -174.21445 4.04380 2.05798 -174.16308 506.75315
6550.0000 -179.40401 -174.99758 4.40643 2.03536 -174.55097 490.56601
6555.0000 -179.63739 -175.25520 4.38219 2.00389 -175.09062 460.05934
6560.0000 -179.14494 -174.21247 4.93247 2.03162 -174.61517 485.92767
6565.0000 -178.34906 -173.32547 5.02358 2.09656 -173.50166 539.83088
6570.0000 -178.23535 -173.21433 5.02102 2.10003 -173.44209 529.65543
6575.0000 -177.65177 -173.32582 4.32595 2.08934 -173.62539 503.22038
6580.0000 -177.46168 -172.54330 4.91838 2.13583 -172.82826 539.98607
6585.0000 -177.49462 -172.76668 4.72794 2.14788 -172.62172 534.51692
6590.0000 -177.27713 -172.46443 4.81270 2.15351 -172.52507 549.61067
6595.0000 -179.65387 -174.92258 4.73129 2.08569 -173.68800 500.42240
6600.0000 -178.94381 -174.54904 4.39477 2.03784 -174.50840 498.81570
6605.0000 -178.87298 -174.35551 4.51747 2.04669 -174.35672 502.24056
6610.0000 -179.16694 -173.99592 5.17102 2.04674 -174.35587 499.67814
6615.0000 -177.52070 -172.93010 4.59061 2.10225 -173.40406 541.64497
6620.0000 -178.11657 -173.06688 5.04969 2.15558 -172.48971 559.83497
6625.0000 -179.06863 -173.36546 5.70317 2.10904 -173.28763 543.59527
6630.0000 -177.96757 -172.89249 5.07508 2.11105 -173.25314 537.70278
6635.0000 -178.77684 -173.26490 5.51194 2.09339 -173.55604 530.98857
6640.0000 -178.26702 -173.29038 4.97664 2.09189 -173.58174 555.84374
6645.0000 -178.79315 -174.18742 4.60573 2.08640 -173.67576 546.02416
6650.0000 -178.46820 -173.20932 5.25888 2.08584 -173.68538 529.28581
6655.0000 -178.68378 -174.01256 4.67122 2.06992 -173.95832 504.73559
6660.0000 -179.23430 -175.23814 3.99616 2.04134 -174.44838 491.76561
6665.0000 -179.48720 -174.04034 5.44686 2.03447 -174.56617 492.76755
6670.0000 -179.57752 -174.96017 4.61736 2.03914 -174.48622 503.25773
6675.0000 -178.25533 -173.91021 4.34512 2.02970 -174.64795 501.40303
6680.0000 -179.38304 -174.64834 4.73470 2.04334 -174.41410 514.23210
6685.0000 -178.84595 -174.34573 4.50022 2.04403 -174.40227 488.10898
6690.0000 -178.18319 -173.55487 4.62832 2.06283 -174.07987 509.27027
6695.0000 -178.67408 -173.67019 5.00388 2.08476 -173.70386 507.03126
6700.0000 -179.20482 -174.17118 5.03364 2.06233 -174.08853 524.51013
6705.0000 -179.25177 -174.80151 4.45026 2.04313 -174.41767 514.00208
6710.0000 -180.47419 -175.43060 5.04359 2.00255 -175.11355 485.68497
6715.0000 -179.63308 -174.62072 5.01236 2.02359 -174.75284 511.60535
6720.0000 -179.39290 -174.81176 4.58114 2.01335 -174.92833 500.13934
6725.0000 -179.57293 -174.80278 4.77015 2.01564 -174.88902 487.69463
6730.0000 -179.24862 -174.99105 4.25757 2.00915 -175.00034 486.53962
6735.0000 -178.85071 -174.74060 4.11011 1.99820 -175.18815 482.74470
6740.0000 -180.21879 -174.98249 5.23630 2.00441 -175.08159 494.05807
6745.0000 -179.41573 -174.66356 4.75217 2.00356 -175.09613 490.29743
6750.0000 -179.99169 -175.25609 4.73560 2.02283 -174.76589 487.03819
FREEZING PROCESS: loop number 28 T-loop= 486.00000000000000
main_MD> interactions number 28 at Temperature= 486.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.77560 1.83941 0.59350
force_rgl> df(natom) 1.60792 -2.28292 1.53995
6755.0000 -179.96404 -174.81657 5.14748 1.98279 -175.45238 474.88107
6760.0000 -179.51242 -175.05494 4.45748 1.99097 -175.31211 480.66178
6765.0000 -179.84708 -175.76851 4.07857 1.99253 -175.28540 462.63274
6770.0000 -179.69795 -175.66035 4.03760 1.96499 -175.75753 458.63160
6775.0000 -179.64661 -174.74396 4.90265 1.99786 -175.19400 493.68646
6780.0000 -179.09613 -174.36046 4.73567 2.01070 -174.97375 496.09004
6785.0000 -179.45511 -174.15298 5.30214 2.03876 -174.49260 523.90188
6790.0000 -179.31668 -174.96781 4.34887 2.04740 -174.34444 541.18170
6795.0000 -179.18904 -175.13456 4.05448 1.98438 -175.42502 489.00247
6800.0000 -180.47305 -176.37265 4.10040 1.95129 -175.99240 447.59714
6805.0000 -179.31063 -174.23545 5.07518 1.98992 -175.33015 487.55019
6810.0000 -179.76017 -174.89004 4.87013 2.02020 -174.81083 513.65042
6815.0000 -180.05589 -176.17335 3.88255 1.98632 -175.39178 473.40642
6820.0000 -178.99711 -174.37638 4.62073 1.97859 -175.52437 469.31442
6825.0000 -179.13821 -174.49099 4.64722 2.02728 -174.68942 503.38692
6830.0000 -178.96218 -174.66940 4.29277 2.02472 -174.73347 484.85955
6835.0000 -179.30974 -175.21295 4.09679 2.00741 -175.03014 476.45656
6840.0000 -180.64042 -176.04225 4.59817 1.97565 -175.57474 451.09776
6845.0000 -179.60661 -175.00836 4.59825 1.97556 -175.57629 449.82414
6850.0000 -178.69069 -174.57804 4.11265 2.02127 -174.79255 482.01684
6855.0000 -179.16168 -174.49038 4.67130 2.05832 -174.15732 500.09051
6860.0000 -179.67938 -174.50982 5.16956 2.03837 -174.49929 493.76213
6865.0000 -178.74621 -174.32015 4.42606 2.04123 -174.45023 504.16378
6870.0000 -179.47071 -174.63012 4.84060 2.02564 -174.71762 495.44673
6875.0000 -179.63511 -174.54664 5.08846 2.03242 -174.60134 499.54404
6880.0000 -179.45987 -175.59053 3.86934 2.01016 -174.98310 488.70154
6885.0000 -178.82869 -174.75605 4.07264 2.03211 -174.60670 489.04805
6890.0000 -179.54118 -174.18853 5.35265 2.02584 -174.71415 505.33399
6895.0000 -179.13711 -174.29491 4.84220 2.05622 -174.19329 528.69633
6900.0000 -180.00646 -175.72452 4.28195 2.02508 -174.72717 502.83364
6905.0000 -178.79138 -174.87597 3.91541 2.00083 -175.14311 463.25996
6910.0000 -179.99536 -175.82777 4.16760 1.99484 -175.24576 475.58091
6915.0000 -179.55273 -175.13152 4.42121 1.98819 -175.35977 475.52675
6920.0000 -179.48868 -175.66169 3.82699 2.01595 -174.88383 493.82279
6925.0000 -180.04976 -175.59334 4.45642 1.95344 -175.95565 441.58808
6930.0000 -180.29712 -176.81891 3.47821 1.94670 -176.07109 444.52773
6935.0000 -179.91286 -175.91249 4.00037 1.93898 -176.20357 441.22917
6940.0000 -180.50453 -175.51491 4.98962 1.97522 -175.58212 472.47965
6945.0000 -179.44938 -175.63596 3.81342 1.97464 -175.59215 482.72431
6950.0000 -180.18217 -175.52503 4.65714 1.97441 -175.59601 480.14924
6955.0000 -180.16710 -175.64611 4.52098 1.99391 -175.26176 486.82341
6960.0000 -179.78904 -175.32940 4.45964 1.97872 -175.52214 479.40784
6965.0000 -180.65087 -175.72920 4.92168 1.98921 -175.34224 484.85270
6970.0000 -180.19868 -175.96283 4.23585 1.96735 -175.71703 464.61486
6975.0000 -179.86360 -175.91512 3.94848 1.94400 -176.11748 443.67716
6980.0000 -180.08853 -176.00245 4.08608 1.99014 -175.32640 484.93403
6985.0000 -180.67417 -176.61785 4.05632 1.93751 -176.22880 434.54111
6990.0000 -179.21903 -175.52403 3.69500 1.95205 -175.97950 450.52031
6995.0000 -180.11722 -175.83269 4.28453 1.96483 -175.76035 454.29230
7000.0000 -180.07318 -175.16649 4.90669 1.97554 -175.57673 467.26842
FREEZING PROCESS: loop number 29 T-loop= 461.00000000000000
main_MD> interactions number 29 at Temperature= 461.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.04532 0.22418 -0.89846
force_rgl> df(natom) -1.40008 1.97621 0.71113
7005.0000 -179.14557 -175.49345 3.65212 2.00516 -175.06886 478.50595
7010.0000 -180.13610 -176.09865 4.03745 1.95192 -175.98160 437.74957
7015.0000 -179.53774 -175.28514 4.25261 1.98031 -175.49483 465.28049
7020.0000 -179.78801 -175.34652 4.44149 2.03737 -174.51642 487.45898
7025.0000 -179.43795 -175.63277 3.80518 1.97360 -175.60993 450.44017
7030.0000 -179.59387 -175.01285 4.58102 1.97244 -175.62979 422.70377
7035.0000 -179.47473 -175.23798 4.23675 1.99315 -175.27469 474.77619
7040.0000 -179.18517 -175.05652 4.12865 2.00286 -175.10827 476.55642
7045.0000 -179.74890 -175.94761 3.80129 1.98575 -175.40164 463.79591
7050.0000 -179.38161 -176.03893 3.34268 1.94775 -176.05317 433.86679
7055.0000 -179.09607 -175.19303 3.90303 1.97904 -175.51666 458.73143
7060.0000 -180.57891 -175.97929 4.59962 1.95779 -175.88107 447.49116
7065.0000 -180.23353 -176.12839 4.10514 1.92985 -176.36002 428.54778
7070.0000 -179.33870 -175.54241 3.79629 1.97501 -175.58579 459.87967
7075.0000 -179.23798 -175.29310 3.94488 1.98856 -175.35343 469.70797
7080.0000 -179.96050 -175.66276 4.29774 1.98912 -175.34380 465.56147
7085.0000 -180.26415 -176.07583 4.18832 1.93601 -176.25444 425.31250
7090.0000 -179.27871 -175.68588 3.59283 1.93479 -176.27533 422.48696
7095.0000 -180.26871 -175.49338 4.77534 1.99507 -175.24172 474.95344
7100.0000 -178.53142 -174.13313 4.39829 2.01680 -174.86923 487.80731
7105.0000 -178.68236 -173.90433 4.77803 2.07392 -173.88986 528.79658
7110.0000 -179.05792 -174.28967 4.76825 2.04659 -174.35846 516.95658
7115.0000 -179.59991 -174.19229 5.40761 2.05504 -174.21359 519.12780
7120.0000 -179.55206 -174.52182 5.03024 2.04993 -174.30113 515.89739
7125.0000 -179.49168 -174.67419 4.81749 2.03229 -174.60363 523.31410
7130.0000 -179.42362 -174.50500 4.91862 2.00358 -175.09581 492.36040
7135.0000 -179.80079 -175.12150 4.67929 2.02249 -174.77162 508.06122
7140.0000 -180.39137 -175.99944 4.39192 1.98242 -175.45870 467.01516
7145.0000 -180.52891 -176.43606 4.09285 1.95541 -175.92179 453.07844
7150.0000 -179.94629 -176.44382 3.50247 1.93900 -176.20324 436.39867
7155.0000 -180.26864 -175.45880 4.80985 1.94984 -176.01735 450.59731
7160.0000 -179.80617 -175.50979 4.29637 1.97735 -175.54568 461.29827
7165.0000 -179.95662 -176.15719 3.79942 1.93656 -176.24510 422.90961
7170.0000 -180.24949 -175.93081 4.31868 1.94903 -176.03119 449.72716
7175.0000 -179.47658 -175.30611 4.17048 1.97478 -175.58967 461.32753
7180.0000 -179.13358 -174.92183 4.21175 2.00509 -175.06991 484.04599
7185.0000 -178.82212 -174.68946 4.13266 1.99737 -175.20234 480.30008
7190.0000 -179.93595 -175.07526 4.86069 2.03489 -174.55904 491.23711
7195.0000 -179.23251 -174.94686 4.28565 2.02694 -174.69537 479.38496
7200.0000 -179.71649 -175.78794 3.92856 1.99200 -175.29445 451.55182
7205.0000 -179.10074 -175.57517 3.52557 1.97360 -175.60991 441.28062
7210.0000 -179.55338 -175.30252 4.25086 1.97497 -175.58645 434.14693
7215.0000 -178.62043 -173.60913 5.01130 2.03004 -174.64221 472.08761
7220.0000 -178.15749 -173.43755 4.71995 2.09126 -173.59242 518.60343
7225.0000 -178.90506 -174.68261 4.22245 2.05309 -174.24694 492.53248
7230.0000 -179.41515 -175.50668 3.90847 1.99999 -175.15743 442.43407
7235.0000 -179.64995 -174.95426 4.69569 1.99098 -175.31197 446.10526
7240.0000 -178.90122 -174.43925 4.46197 2.00101 -175.13998 464.64912
7245.0000 -178.87957 -174.83813 4.04144 2.03308 -174.59010 496.97438
7250.0000 -179.38061 -174.57499 4.80562 2.03706 -174.52179 477.51929
FREEZING PROCESS: loop number 30 T-loop= 436.00000000000000
main_MD> interactions number 30 at Temperature= 436.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.86458 1.88904 -0.37988
force_rgl> df(natom) 3.92173 -1.71502 -2.04233
7255.0000 -179.68361 -175.46809 4.21552 2.01873 -174.83615 456.07437
7260.0000 -179.04774 -174.87464 4.17310 2.00479 -175.07516 454.93711
7265.0000 -179.49824 -175.38939 4.10885 1.99891 -175.17599 454.66130
7270.0000 -178.98991 -174.66823 4.32168 2.01000 -174.98578 467.08224
7275.0000 -178.94025 -175.08033 3.85991 2.00775 -175.02437 475.71320
7280.0000 -179.62691 -175.22038 4.40652 2.00265 -175.11186 459.92638
7285.0000 -180.41753 -176.94049 3.47704 1.94161 -176.15839 419.27336
7290.0000 -180.00068 -176.74900 3.25168 1.88657 -177.10216 382.81270
7295.0000 -180.32830 -176.09138 4.23692 1.91605 -176.59669 417.06663
7300.0000 -180.01254 -176.61769 3.39485 1.92571 -176.43106 422.34096
7305.0000 -180.35170 -176.61836 3.73334 1.90945 -176.70993 400.52678
7310.0000 -180.23873 -175.56799 4.67074 1.95186 -175.98263 428.94179
7315.0000 -179.90503 -175.46688 4.43815 1.98707 -175.37889 471.58583
7320.0000 -180.39935 -176.88944 3.50991 1.94470 -176.10544 438.04023
7325.0000 -180.24719 -177.10994 3.13725 1.90903 -176.71711 409.43759
7330.0000 -180.38412 -177.53624 2.84788 1.88647 -177.10395 378.42508
7335.0000 -180.35010 -176.62436 3.72574 1.85532 -177.63800 362.67946
7340.0000 -180.06182 -176.17740 3.88442 1.91426 -176.62740 403.45200
7345.0000 -179.90998 -176.08340 3.82658 1.94540 -176.09349 430.37768
7350.0000 -179.75258 -175.79716 3.95542 1.94613 -176.08086 429.94931
7355.0000 -179.76474 -175.70816 4.05658 1.96761 -175.71261 449.71113
7360.0000 -180.37192 -176.37695 3.99496 1.94406 -176.11646 435.15191
7365.0000 -180.43390 -176.69594 3.73796 1.91721 -176.57683 406.44843
7370.0000 -179.76796 -176.62704 3.14092 1.90768 -176.74016 391.01639
7375.0000 -180.31465 -177.23582 3.07883 1.90999 -176.70061 393.34869
7380.0000 -180.33991 -175.71185 4.62806 1.93855 -176.21090 419.32241
7385.0000 -180.45167 -176.18862 4.26305 1.95689 -175.89644 430.31975
7390.0000 -180.46465 -176.27816 4.18649 1.91541 -176.60765 405.14875
7395.0000 -180.30081 -175.86781 4.43300 1.96273 -175.79637 441.72719
7400.0000 -179.75383 -175.90469 3.84914 1.95940 -175.85331 436.33338
7405.0000 -179.29998 -175.70172 3.59827 1.98883 -175.34885 446.43440
7410.0000 -179.92779 -176.07875 3.84904 1.97255 -175.62784 437.31552
7415.0000 -179.49821 -176.07528 3.42293 1.94667 -176.07166 433.62622
7420.0000 -180.34560 -177.23933 3.10627 1.90467 -176.79175 397.48889
7425.0000 -179.80689 -176.33884 3.46805 1.92113 -176.50952 406.42032
7430.0000 -180.24449 -176.05221 4.19228 1.96126 -175.82154 443.69563
7435.0000 -179.89547 -174.89195 5.00352 1.95985 -175.84575 433.57167
7440.0000 -178.81849 -174.56122 4.25727 2.01068 -174.97412 467.15598
7445.0000 -178.87622 -174.97695 3.89927 2.00895 -175.00384 469.49459
7450.0000 -179.48269 -175.51673 3.96596 2.00713 -175.03493 460.10595
7455.0000 -178.80909 -174.53421 4.27488 2.02023 -174.81045 480.48846
7460.0000 -179.44931 -175.55568 3.89363 1.97797 -175.53501 410.00854
7465.0000 -180.10148 -175.74339 4.35809 1.96483 -175.76035 420.17932
7470.0000 -179.50682 -176.07838 3.42844 1.94056 -176.17636 400.63920
7475.0000 -179.68771 -175.86124 3.82647 1.94001 -176.18583 398.54536
7480.0000 -178.85494 -174.93468 3.92027 1.98450 -175.42304 440.90373
7485.0000 -179.50729 -175.60443 3.90286 1.97050 -175.66302 455.65756
7490.0000 -179.55010 -175.68522 3.86488 1.96907 -175.68757 451.67928
7495.0000 -180.47514 -176.71055 3.76459 1.92632 -176.42064 420.39932
7500.0000 -180.48143 -176.58538 3.89605 1.91796 -176.56402 407.46132
FREEZING PROCESS: loop number 31 T-loop= 411.00000000000000
main_MD> interactions number 31 at Temperature= 411.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.41234 -1.20210 -1.64768
force_rgl> df(natom) -0.22421 0.19609 0.33910
7505.0000 -180.12532 -176.18803 3.93729 1.92397 -176.46090 402.09428
7510.0000 -179.92838 -176.35640 3.57198 1.92733 -176.40335 412.78892
7515.0000 -180.21885 -175.99156 4.22730 1.93984 -176.18872 419.25101
7520.0000 -179.99495 -176.52657 3.46838 1.92397 -176.46083 434.34270
7525.0000 -180.04192 -176.32415 3.71777 1.93605 -176.25375 441.23985
7530.0000 -180.58468 -176.45329 4.13139 1.94433 -176.11176 446.68187
7535.0000 -180.52908 -176.79973 3.72934 1.90391 -176.80488 404.70925
7540.0000 -179.70177 -175.46325 4.23852 1.94071 -176.17378 437.59115
7545.0000 -179.63461 -175.51481 4.11980 1.94350 -176.12611 436.43823
7550.0000 -179.71761 -175.13590 4.58171 1.98402 -175.43128 458.69050
7555.0000 -179.90717 -176.21653 3.69063 1.96422 -175.77068 461.24517
7560.0000 -180.30314 -176.62352 3.67962 1.92069 -176.51721 424.44101
7565.0000 -180.44070 -176.92223 3.51848 1.87749 -177.25793 393.11325
7570.0000 -179.72792 -175.66996 4.05796 1.92217 -176.49177 424.57667
7575.0000 -180.55016 -176.38854 4.16162 1.94175 -176.15598 447.20990
7580.0000 -180.43460 -176.19096 4.24365 1.92272 -176.48230 427.74987
7585.0000 -181.29744 -178.08472 3.21272 1.87896 -177.23268 385.52002
7590.0000 -181.19821 -177.50694 3.69127 1.85056 -177.71967 358.63136
7595.0000 -180.51381 -176.75254 3.76127 1.87177 -177.35599 379.44587
7600.0000 -180.82628 -177.20217 3.62411 1.88965 -177.04940 396.50780
7605.0000 -180.95608 -177.42761 3.52848 1.88432 -177.14071 396.64540
7610.0000 -180.72853 -177.52118 3.20735 1.84574 -177.80227 360.11046
7615.0000 -180.54884 -176.58844 3.96040 1.90383 -176.80617 413.12903
7620.0000 -180.82726 -176.59076 4.23650 1.90051 -176.86321 410.36835
7625.0000 -180.71297 -176.34219 4.37078 1.91685 -176.58292 423.57835
7630.0000 -179.86389 -176.51468 3.34921 1.92982 -176.36055 420.38853
7635.0000 -180.46511 -176.83913 3.62597 1.90424 -176.79913 386.45187
7640.0000 -179.70814 -175.97725 3.73089 1.93963 -176.19236 414.27470
7645.0000 -180.85093 -177.13408 3.71685 1.93504 -176.27105 425.59725
7650.0000 -180.36312 -176.85710 3.50603 1.91557 -176.60497 426.03732
7655.0000 -180.42293 -176.22800 4.19492 1.92301 -176.47728 429.52761
7660.0000 -180.90163 -176.40114 4.50049 1.92407 -176.45924 425.47165
7665.0000 -179.96650 -175.41781 4.54869 1.96944 -175.68124 469.20552
7670.0000 -180.40045 -176.26390 4.13655 1.93155 -176.33095 422.04573
7675.0000 -180.15607 -176.13213 4.02394 1.93100 -176.34033 421.93070
7680.0000 -180.80451 -176.78353 4.02098 1.93216 -176.32041 422.10243
7685.0000 -180.76690 -176.93129 3.83560 1.89463 -176.96404 395.75182
7690.0000 -180.76184 -177.25904 3.50280 1.88200 -177.18060 383.79026
7695.0000 -181.42648 -177.29609 4.13040 1.89721 -176.91975 393.12930
7700.0000 -180.44638 -176.34075 4.10564 1.89009 -177.04178 392.32501
7705.0000 -180.02890 -176.52866 3.50024 1.91146 -176.67542 421.84531
7710.0000 -180.22269 -176.29161 3.93109 1.94833 -176.04313 445.54241
7715.0000 -181.45944 -177.45284 4.00660 1.89037 -177.03694 433.22145
7720.0000 -182.15756 -177.52380 4.63376 1.86590 -177.45661 432.15499
7725.0000 -181.88717 -177.94780 3.93938 1.81469 -178.33462 388.56480
7730.0000 -182.06942 -178.19154 3.87788 1.83378 -178.00730 403.81181
7735.0000 -182.06877 -177.56688 4.50189 1.85450 -177.65206 421.29994
7740.0000 -181.34738 -177.67628 3.67110 1.83914 -177.91534 407.07983
7745.0000 -182.07592 -178.55908 3.51684 1.83870 -177.92295 406.73492
7750.0000 -181.37876 -178.24675 3.13200 1.80272 -178.53982 377.82914
FREEZING PROCESS: loop number 32 T-loop= 386.00000000000000
main_MD> interactions number 32 at Temperature= 386.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.05763 2.09231 2.22496
force_rgl> df(natom) -0.10940 0.23808 2.11081
7755.0000 -181.63051 -177.72943 3.90108 1.81695 -178.29589 387.86557
7760.0000 -182.24565 -178.66564 3.58001 1.83288 -178.02284 405.13560
7765.0000 -181.28711 -178.21146 3.07565 1.80867 -178.43779 382.26436
7770.0000 -182.09845 -178.04720 4.05124 1.84072 -177.88839 411.06278
7775.0000 -182.25742 -178.30805 3.94937 1.81469 -178.33462 387.94669
7780.0000 -181.88889 -179.07308 2.81581 1.82291 -178.19367 392.23088
7785.0000 -181.89738 -178.39161 3.50577 1.80545 -178.49312 377.72902
7790.0000 -182.09426 -178.84596 3.24829 1.79279 -178.71008 367.38964
7795.0000 -181.93527 -178.87705 3.05822 1.77706 -178.97992 352.48719
7800.0000 -182.02313 -178.91554 3.10759 1.79959 -178.59364 377.37318
7805.0000 -182.54722 -178.46610 4.08112 1.79737 -178.63167 371.98992
7810.0000 -182.11734 -178.16741 3.94993 1.79689 -178.63991 374.11672
7815.0000 -181.94895 -178.59787 3.35108 1.80279 -178.53863 378.16923
7820.0000 -182.15369 -178.50327 3.65042 1.80098 -178.56973 376.93375
7825.0000 -181.82860 -177.72584 4.10276 1.83116 -178.05230 399.60386
7830.0000 -181.81066 -178.28473 3.52593 1.83508 -177.98506 408.34003
7835.0000 -181.71216 -178.09332 3.61884 1.84418 -177.82901 410.06853
7840.0000 -181.54648 -177.76972 3.77677 1.83316 -178.01792 403.15222
7845.0000 -181.76053 -178.09915 3.66138 1.83221 -178.03419 398.63250
7850.0000 -182.43503 -179.58042 2.85461 1.78948 -178.76684 367.69433
7855.0000 -181.25719 -177.45738 3.79981 1.78860 -178.78205 368.20518
7860.0000 -182.12971 -178.12178 4.00792 1.86612 -177.45279 431.64409
7865.0000 -181.83089 -178.19147 3.63942 1.82368 -178.18057 392.33240
7870.0000 -182.35184 -178.23998 4.11186 1.78881 -178.77847 366.74773
7875.0000 -181.06822 -178.03608 3.03214 1.81500 -178.32940 388.99819
7880.0000 -181.82025 -178.26509 3.55516 1.82358 -178.18218 394.14139
7885.0000 -182.82082 -179.73902 3.08181 1.79839 -178.61421 368.27290
7890.0000 -182.29943 -178.90798 3.39145 1.77931 -178.94124 357.56390
7895.0000 -181.77131 -178.29364 3.47767 1.78730 -178.80423 364.97707
7900.0000 -182.02359 -178.22943 3.79415 1.81985 -178.24625 390.55434
7905.0000 -181.55201 -177.73669 3.81531 1.84962 -177.73572 413.78024
7910.0000 -181.99107 -178.25996 3.73111 1.82301 -178.19192 397.65539
7915.0000 -182.37279 -178.34180 4.03099 1.80258 -178.54235 378.36273
7920.0000 -181.53141 -177.56815 3.96327 1.82243 -178.20191 391.25450
7925.0000 -181.88267 -178.61368 3.26899 1.81595 -178.31298 392.06813
7930.0000 -181.73651 -178.48561 3.25090 1.78553 -178.83460 363.16612
7935.0000 -181.24451 -177.52244 3.72207 1.85271 -177.68277 417.81262
7940.0000 -181.93669 -178.73415 3.20254 1.83590 -177.97091 406.27075
7945.0000 -182.52972 -178.98732 3.54240 1.77128 -179.07891 349.68667
7950.0000 -181.61671 -177.73617 3.88054 1.80471 -178.50585 378.86972
7955.0000 -180.95580 -177.50129 3.45451 1.86023 -177.55381 427.84618
7960.0000 -181.06745 -177.31343 3.75402 1.86592 -177.45625 432.46859
7965.0000 -182.17250 -178.58531 3.58719 1.83673 -177.95671 407.54284
7970.0000 -182.50184 -179.27065 3.23120 1.78991 -178.75950 366.27254
7975.0000 -182.07905 -178.32216 3.75689 1.80764 -178.45559 379.20866
7980.0000 -181.74751 -178.59747 3.15004 1.81370 -178.35161 389.44088
7985.0000 -182.17695 -178.33238 3.84457 1.81135 -178.39189 384.88417
7990.0000 -181.81354 -178.35018 3.46336 1.82003 -178.24304 393.05516
7995.0000 -181.84398 -178.30383 3.54015 1.80771 -178.45427 379.78181
8000.0000 -181.97465 -178.17317 3.80149 1.80606 -178.48254 381.84295
FREEZING PROCESS: loop number 33 T-loop= 361.00000000000000
main_MD> interactions number 33 at Temperature= 361.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.65436 -3.58932 3.47509
force_rgl> df(natom) -1.32858 0.23491 -1.65640
8005.0000 -182.00970 -178.32668 3.68302 1.82888 -178.09133 397.25575
8010.0000 -183.01099 -179.48497 3.52602 1.78477 -178.84761 359.34004
8015.0000 -182.21788 -179.01102 3.20686 1.76052 -179.26346 341.03569
8020.0000 -182.26709 -178.93468 3.33241 1.77598 -178.99841 353.20026
8025.0000 -182.36644 -178.63281 3.73362 1.79017 -178.75510 367.76233
8030.0000 -182.30654 -179.18215 3.12439 1.79059 -178.74793 367.49669
8035.0000 -182.66430 -179.56520 3.09910 1.75732 -179.31839 338.48401
8040.0000 -182.04412 -179.21660 2.82753 1.77674 -178.98540 358.64598
8045.0000 -182.29028 -178.39490 3.89538 1.79424 -178.68535 374.63286
8050.0000 -182.33760 -179.48969 2.84791 1.78966 -178.76378 369.63831
8055.0000 -182.60279 -179.48836 3.11443 1.74119 -179.59493 327.20858
8060.0000 -182.10276 -179.32194 2.78082 1.74275 -179.56825 327.84996
8065.0000 -182.47201 -179.37600 3.09601 1.75862 -179.29602 337.69702
8070.0000 -182.03360 -178.72819 3.30541 1.77953 -178.93743 363.97187
8075.0000 -182.76110 -179.31106 3.45004 1.75778 -179.31040 339.95095
8080.0000 -182.55695 -178.94967 3.60728 1.77010 -179.09929 350.22900
8085.0000 -182.63679 -179.70771 2.92908 1.73528 -179.69626 319.57204
8090.0000 -182.09573 -179.28475 2.81098 1.75443 -179.36791 335.51212
8095.0000 -182.93483 -179.70854 3.22629 1.72900 -179.80385 311.43448
8100.0000 -182.81401 -179.49430 3.31971 1.73143 -179.76227 316.09485
8105.0000 -182.46167 -178.95151 3.51016 1.76645 -179.16180 346.39148
8110.0000 -182.37247 -179.53779 2.83468 1.76399 -179.20402 345.93411
8115.0000 -182.60291 -179.40993 3.19298 1.75814 -179.30423 340.91973
8120.0000 -181.99320 -179.03507 2.95813 1.77767 -178.96938 361.11071
8125.0000 -182.24604 -179.13934 3.10671 1.75978 -179.27612 338.85549
8130.0000 -182.07888 -178.39038 3.68849 1.79220 -178.72023 370.27330
8135.0000 -182.28118 -179.04502 3.23616 1.79535 -178.66625 370.36725
8140.0000 -182.46107 -179.56553 2.89554 1.74674 -179.49970 327.29532
8145.0000 -182.30524 -179.20176 3.10348 1.75835 -179.30063 337.79881
8150.0000 -182.40020 -179.28495 3.11525 1.75159 -179.41655 332.68513
8155.0000 -181.58034 -178.21583 3.36451 1.79049 -178.74956 366.75056
8160.0000 -181.84212 -178.73041 3.11171 1.80404 -178.51725 379.66443
8165.0000 -181.12810 -177.57650 3.55160 1.80896 -178.43297 380.61957
8170.0000 -182.39629 -178.54277 3.85351 1.82801 -178.10622 400.58020
8175.0000 -181.97526 -178.84110 3.13416 1.78091 -178.91386 359.29251
8180.0000 -182.48258 -179.28566 3.19692 1.78777 -178.79616 365.57903
8185.0000 -182.24568 -179.74562 2.50006 1.75107 -179.42547 333.53773
8190.0000 -182.32554 -179.22298 3.10256 1.76429 -179.19880 347.57280
8195.0000 -182.17507 -179.04797 3.12710 1.75280 -179.39587 336.39890
8200.0000 -182.40793 -178.83682 3.57111 1.77951 -178.93784 356.26299
8205.0000 -182.39783 -178.81110 3.58673 1.79840 -178.61401 372.81249
8210.0000 -181.54724 -178.39619 3.15105 1.81779 -178.28145 389.91180
8215.0000 -182.06817 -178.81852 3.24965 1.80911 -178.43029 384.74968
8220.0000 -182.16980 -178.84753 3.32227 1.79057 -178.74827 365.70687
8225.0000 -181.86587 -178.25979 3.60608 1.80735 -178.46047 382.77489
8230.0000 -182.11970 -178.91310 3.20660 1.78471 -178.84866 359.89996
8235.0000 -182.42085 -178.93514 3.48571 1.78586 -178.82907 364.15074
8240.0000 -182.06170 -178.88695 3.17476 1.77493 -179.01635 352.02557
8245.0000 -182.08861 -179.12534 2.96327 1.75383 -179.37813 334.95615
8250.0000 -182.24201 -178.66115 3.58086 1.76726 -179.14792 345.21523
FREEZING PROCESS: loop number 34 T-loop= 336.00000000000000
main_MD> interactions number 34 at Temperature= 336.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.60971 0.14075 -2.29873
force_rgl> df(natom) -0.94637 1.08310 1.29799
8255.0000 -182.35253 -179.29542 3.05711 1.76958 -179.10807 346.88746
8260.0000 -182.78372 -179.95980 2.82392 1.74061 -179.60485 326.97569
8265.0000 -182.55789 -179.57297 2.98492 1.74115 -179.59561 326.04419
8270.0000 -182.63598 -179.30302 3.33297 1.74194 -179.58199 325.17937
8275.0000 -182.05167 -178.91181 3.13986 1.75289 -179.39422 334.59597
8280.0000 -182.28656 -178.77743 3.50913 1.77034 -179.09502 355.26796
8285.0000 -182.65639 -179.35756 3.29883 1.76469 -179.19192 347.52854
8290.0000 -182.17517 -180.02074 2.15443 1.73715 -179.66413 317.99564
8295.0000 -182.82497 -179.49873 3.32624 1.72723 -179.83434 311.29666
8300.0000 -182.54378 -179.20825 3.33553 1.73995 -179.61621 323.87044
8305.0000 -182.53616 -179.85367 2.68249 1.74624 -179.50833 327.41418
8310.0000 -182.51788 -179.31396 3.20392 1.74026 -179.61089 322.71348
8315.0000 -182.83276 -179.52610 3.30665 1.74994 -179.44488 333.31602
8320.0000 -182.07030 -178.95206 3.11824 1.76360 -179.21074 344.29222
8325.0000 -182.51130 -179.49221 3.01909 1.76073 -179.25995 341.04909
8330.0000 -182.28137 -179.23957 3.04180 1.75948 -179.28135 339.01227
8335.0000 -182.65979 -179.69361 2.96619 1.72508 -179.87117 309.45477
8340.0000 -181.98252 -178.60120 3.38132 1.78174 -178.89967 359.95038
8345.0000 -182.14064 -178.75290 3.38774 1.79463 -178.67867 368.55063
8350.0000 -182.43278 -179.38289 3.04989 1.78069 -178.91766 357.69185
8355.0000 -182.33031 -179.30363 3.02667 1.75483 -179.36097 335.51593
8360.0000 -182.08554 -178.53648 3.54906 1.77019 -179.09767 347.92455
8365.0000 -182.43984 -179.20688 3.23296 1.77530 -179.01010 353.29102
8370.0000 -181.83992 -178.80219 3.03773 1.78076 -178.91637 360.13388
8375.0000 -182.17062 -178.62208 3.54854 1.78630 -178.82147 362.62238
8380.0000 -182.62811 -179.03554 3.59257 1.78670 -178.81462 365.37987
8385.0000 -182.25727 -178.75165 3.50561 1.77674 -178.98530 353.04980
8390.0000 -181.80408 -178.31060 3.49348 1.80938 -178.42566 381.07918
8395.0000 -182.61663 -179.29228 3.32436 1.78114 -178.90991 356.76469
8400.0000 -182.51838 -179.37586 3.14252 1.76296 -179.22162 344.53023
8405.0000 -182.72555 -179.34687 3.37868 1.74301 -179.56365 326.06218
8410.0000 -182.15443 -178.90350 3.25093 1.78348 -178.86974 361.42626
8415.0000 -182.54921 -179.68228 2.86693 1.75894 -179.29059 342.97482
8420.0000 -182.28595 -179.31791 2.96804 1.77546 -179.00735 355.28406
8425.0000 -182.48925 -179.69569 2.79356 1.74565 -179.51836 327.29347
8430.0000 -182.72768 -179.47699 3.25070 1.72220 -179.92058 308.73152
8435.0000 -182.44500 -179.08137 3.36363 1.75269 -179.39780 335.18764
8440.0000 -182.29719 -179.66145 2.63574 1.76230 -179.23287 343.11807
8445.0000 -182.39475 -179.24198 3.15277 1.76074 -179.25973 341.55362
8450.0000 -182.37434 -179.13288 3.24146 1.74986 -179.44619 328.03909
8455.0000 -182.73317 -179.77931 2.95386 1.74364 -179.55297 325.47960
8460.0000 -182.74736 -179.67307 3.07429 1.74210 -179.57925 322.34416
8465.0000 -182.20138 -178.85827 3.34311 1.76738 -179.14583 347.51880
8470.0000 -182.06205 -178.77309 3.28895 1.78318 -178.87492 359.65821
8475.0000 -182.22887 -179.25184 2.97703 1.74844 -179.47053 332.72908
8480.0000 -182.94894 -179.66436 3.28458 1.74151 -179.58949 324.73870
8485.0000 -182.39718 -178.93265 3.46453 1.77008 -179.09953 350.04464
8490.0000 -182.36585 -179.04608 3.31977 1.76082 -179.25825 343.12588
8495.0000 -182.63596 -179.95804 2.67792 1.75473 -179.36274 336.62446
8500.0000 -182.79867 -179.77652 3.02215 1.72749 -179.82983 313.79927
FREEZING PROCESS: loop number 35 T-loop= 311.00000000000000
main_MD> interactions number 35 at Temperature= 311.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.07885 0.62014 3.92636
force_rgl> df(natom) -2.07777 0.00942 -2.56417
8505.0000 -183.07878 -180.17357 2.90521 1.71128 -180.10774 298.91596
8510.0000 -183.41866 -180.93569 2.48297 1.70068 -180.28950 287.77440
8515.0000 -183.09908 -180.81156 2.28752 1.68377 -180.57953 273.06639
8520.0000 -182.65535 -179.89187 2.76348 1.69505 -180.38599 285.08691
8525.0000 -182.41583 -179.63886 2.77697 1.71653 -180.01774 303.67751
8530.0000 -183.01929 -180.19042 2.82887 1.72674 -179.84267 309.64993
8535.0000 -182.63654 -180.02698 2.60956 1.70667 -180.18680 293.35686
8540.0000 -182.64557 -179.69922 2.94635 1.71863 -179.98176 304.62526
8545.0000 -182.68624 -179.12365 3.56258 1.74455 -179.53738 326.68776
8550.0000 -182.63621 -179.16865 3.46756 1.76106 -179.25424 342.80296
8555.0000 -182.42562 -179.56373 2.86189 1.73854 -179.64034 323.47707
8560.0000 -182.58101 -179.58061 3.00041 1.75174 -179.41397 339.02177
8565.0000 -182.44546 -179.24639 3.19907 1.75246 -179.40168 337.63347
8570.0000 -182.86542 -179.32393 3.54149 1.77884 -178.94929 356.44703
8575.0000 -182.16853 -179.52256 2.64597 1.74161 -179.58764 322.49364
8580.0000 -182.30369 -179.52189 2.78179 1.74253 -179.57187 325.16521
8585.0000 -182.91957 -180.01471 2.90485 1.71916 -179.97257 303.06658
8590.0000 -182.97106 -180.12918 2.84189 1.71231 -180.09008 299.49959
8595.0000 -182.63752 -179.97624 2.66128 1.72710 -179.83646 310.21698
8600.0000 -182.50943 -179.30945 3.19997 1.73846 -179.64169 322.71297
8605.0000 -182.70542 -179.82133 2.88410 1.73855 -179.64017 323.32076
8610.0000 -182.25431 -179.19281 3.06149 1.74240 -179.57408 323.13074
8615.0000 -182.33008 -179.08496 3.24512 1.76023 -179.26837 340.56057
8620.0000 -182.44504 -179.17048 3.27456 1.76837 -179.12886 346.88523
8625.0000 -181.97341 -179.24260 2.73081 1.76340 -179.21408 342.62074
8630.0000 -182.67726 -179.21549 3.46177 1.76365 -179.20973 344.34302
8635.0000 -182.62023 -179.61560 3.00463 1.74558 -179.51967 335.56229
8640.0000 -182.79763 -180.01245 2.78518 1.73475 -179.70530 318.25106
8645.0000 -182.66646 -179.90112 2.76534 1.70969 -180.13504 294.47538
8650.0000 -182.63877 -179.68458 2.95419 1.73203 -179.75191 316.01501
8655.0000 -183.18865 -179.86392 3.32473 1.72193 -179.92508 310.00245
8660.0000 -182.58285 -179.24920 3.33366 1.73083 -179.77247 314.56856
8665.0000 -182.83242 -179.49406 3.33836 1.74265 -179.56990 324.04990
8670.0000 -182.49677 -179.34646 3.15032 1.75353 -179.38340 332.48491
8675.0000 -183.29308 -180.76736 2.52572 1.71944 -179.96782 303.77196
8680.0000 -183.26024 -180.84391 2.41632 1.68269 -180.59805 270.73257
8685.0000 -182.61555 -180.18923 2.42632 1.69503 -180.38638 285.63553
8690.0000 -182.89743 -180.11657 2.78087 1.69561 -180.37639 286.69885
8695.0000 -182.09865 -179.22712 2.87153 1.74445 -179.53902 328.01880
8700.0000 -182.14092 -179.34142 2.79950 1.74104 -179.59748 322.94000
8705.0000 -182.90133 -179.57995 3.32138 1.74569 -179.51774 327.87947
8710.0000 -182.14921 -179.37146 2.77774 1.74172 -179.58584 325.01699
8715.0000 -182.22747 -179.42832 2.79915 1.75718 -179.32076 338.40812
8720.0000 -183.03365 -179.83366 3.19999 1.73673 -179.67134 318.84733
8725.0000 -182.63322 -179.35880 3.27442 1.75230 -179.40440 332.58172
8730.0000 -182.61043 -180.06202 2.54841 1.73257 -179.74264 314.18713
8735.0000 -182.98661 -180.37772 2.60889 1.70803 -180.16347 296.41339
8740.0000 -183.07675 -180.11123 2.96552 1.70706 -180.18006 293.28685
8745.0000 -182.59851 -179.35819 3.24032 1.74912 -179.45897 330.99202
8750.0000 -182.37389 -179.68819 2.68570 1.74814 -179.47567 329.31141
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 15 [min], 14.0830060 [s].
main_MD> Deallocating global variables
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