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nanoparticlesims/growth_Melting_Silver_ICO_4091/freezeSims/run_64/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_64.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 = 64 ntipo2 = 0
read_input> Finish reading input
main_MD> Allocating global variables
main_MD> Number of outputs that will be created: 1600
main_MD> Size of nv and nvoiz: 64 6400
main_MD> Size of nv and nvoiz: 64 6400
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 = 64
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> 0.17022212909137835 3.0981904954082040E-002 -0.10368760997908311 initial drift of cluster / NP1 for coalescence
init> 0.32177870744400838 0.32865415578512330 0.26591908822157195 scaling for velocity /for coalescence NP1
init.f90 > facguy = 3.5899096217263411E-003
preparo> IN BIGVOI : LIMIT 1.2247448652052084 1.2247448652052084 1.2247448652052084
preparo> END t=0 TIME STEP
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.90913 -2.76035 0.03210
force_rgl> df(natom) -1.59218 1.50598 1.37228
preparo> THERMALIZATION PROCESS AT 1117.9801019712550
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -142.71468599301764 7.9852442720204273 -150.69993026503806 6.1688438910441736E-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 32
FREEZING PROCESS: loop number 1 T-loop= 1093.0000000000000
main_MD> interactions number 1 at Temperature= 1093.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.83685 4.61421 -0.32617
force_rgl> df(natom) -1.44208 -0.99670 -1.52937
5.0000 -151.82817 -143.80510 8.02308 2.82353 -143.62357 1006.61266
10.0000 -151.03242 -142.31211 8.72031 2.86552 -142.95164 1054.63354
15.0000 -152.25648 -143.16750 9.08898 2.89784 -142.43450 1050.24279
20.0000 -151.88959 -143.07149 8.81810 2.88050 -142.71207 1061.89548
25.0000 -151.03798 -143.40282 7.63516 2.86919 -142.89291 1055.89251
30.0000 -151.18437 -143.51111 7.67327 2.81440 -143.76952 994.30284
35.0000 -146.46659 -138.30785 8.15874 2.95358 -141.54275 1097.52803
40.0000 -150.51586 -142.15249 8.36337 3.05499 -139.92011 1200.61537
45.0000 -150.85493 -140.80519 10.04974 2.95144 -141.57699 1129.22660
50.0000 -152.01402 -141.64394 10.37009 2.89258 -142.51867 1053.57458
55.0000 -151.15836 -142.38226 8.77610 2.97433 -141.21080 1148.93184
60.0000 -152.25370 -143.81636 8.43734 2.84230 -143.32321 1047.96568
65.0000 -153.54072 -144.85118 8.68955 2.76735 -144.52246 998.23391
70.0000 -152.74206 -145.26890 7.47316 2.75316 -144.74947 981.13350
75.0000 -150.56980 -142.73970 7.83010 2.84366 -143.30146 1041.10217
80.0000 -149.78167 -140.84470 8.93697 2.91146 -142.21671 1084.94501
85.0000 -149.66378 -140.53475 9.12903 2.98619 -141.02090 1154.36835
90.0000 -150.27239 -142.74865 7.52373 2.96342 -141.38534 1111.64521
95.0000 -149.77890 -139.02120 10.75769 2.98957 -140.96685 1173.88107
100.0000 -150.48355 -140.69002 9.79353 3.08954 -139.36740 1219.46718
105.0000 -149.63528 -138.46004 11.17524 3.08351 -139.46383 1228.72642
110.0000 -148.20351 -137.03244 11.17106 3.14089 -138.54572 1222.12894
115.0000 -151.54013 -142.06563 9.47449 3.04941 -140.00938 1219.14351
120.0000 -150.34551 -141.88370 8.46181 2.95533 -141.51467 1136.97502
125.0000 -151.25438 -142.08980 9.16458 2.91083 -142.22671 1080.89222
130.0000 -150.54140 -142.28131 8.26008 2.89058 -142.55066 1051.57051
135.0000 -151.01851 -142.26952 8.74899 2.91372 -142.18047 1073.98108
140.0000 -151.85970 -143.12353 8.73617 2.86846 -142.90471 1099.17801
145.0000 -152.12483 -141.28432 10.84051 2.88348 -142.66427 1095.27123
150.0000 -149.52166 -140.00368 9.51798 3.01464 -140.56573 1181.83749
155.0000 -151.07954 -140.36107 10.71847 3.06835 -139.70637 1194.74226
160.0000 -150.05079 -139.61898 10.43181 3.08339 -139.46577 1237.83122
165.0000 -151.01536 -140.91056 10.10480 3.02066 -140.46944 1186.24484
170.0000 -150.49531 -141.35952 9.13579 2.97841 -141.14539 1157.35308
175.0000 -152.24031 -142.23056 10.00975 2.96528 -141.35554 1159.03021
180.0000 -152.79086 -141.92775 10.86312 2.88222 -142.68447 1080.55590
185.0000 -152.26143 -142.33916 9.92227 2.88158 -142.69467 1091.29323
190.0000 -150.69339 -142.07136 8.62204 2.88713 -142.60586 1092.44148
195.0000 -151.10102 -141.46586 9.63516 2.93385 -141.85836 1099.22266
200.0000 -149.28734 -139.03284 10.25449 2.98593 -141.02513 1126.60023
205.0000 -150.43349 -140.73626 9.69723 3.00642 -140.69721 1148.92587
210.0000 -152.10119 -141.73847 10.36272 2.93131 -141.89903 1111.56593
215.0000 -149.63088 -141.91540 7.71549 2.93400 -141.85593 1086.11451
220.0000 -150.51648 -141.20907 9.30741 2.94771 -141.63669 1138.65715
225.0000 -150.28797 -140.59447 9.69350 3.01373 -140.58032 1165.96024
230.0000 -150.40092 -141.03771 9.36322 3.01786 -140.51427 1131.74700
235.0000 -148.73149 -140.54448 8.18701 2.98667 -141.01322 1144.41758
240.0000 -149.84709 -139.85528 9.99181 3.06177 -139.81175 1176.85115
245.0000 -150.73948 -142.17364 8.56584 2.92572 -141.98854 1053.71095
250.0000 -150.71731 -142.58961 8.12770 2.96202 -141.40765 1097.95211
FREEZING PROCESS: loop number 2 T-loop= 1068.0000000000000
main_MD> interactions number 2 at Temperature= 1068.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.18401 -0.98435 3.90284
force_rgl> df(natom) 0.50980 1.78775 0.36102
255.0000 -151.23105 -142.02422 9.20683 2.89902 -142.41563 1082.65603
260.0000 -153.21712 -144.57854 8.63858 2.80206 -143.96711 1003.77869
265.0000 -153.05151 -142.90031 10.15120 2.83301 -143.47181 1033.57614
270.0000 -151.37097 -143.14115 8.22982 2.89298 -142.51228 1102.13405
275.0000 -151.06515 -143.14406 7.92109 2.86322 -142.98852 1068.18109
280.0000 -152.87903 -143.86410 9.01493 2.84454 -143.28738 1037.74825
285.0000 -151.59809 -143.57062 8.02747 2.83429 -143.45135 1006.99793
290.0000 -152.54302 -144.06980 8.47321 2.79278 -144.11556 1015.94611
295.0000 -151.57748 -143.43859 8.13889 2.80854 -143.86341 992.78383
300.0000 -152.10766 -142.02165 10.08601 2.98741 -141.00139 1130.72833
305.0000 -151.70152 -143.74564 7.95587 2.88742 -142.60129 1063.97640
310.0000 -151.38008 -141.07715 10.30293 2.88456 -142.64706 1077.60707
315.0000 -149.68572 -140.26466 9.42106 2.99981 -140.80298 1161.16974
320.0000 -152.04108 -142.86009 9.18100 2.99000 -140.96001 1159.29183
325.0000 -152.02167 -143.50358 8.51808 2.83191 -143.48950 1051.20258
330.0000 -151.70911 -143.37372 8.33539 2.86718 -142.92517 1075.49891
335.0000 -151.93177 -142.25963 9.67213 2.85088 -143.18591 1060.61918
340.0000 -152.53447 -142.18417 10.35030 2.90694 -142.28902 1095.53267
345.0000 -151.95079 -143.75344 8.19735 2.86616 -142.94138 1062.69422
350.0000 -152.29508 -143.84952 8.44556 2.82194 -143.64889 988.11592
355.0000 -153.59754 -144.10723 9.49031 2.84205 -143.32721 1049.58689
360.0000 -150.18545 -142.68805 7.49740 2.90149 -142.37617 1088.83396
365.0000 -151.49880 -142.16531 9.33350 2.90305 -142.35115 1076.81779
370.0000 -150.58998 -140.26053 10.32945 3.04020 -140.15685 1176.32905
375.0000 -151.77820 -141.47082 10.30738 3.02257 -140.43889 1172.76653
380.0000 -149.86250 -139.88551 9.97699 2.97860 -141.14239 1134.52098
385.0000 -148.90546 -140.15688 8.74858 3.01946 -140.48857 1174.86602
390.0000 -151.98355 -142.36574 9.61781 2.94848 -141.62437 1132.33535
395.0000 -150.74754 -142.61283 8.13470 2.90385 -142.33845 1074.81076
400.0000 -150.92717 -141.03878 9.88840 2.95260 -141.55844 1134.44717
405.0000 -153.45516 -143.91333 9.54182 2.85147 -143.17642 1054.10601
410.0000 -151.04810 -142.28375 8.76435 2.91683 -142.13075 1102.08303
415.0000 -151.60223 -140.66950 10.93273 2.98204 -141.08732 1153.68081
420.0000 -148.98912 -139.22091 9.76821 3.11926 -138.89187 1264.23276
425.0000 -152.83914 -141.04772 11.79142 3.06031 -139.83501 1165.99516
430.0000 -150.41225 -141.62935 8.78290 2.93026 -141.91584 1127.14665
435.0000 -151.39756 -141.67449 9.72307 2.93775 -141.79593 1119.98085
440.0000 -152.28958 -144.12675 8.16283 2.91546 -142.15266 1109.63702
445.0000 -151.73597 -143.85877 7.87720 2.78460 -144.24647 1000.32650
450.0000 -151.32422 -141.48757 9.83665 2.84470 -143.28473 1027.76604
455.0000 -152.13030 -142.66441 9.46589 2.95267 -141.55725 1147.77906
460.0000 -152.29850 -142.09481 10.20369 2.92075 -142.06798 1088.48204
465.0000 -151.84850 -143.44769 8.40081 2.88898 -142.57629 1049.45423
470.0000 -149.73516 -142.58469 7.15047 2.92218 -142.04514 1084.45579
475.0000 -152.15665 -143.56942 8.58724 2.84080 -143.34716 1053.27263
480.0000 -149.74079 -143.00474 6.73605 2.80828 -143.86758 1003.15151
485.0000 -153.96875 -143.82511 10.14364 2.87350 -142.82406 1060.49124
490.0000 -153.77693 -144.19603 9.58089 2.74568 -144.86911 1009.62918
495.0000 -150.88893 -141.52519 9.36373 2.90057 -142.39085 1076.30677
500.0000 -152.78162 -141.86370 10.91792 2.95911 -141.45419 1127.75321
FREEZING PROCESS: loop number 3 T-loop= 1043.0000000000000
main_MD> interactions number 3 at Temperature= 1043.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.05802 -2.64680 -3.03379
force_rgl> df(natom) 3.01949 0.97244 -2.16034
505.0000 -151.60752 -143.59993 8.00759 2.87655 -142.77527 1071.15958
510.0000 -152.15264 -143.49148 8.66116 2.80447 -143.92851 1032.45576
515.0000 -153.78502 -145.87976 7.90525 2.74556 -144.87101 984.59014
520.0000 -151.55585 -143.48308 8.07277 2.68490 -145.84156 932.34423
525.0000 -153.07139 -143.18074 9.89065 2.81222 -143.80449 994.89958
530.0000 -151.54330 -142.73807 8.80523 2.86179 -143.01133 1060.06946
535.0000 -151.39188 -142.59703 8.79485 2.87821 -142.74869 1051.05100
540.0000 -151.06085 -141.50453 9.55632 2.91762 -142.11802 1082.17694
545.0000 -151.47855 -141.96122 9.51733 2.99218 -140.92505 1153.21019
550.0000 -152.35074 -143.02135 9.32939 2.87132 -142.85886 1102.32749
555.0000 -152.25409 -142.97355 9.28054 2.80992 -143.84125 1039.05431
560.0000 -152.37377 -141.74990 10.62387 2.89819 -142.42895 1100.42562
565.0000 -151.34750 -143.11731 8.23019 2.81039 -143.83371 995.05641
570.0000 -150.59544 -141.67632 8.91912 2.91027 -142.23560 1104.25758
575.0000 -149.23545 -139.70730 9.52815 2.96839 -141.30582 1113.34230
580.0000 -149.09120 -140.52871 8.56250 3.11133 -139.01866 1219.82202
585.0000 -151.05131 -142.19665 8.85466 2.93690 -141.80952 1075.60523
590.0000 -152.69813 -143.80763 8.89050 2.94873 -141.62029 1107.13576
595.0000 -152.13562 -141.94474 10.19088 2.84521 -143.27659 1047.94804
600.0000 -151.25684 -142.74368 8.51317 2.90154 -142.37541 1074.97485
605.0000 -152.36763 -143.51483 8.85280 2.87875 -142.73998 1063.20228
610.0000 -152.69843 -145.21363 7.48480 2.79313 -144.10994 996.54643
615.0000 -152.81718 -144.15777 8.65942 2.73438 -145.04986 968.74027
620.0000 -150.87606 -142.76772 8.10834 2.80576 -143.90784 996.12596
625.0000 -152.23530 -144.01636 8.21894 2.89173 -142.53238 1082.38559
630.0000 -152.24730 -142.64034 9.60697 2.78730 -144.20320 1011.08017
635.0000 -150.73940 -142.77000 7.96940 2.86900 -142.89598 1066.95338
640.0000 -152.43046 -143.96677 8.46369 2.86554 -142.95142 1067.57149
645.0000 -152.25059 -143.81361 8.43697 2.84743 -143.24116 1070.32561
650.0000 -153.29379 -144.97481 8.31899 2.77933 -144.33071 982.43794
655.0000 -152.77245 -144.08671 8.68573 2.79540 -144.07359 1028.71689
660.0000 -150.68499 -143.06204 7.62295 2.79315 -144.10964 1002.67770
665.0000 -151.04808 -142.99354 8.05454 2.86061 -143.03019 1063.78842
670.0000 -151.32584 -142.28263 9.04320 2.93942 -141.76931 1123.47724
675.0000 -152.72404 -143.63248 9.09155 2.90152 -142.37560 1083.75598
680.0000 -150.77594 -142.08848 8.68746 2.89180 -142.53115 1090.54391
685.0000 -152.48389 -143.75593 8.72796 2.87522 -142.79642 1087.76874
690.0000 -152.47036 -144.83772 7.63264 2.86208 -143.00666 1055.53082
695.0000 -153.30038 -143.99583 9.30456 2.77562 -144.39000 988.00527
700.0000 -152.01028 -145.20592 6.80436 2.76136 -144.61817 986.23645
705.0000 -152.77696 -144.58875 8.18821 2.78542 -144.23323 1031.41898
710.0000 -150.99655 -143.12388 7.87267 2.77440 -144.40960 990.22089
715.0000 -152.16786 -143.93104 8.23682 2.89131 -142.53904 1075.77624
720.0000 -152.10515 -142.21281 9.89234 2.86930 -142.89119 1047.72587
725.0000 -148.49139 -139.20746 9.28393 2.99832 -140.82693 1091.02236
730.0000 -149.81781 -140.30548 9.51233 3.02910 -140.33446 1149.91984
735.0000 -149.68793 -140.65625 9.03168 3.01727 -140.52366 1145.75349
740.0000 -151.51729 -142.59566 8.92162 2.93136 -141.89819 1128.29319
745.0000 -153.51550 -144.90583 8.60967 2.87983 -142.72272 1076.09297
750.0000 -152.04594 -143.96631 8.07963 2.79918 -144.01317 1022.76541
FREEZING PROCESS: loop number 4 T-loop= 1018.0000000000000
main_MD> interactions number 4 at Temperature= 1018.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.39588 -3.76513 -2.07865
force_rgl> df(natom) -0.82892 2.29019 5.69012
755.0000 -152.76987 -144.17222 8.59765 2.78567 -144.22934 972.22775
760.0000 -152.36130 -143.40912 8.95218 2.78623 -144.22033 999.22194
765.0000 -151.48214 -141.90869 9.57345 2.89407 -142.49493 1087.15827
770.0000 -151.53898 -143.14379 8.39519 2.92004 -142.07935 1089.30960
775.0000 -151.05803 -143.23841 7.81962 2.88863 -142.58191 1063.19687
780.0000 -151.19845 -142.38921 8.80924 2.92428 -142.01154 1102.28889
785.0000 -152.26734 -144.79290 7.47444 2.81272 -143.79654 1052.62826
790.0000 -152.95607 -144.82190 8.13417 2.76442 -144.56924 990.40075
795.0000 -151.93009 -143.29813 8.63196 2.78440 -144.24959 1015.34313
800.0000 -153.09291 -144.55436 8.53855 2.81607 -143.74294 1018.46512
805.0000 -152.26231 -142.72595 9.53636 2.78175 -144.29201 997.80122
810.0000 -153.82386 -144.99917 8.82469 2.78387 -144.25814 1017.15554
815.0000 -154.64725 -145.03562 9.61163 2.70425 -145.53195 985.49344
820.0000 -153.07351 -144.65060 8.42291 2.76209 -144.60650 1003.01402
825.0000 -152.09318 -144.02585 8.06734 2.77449 -144.40815 979.79624
830.0000 -152.23073 -144.56142 7.66931 2.78505 -144.23928 991.98277
835.0000 -152.17769 -143.20489 8.97279 2.82181 -143.65097 1049.81970
840.0000 -152.76573 -142.87295 9.89278 2.84566 -143.26952 1025.06891
845.0000 -150.86776 -140.85041 10.01736 2.93862 -141.78212 1101.65950
850.0000 -150.97175 -143.61093 7.36082 2.92764 -141.95768 1105.35397
855.0000 -151.76231 -144.64479 7.11753 2.76605 -144.54316 999.53616
860.0000 -151.97020 -142.65567 9.31453 2.87872 -142.74042 1085.00536
865.0000 -152.50381 -143.41162 9.09219 2.86786 -142.91421 1080.15885
870.0000 -152.28755 -143.77284 8.51472 2.78989 -144.16169 1005.30791
875.0000 -152.09478 -142.54397 9.55081 2.85702 -143.08763 1048.97669
880.0000 -150.29492 -143.45341 6.84152 2.87434 -142.81053 1058.49881
885.0000 -150.08815 -141.92377 8.16438 2.94189 -141.72971 1162.56810
890.0000 -151.53875 -141.19011 10.34864 2.95885 -141.45834 1100.86014
895.0000 -152.97010 -144.77988 8.19022 2.80860 -143.86237 1010.81899
900.0000 -151.95949 -144.65721 7.30228 2.72099 -145.26415 946.52642
905.0000 -151.86262 -144.11788 7.74474 2.79144 -144.13703 1043.45867
910.0000 -152.11881 -143.58283 8.53598 2.79775 -144.03595 1052.31491
915.0000 -151.29025 -141.79438 9.49587 2.84797 -143.23255 1059.49524
920.0000 -152.06124 -142.51999 9.54125 2.91946 -142.08872 1093.66531
925.0000 -151.14756 -141.89025 9.25731 2.90672 -142.29243 1110.45160
930.0000 -151.45758 -142.43345 9.02413 2.93999 -141.76021 1101.17527
935.0000 -151.04664 -141.82521 9.22143 2.94674 -141.65218 1103.24959
940.0000 -152.68602 -144.65727 8.02875 2.84623 -143.26029 1037.71849
945.0000 -151.56626 -141.99640 9.56986 2.82928 -143.53148 1039.83713
950.0000 -152.81530 -144.72779 8.08751 2.80158 -143.97465 1046.71903
955.0000 -150.58333 -143.08847 7.49485 2.78464 -144.24575 1013.72755
960.0000 -151.36201 -142.82737 8.53464 2.87948 -142.72837 1064.74171
965.0000 -151.80841 -143.08283 8.72558 2.85523 -143.11638 1099.73755
970.0000 -152.05034 -142.92780 9.12254 2.89499 -142.48018 1089.39786
975.0000 -151.77134 -143.58063 8.19071 2.82843 -143.54506 1028.37455
980.0000 -153.28717 -145.00186 8.28531 2.75405 -144.73524 981.46875
985.0000 -151.97055 -142.94318 9.02737 2.82996 -143.52067 1020.43303
990.0000 -152.62646 -145.96135 6.66511 2.79140 -144.13766 991.52741
995.0000 -155.16547 -148.03473 7.13074 2.60483 -147.12267 882.63540
1000.0000 -151.94331 -144.26294 7.68037 2.61167 -147.01323 919.88251
FREEZING PROCESS: loop number 5 T-loop= 993.00000000000000
main_MD> interactions number 5 at Temperature= 993.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.85565 2.15826 3.40015
force_rgl> df(natom) 2.25007 2.85731 0.35971
1005.0000 -150.97352 -141.78255 9.19097 2.90728 -142.28350 1081.89396
1010.0000 -152.69287 -142.89934 9.79353 2.88349 -142.66410 1058.96430
1015.0000 -152.08008 -143.66347 8.41661 2.82926 -143.53189 1030.59530
1020.0000 -150.57953 -143.59960 6.97993 2.78999 -144.16013 1010.94302
1025.0000 -151.65033 -143.54087 8.10946 2.77186 -144.45032 952.41550
1030.0000 -151.78069 -143.41486 8.36583 2.86592 -142.94522 1077.43483
1035.0000 -152.42369 -142.22289 10.20080 2.90603 -142.30349 1082.58774
1040.0000 -153.91775 -144.15953 9.75822 2.84317 -143.30935 1054.38871
1045.0000 -153.13386 -144.32761 8.80625 2.71965 -145.28555 966.62000
1050.0000 -152.46856 -144.25784 8.21072 2.78145 -144.29685 997.65700
1055.0000 -154.20831 -145.76842 8.43988 2.74253 -144.91953 980.44956
1060.0000 -151.35579 -142.90392 8.45186 2.79104 -144.14329 1013.46737
1065.0000 -150.79967 -142.17250 8.62716 2.92763 -141.95795 1110.65560
1070.0000 -152.75858 -144.02960 8.72898 2.88692 -142.60932 1066.23606
1075.0000 -152.46623 -144.93812 7.52811 2.68132 -145.89887 955.02936
1080.0000 -151.41893 -143.27792 8.14100 2.76045 -144.63275 1008.52153
1085.0000 -153.14706 -145.77939 7.36767 2.74273 -144.91628 981.79831
1090.0000 -152.12528 -143.93895 8.18633 2.80356 -143.94302 1052.76235
1095.0000 -153.73883 -146.15373 7.58510 2.77549 -144.39220 1003.43239
1100.0000 -154.27062 -145.84771 8.42291 2.69940 -145.60952 954.59277
1105.0000 -154.11724 -146.17587 7.94137 2.65156 -146.37505 911.27501
1110.0000 -154.33596 -145.84751 8.48846 2.65700 -146.28804 919.78712
1115.0000 -153.12357 -146.27929 6.84428 2.63409 -146.65461 931.91695
1120.0000 -154.84596 -145.46030 9.38566 2.73312 -145.07014 983.99775
1125.0000 -152.00817 -144.13465 7.87352 2.82007 -143.67889 1026.72841
1130.0000 -152.81729 -145.02914 7.78815 2.76391 -144.57751 995.88213
1135.0000 -152.82700 -146.05417 6.77283 2.68853 -145.78355 930.14166
1140.0000 -151.80682 -144.04622 7.76060 2.67249 -146.04014 953.22944
1145.0000 -151.24800 -143.48171 7.76629 2.78458 -144.24668 1001.06028
1150.0000 -153.21904 -144.74637 8.47267 2.79451 -144.08788 1015.61690
1155.0000 -153.05442 -143.14674 9.90768 2.83128 -143.49954 1061.29009
1160.0000 -153.90340 -146.10139 7.80201 2.74168 -144.93315 1011.22789
1165.0000 -154.29858 -146.84359 7.45499 2.64232 -146.52289 925.88430
1170.0000 -152.06872 -144.22985 7.83887 2.71054 -145.43137 937.72472
1175.0000 -152.38338 -144.71026 7.67312 2.74255 -144.91914 974.56284
1180.0000 -153.14769 -144.03004 9.11765 2.77803 -144.35157 995.33701
1185.0000 -151.17823 -144.20757 6.97066 2.79575 -144.06806 997.05251
1190.0000 -152.69836 -143.85121 8.84716 2.74409 -144.89451 957.62333
1195.0000 -153.49745 -145.58753 7.90992 2.75923 -144.65230 968.23766
1200.0000 -152.75271 -145.84593 6.90677 2.69579 -145.66741 912.79865
1205.0000 -151.55324 -142.78193 8.77132 2.77545 -144.39281 980.91803
1210.0000 -154.02317 -144.96851 9.05466 2.80420 -143.93277 1023.73241
1215.0000 -153.75322 -145.97559 7.77764 2.75625 -144.70006 1005.52682
1220.0000 -152.78548 -144.79633 7.98914 2.70042 -145.59328 965.23855
1225.0000 -151.43705 -142.20005 9.23700 2.81211 -143.80621 1055.56241
1230.0000 -152.24415 -143.01384 9.23031 2.88648 -142.61632 1068.87631
1235.0000 -153.19201 -144.30230 8.88970 2.80307 -143.95087 1011.96598
1240.0000 -151.79799 -142.81421 8.98378 2.81862 -143.70203 1043.50481
1245.0000 -151.96831 -144.34314 7.62518 2.83274 -143.47621 1033.07267
1250.0000 -153.25239 -146.12757 7.12482 2.70683 -145.49079 911.93720
FREEZING PROCESS: loop number 6 T-loop= 968.00000000000000
main_MD> interactions number 6 at Temperature= 968.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.74590 4.16103 1.83626
force_rgl> df(natom) 1.27075 -0.81015 -3.69417
1255.0000 -153.72497 -146.87308 6.85189 2.61479 -146.96334 905.07637
1260.0000 -152.65058 -144.34300 8.30757 2.72025 -145.27607 919.81665
1265.0000 -152.52347 -144.19147 8.33200 2.81802 -143.71167 1017.03441
1270.0000 -150.36711 -142.99018 7.37694 2.77485 -144.40236 1005.03688
1275.0000 -152.34647 -143.95293 8.39353 2.85637 -143.09801 1037.36980
1280.0000 -152.93007 -143.26008 9.66999 2.81740 -143.72160 995.01862
1285.0000 -152.32298 -145.41726 6.90572 2.79496 -144.08059 989.91666
1290.0000 -152.72408 -145.28616 7.43792 2.80343 -143.94514 1039.19209
1295.0000 -153.32105 -145.67092 7.65012 2.70908 -145.45469 930.86448
1300.0000 -152.43865 -144.66755 7.77110 2.73293 -145.07313 957.27797
1305.0000 -153.67611 -145.38826 8.28785 2.79234 -144.12258 1036.10769
1310.0000 -151.13335 -142.26290 8.87045 2.78173 -144.29230 980.42329
1315.0000 -151.95973 -144.39994 7.55979 2.89289 -142.51383 1075.26094
1320.0000 -153.43529 -144.26243 9.17286 2.83780 -143.39523 1042.95653
1325.0000 -153.41948 -145.29164 8.12784 2.72695 -145.16882 928.29076
1330.0000 -153.96264 -146.80025 7.16239 2.66583 -146.14666 897.42483
1335.0000 -154.16655 -147.07016 7.09639 2.62936 -146.73022 892.84358
1340.0000 -152.40123 -144.58803 7.81320 2.68688 -145.80998 919.45404
1345.0000 -152.38730 -143.25658 9.13072 2.80583 -143.90676 1025.35610
1350.0000 -153.35054 -145.25253 8.09801 2.73792 -144.99328 989.22539
1355.0000 -153.84315 -146.71156 7.13159 2.65434 -146.33054 916.47986
1360.0000 -154.82572 -146.56805 8.25767 2.62323 -146.82836 924.02124
1365.0000 -154.75721 -146.24042 8.51679 2.65148 -146.37626 918.72750
1370.0000 -153.93334 -145.23463 8.69871 2.67251 -146.03988 912.23902
1375.0000 -153.88109 -146.24335 7.63774 2.73044 -145.11301 981.56528
1380.0000 -154.00462 -144.91797 9.08665 2.74958 -144.80668 978.97111
1385.0000 -152.72526 -144.97491 7.75035 2.72319 -145.22903 963.56340
1390.0000 -153.22423 -145.11044 8.11379 2.73678 -145.01147 975.66914
1395.0000 -154.61194 -146.37393 8.23801 2.69561 -145.67018 962.83467
1400.0000 -154.92623 -147.65929 7.26693 2.64401 -146.49577 952.25908
1405.0000 -153.59626 -144.26509 9.33116 2.66494 -146.16096 952.92180
1410.0000 -151.93412 -143.58752 8.34661 2.77144 -144.45698 1016.40163
1415.0000 -152.67081 -143.47879 9.19202 2.74852 -144.82369 978.78252
1420.0000 -152.96640 -144.52269 8.44372 2.81819 -143.70899 1037.03252
1425.0000 -154.88904 -146.00604 8.88299 2.72190 -145.24968 981.76618
1430.0000 -153.49969 -146.85578 6.64391 2.67127 -146.05971 924.32569
1435.0000 -152.92536 -145.09033 7.83504 2.66412 -146.17412 887.63046
1440.0000 -152.49002 -143.89444 8.59558 2.83291 -143.47349 1060.64406
1445.0000 -153.45408 -146.70051 6.75357 2.69528 -145.67556 961.67431
1450.0000 -153.44226 -145.36003 8.08223 2.65385 -146.33836 966.77778
1455.0000 -153.25954 -145.60854 7.65101 2.71154 -145.41531 970.94838
1460.0000 -152.83628 -143.64705 9.18924 2.72315 -145.22959 960.26558
1465.0000 -152.82650 -144.37419 8.45231 2.81407 -143.77495 1036.61225
1470.0000 -154.40414 -147.13698 7.26716 2.72623 -145.18036 974.01590
1475.0000 -153.19570 -145.07611 8.11959 2.73173 -145.09238 959.22986
1480.0000 -154.88313 -145.00990 9.87323 2.74794 -144.83303 963.55774
1485.0000 -154.19057 -148.04300 6.14756 2.72508 -145.19879 994.15619
1490.0000 -153.15460 -145.17062 7.98398 2.59056 -147.35103 864.36970
1495.0000 -152.73707 -144.93969 7.79738 2.70972 -145.44452 946.45101
1500.0000 -152.80926 -145.29860 7.51066 2.76076 -144.62788 975.12875
FREEZING PROCESS: loop number 7 T-loop= 943.00000000000000
main_MD> interactions number 7 at Temperature= 943.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.85118 -0.46060 -0.67854
force_rgl> df(natom) 0.70532 -0.46171 -1.92872
1505.0000 -153.35612 -144.99379 8.36233 2.73776 -144.99585 956.89930
1510.0000 -153.66131 -146.93301 6.72831 2.71857 -145.30284 955.56408
1515.0000 -154.37697 -147.74881 6.62816 2.60562 -147.11003 870.30156
1520.0000 -152.34100 -143.72845 8.61254 2.75466 -144.72549 968.05415
1525.0000 -153.04266 -146.29631 6.74635 2.70871 -145.46058 950.39800
1530.0000 -153.56468 -145.74977 7.81491 2.67067 -146.06924 898.01111
1535.0000 -152.28496 -145.35883 6.92613 2.75263 -144.75789 954.02159
1540.0000 -151.92692 -144.84342 7.08350 2.70243 -145.56117 954.80688
1545.0000 -154.17127 -145.69698 8.47429 2.72233 -145.24269 958.74051
1550.0000 -152.20707 -143.68087 8.52620 2.77820 -144.34884 999.23820
1555.0000 -153.19218 -146.51744 6.67474 2.75022 -144.79640 998.64732
1560.0000 -155.31136 -148.77460 6.53676 2.58170 -147.49277 835.47703
1565.0000 -152.87299 -144.54545 8.32753 2.64463 -146.48597 904.57247
1570.0000 -153.20174 -145.25810 7.94364 2.77314 -144.42978 1025.37718
1575.0000 -154.62800 -148.12368 6.50432 2.66346 -146.18458 926.16744
1580.0000 -152.55082 -144.91095 7.63987 2.63311 -146.67030 880.94601
1585.0000 -153.27593 -145.14840 8.12753 2.66222 -146.20454 949.63691
1590.0000 -153.19537 -143.95325 9.24212 2.77490 -144.40154 999.95627
1595.0000 -154.16974 -145.36778 8.80196 2.77742 -144.36134 974.28029
1600.0000 -153.23892 -143.90696 9.33196 2.78854 -144.18336 995.67995
1605.0000 -153.55648 -145.81848 7.73800 2.76729 -144.52333 991.77613
1610.0000 -150.00242 -140.84675 9.15567 2.81854 -143.70335 1004.91905
1615.0000 -151.36287 -141.99796 9.36491 2.96252 -141.39963 1126.05936
1620.0000 -154.68661 -147.38606 7.30055 2.78915 -144.17364 993.03248
1625.0000 -153.36864 -145.77129 7.59735 2.71682 -145.33087 934.70625
1630.0000 -152.41099 -144.35387 8.05712 2.74849 -144.82420 986.70408
1635.0000 -153.36933 -146.82460 6.54474 2.72756 -145.15908 937.66486
1640.0000 -154.34513 -145.85813 8.48700 2.63847 -146.58447 886.70601
1645.0000 -151.49301 -143.48581 8.00720 2.72219 -145.24501 951.90887
1650.0000 -152.79219 -144.27453 8.51766 2.80042 -143.99334 1011.60547
1655.0000 -150.93824 -142.90044 8.03780 2.82003 -143.67950 1020.82908
1660.0000 -152.09383 -145.72147 6.37236 2.76211 -144.60630 984.59334
1665.0000 -154.02073 -146.43009 7.59064 2.66774 -146.11620 905.42151
1670.0000 -154.22285 -146.67690 7.54594 2.61512 -146.95805 871.26476
1675.0000 -153.17983 -144.84996 8.32988 2.66278 -146.19550 934.82458
1680.0000 -152.77454 -143.79476 8.97979 2.78927 -144.17161 997.73813
1685.0000 -152.65803 -144.34397 8.31407 2.72683 -145.17067 976.50270
1690.0000 -153.73693 -145.24996 8.48698 2.76368 -144.58111 1010.97256
1695.0000 -153.69382 -145.75975 7.93407 2.69461 -145.68619 959.93024
1700.0000 -152.98120 -145.42112 7.56008 2.68803 -145.79151 943.68247
1705.0000 -153.64516 -144.66923 8.97592 2.74410 -144.89437 979.06549
1710.0000 -152.74247 -143.95278 8.78969 2.84090 -143.34553 1063.79892
1715.0000 -153.54845 -146.37717 7.17128 2.77890 -144.33754 1045.79493
1720.0000 -155.30683 -148.28913 7.01770 2.60685 -147.09045 901.69897
1725.0000 -153.26179 -146.21277 7.04902 2.63703 -146.60744 896.61459
1730.0000 -153.85354 -146.56551 7.28803 2.61005 -147.03925 894.55777
1735.0000 -153.51515 -145.68871 7.82644 2.65477 -146.32372 903.47567
1740.0000 -153.94548 -146.34005 7.60543 2.63200 -146.68798 902.86764
1745.0000 -152.06658 -145.77089 6.29569 2.66673 -146.13234 919.92659
1750.0000 -152.60848 -144.07146 8.53702 2.77853 -144.34350 1023.85114
FREEZING PROCESS: loop number 8 T-loop= 918.00000000000000
main_MD> interactions number 8 at Temperature= 918.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.17306 -0.68957 0.45872
force_rgl> df(natom) 0.44542 1.76488 2.28394
1755.0000 -153.15512 -145.04910 8.10602 2.77061 -144.47031 972.25129
1760.0000 -154.33790 -146.70743 7.63047 2.64743 -146.44108 906.29862
1765.0000 -154.66207 -148.49724 6.16483 2.53352 -148.26361 816.58623
1770.0000 -155.39939 -149.12932 6.27008 2.52093 -148.46514 833.17415
1775.0000 -154.09018 -146.17831 7.91187 2.56664 -147.73376 857.71597
1780.0000 -155.31386 -147.96886 7.34500 2.61222 -147.00454 907.33806
1785.0000 -153.48753 -146.64743 6.84010 2.54430 -148.09121 844.57068
1790.0000 -154.24697 -147.33900 6.90797 2.65743 -146.28117 928.11089
1795.0000 -153.68822 -146.14199 7.54624 2.63562 -146.63000 889.67722
1800.0000 -154.70447 -146.96883 7.73564 2.66117 -146.22125 944.78881
1805.0000 -155.37085 -147.48859 7.88226 2.61551 -146.95189 869.02439
1810.0000 -154.95656 -147.94721 7.00935 2.59806 -147.23108 902.00802
1815.0000 -153.54622 -146.99715 6.54906 2.57648 -147.57634 880.67676
1820.0000 -153.06968 -146.81876 6.25092 2.62779 -146.75532 868.01159
1825.0000 -152.77658 -145.03065 7.74593 2.65889 -146.25777 880.99338
1830.0000 -152.51494 -145.11463 7.40031 2.73084 -145.10656 934.52806
1835.0000 -154.08243 -144.21066 9.87177 2.77076 -144.46784 981.04407
1840.0000 -153.44317 -145.75033 7.69285 2.68557 -145.83096 944.19369
1845.0000 -154.03393 -148.08362 5.95030 2.57800 -147.55207 821.08566
1850.0000 -156.61979 -149.46264 7.15715 2.51178 -148.61159 797.12675
1855.0000 -155.34062 -147.67929 7.66133 2.47393 -149.21709 794.88018
1860.0000 -154.69075 -147.45934 7.23141 2.56854 -147.70335 891.39807
1865.0000 -154.00668 -146.97802 7.02866 2.57686 -147.57027 867.46191
1870.0000 -155.73824 -147.69457 8.04367 2.57553 -147.59149 890.21516
1875.0000 -154.58335 -145.99388 8.58948 2.61679 -146.93143 906.62538
1880.0000 -153.13029 -145.39185 7.73844 2.72491 -145.20138 961.73280
1885.0000 -152.76065 -143.69344 9.06721 2.72708 -145.16666 958.24442
1890.0000 -153.59745 -147.01931 6.57815 2.68522 -145.83646 933.63644
1895.0000 -153.66923 -147.46710 6.20213 2.67015 -146.07767 912.33993
1900.0000 -155.43416 -148.89535 6.53882 2.55858 -147.86276 857.82746
1905.0000 -151.50379 -144.08148 7.42232 2.62371 -146.82067 912.99586
1910.0000 -152.27496 -144.10643 8.16854 2.73896 -144.97663 967.22138
1915.0000 -150.29173 -143.17122 7.12051 2.78302 -144.27160 987.99468
1920.0000 -152.72022 -145.32741 7.39281 2.77939 -144.32974 1009.48822
1925.0000 -153.95837 -146.46640 7.49197 2.73599 -145.02421 958.89591
1930.0000 -154.28760 -146.45748 7.83011 2.63731 -146.60302 909.01667
1935.0000 -155.17789 -147.23048 7.94742 2.62662 -146.77415 901.98538
1940.0000 -154.57130 -148.07174 6.49955 2.58036 -147.51430 852.90072
1945.0000 -155.70630 -147.25851 8.44779 2.59612 -147.26204 873.22672
1950.0000 -153.53510 -145.53031 8.00479 2.64771 -146.43660 920.04126
1955.0000 -153.58075 -146.03270 7.54805 2.65606 -146.30312 909.43181
1960.0000 -155.09499 -146.34915 8.74584 2.64535 -146.47436 881.88034
1965.0000 -153.39946 -145.89430 7.50516 2.66432 -146.17083 924.09831
1970.0000 -154.54980 -146.83479 7.71502 2.63316 -146.66950 904.65244
1975.0000 -153.66167 -146.20776 7.45391 2.63018 -146.71712 901.66149
1980.0000 -154.13765 -147.93660 6.20105 2.64340 -146.50559 914.18945
1985.0000 -153.94891 -147.21971 6.72920 2.58079 -147.50736 858.98045
1990.0000 -153.52112 -146.19379 7.32733 2.62869 -146.74098 880.51314
1995.0000 -156.31808 -147.27895 9.03912 2.64882 -146.41892 917.98175
2000.0000 -154.85338 -147.74000 7.11338 2.60348 -147.14431 870.39983
FREEZING PROCESS: loop number 9 T-loop= 893.00000000000000
main_MD> interactions number 9 at Temperature= 893.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.06492 -2.86863 0.77218
force_rgl> df(natom) -1.78311 0.57485 -0.40821
2005.0000 -154.16044 -146.27059 7.88985 2.57943 -147.52909 856.91697
2010.0000 -153.66087 -145.64203 8.01884 2.66705 -146.12717 931.83875
2015.0000 -153.95881 -146.53233 7.42648 2.64294 -146.51291 895.00034
2020.0000 -153.52808 -147.24233 6.28576 2.62718 -146.76506 863.69387
2025.0000 -153.27929 -145.87320 7.40609 2.64944 -146.40891 912.64163
2030.0000 -153.50045 -145.11001 8.39044 2.70731 -145.48311 974.65980
2035.0000 -154.07399 -147.31366 6.76033 2.69875 -145.61996 950.37517
2040.0000 -155.48597 -148.96421 6.52177 2.53303 -148.27156 831.68251
2045.0000 -154.84460 -146.90335 7.94125 2.53537 -148.23411 850.51931
2050.0000 -155.87887 -147.40931 8.46956 2.56268 -147.79707 877.57348
2055.0000 -154.61200 -146.94919 7.66282 2.60499 -147.12017 887.17655
2060.0000 -153.93153 -147.04373 6.88780 2.61195 -147.00885 848.20809
2065.0000 -154.62635 -148.12353 6.50281 2.58983 -147.36277 880.88291
2070.0000 -153.67615 -147.30586 6.37029 2.55947 -147.84846 848.27726
2075.0000 -153.47803 -145.76332 7.71471 2.66922 -146.09255 934.89343
2080.0000 -154.07163 -147.56500 6.50663 2.61843 -146.90520 865.88816
2085.0000 -153.51233 -147.31576 6.19657 2.61025 -147.03597 874.07043
2090.0000 -155.24143 -147.25119 7.99024 2.63048 -146.71228 898.60024
2095.0000 -154.83382 -145.66594 9.16788 2.67455 -146.00715 941.66032
2100.0000 -154.97626 -147.37056 7.60569 2.64614 -146.46174 933.78940
2105.0000 -153.26310 -146.75373 6.50937 2.60899 -147.05612 893.58359
2110.0000 -154.53267 -146.87444 7.65823 2.64590 -146.46563 907.30223
2115.0000 -153.89960 -147.66915 6.23045 2.59587 -147.26601 851.95409
2120.0000 -154.16439 -147.18208 6.98230 2.61416 -146.97349 861.94614
2125.0000 -153.59884 -145.83049 7.76835 2.62212 -146.84612 865.83478
2130.0000 -154.00084 -145.03609 8.96475 2.75037 -144.79412 1006.06876
2135.0000 -152.75167 -144.64495 8.10673 2.75035 -144.79438 955.12159
2140.0000 -153.73172 -146.20381 7.52792 2.67609 -145.98253 928.62982
2145.0000 -153.19416 -145.66185 7.53231 2.70967 -145.44529 955.94778
2150.0000 -153.99028 -146.81805 7.17223 2.67909 -145.93457 930.37802
2155.0000 -152.42827 -145.12793 7.30034 2.67596 -145.98459 921.07417
2160.0000 -153.07406 -144.60070 8.47336 2.71402 -145.37565 940.07460
2165.0000 -151.90366 -143.06966 8.83400 2.83487 -143.44206 1054.07238
2170.0000 -152.90404 -144.98845 7.91559 2.77666 -144.37338 957.86919
2175.0000 -153.22283 -145.50754 7.71528 2.70520 -145.51688 937.93590
2180.0000 -153.51523 -147.02008 6.49515 2.64426 -146.49192 902.01692
2185.0000 -153.35940 -146.52585 6.83355 2.67215 -146.04559 925.03120
2190.0000 -154.37016 -147.35617 7.01399 2.58792 -147.39323 841.04678
2195.0000 -154.99729 -145.77999 9.21730 2.61549 -146.95215 878.10012
2200.0000 -154.07113 -146.95126 7.11987 2.60840 -147.06567 878.07455
2205.0000 -154.27503 -147.56832 6.70671 2.63985 -146.56245 899.44144
2210.0000 -153.18593 -146.41374 6.77219 2.62947 -146.72850 886.69612
2215.0000 -154.40860 -145.89488 8.51372 2.58907 -147.37489 898.25689
2220.0000 -154.44277 -147.31823 7.12454 2.63577 -146.62775 915.63042
2225.0000 -153.76446 -146.05947 7.70499 2.59041 -147.35348 862.09605
2230.0000 -154.04093 -147.06289 6.97804 2.62857 -146.74289 903.02948
2235.0000 -155.34798 -148.15030 7.19768 2.54728 -148.04360 816.92090
2240.0000 -155.87370 -147.91855 7.95515 2.52777 -148.35565 840.07313
2245.0000 -153.76761 -146.69469 7.07292 2.61800 -146.91196 920.64120
2250.0000 -153.62953 -147.48657 6.14296 2.62727 -146.76361 890.95236
FREEZING PROCESS: loop number 10 T-loop= 868.00000000000000
main_MD> interactions number 10 at Temperature= 868.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.09632 -1.25056 -1.80676
force_rgl> df(natom) -0.87573 -1.35126 -2.79940
2255.0000 -154.73258 -148.64357 6.08902 2.56504 -147.75929 830.00711
2260.0000 -153.75762 -146.54888 7.20875 2.60737 -147.08207 869.44090
2265.0000 -152.80361 -145.15506 7.64855 2.63986 -146.56220 903.03079
2270.0000 -155.61377 -149.09322 6.52056 2.61479 -146.96330 896.29615
2275.0000 -153.26939 -147.04526 6.22413 2.52979 -148.32329 836.16771
2280.0000 -155.82767 -147.93534 7.89233 2.60454 -147.12735 902.20336
2285.0000 -154.11038 -148.66558 5.44479 2.51955 -148.48717 806.28990
2290.0000 -154.83401 -148.16652 6.66749 2.50300 -148.75193 807.63971
2295.0000 -155.62551 -148.39897 7.22654 2.53328 -148.26744 839.02722
2300.0000 -155.93737 -149.03107 6.90630 2.48367 -149.06128 777.03682
2305.0000 -155.74019 -150.75883 4.98136 2.46571 -149.34862 783.08667
2310.0000 -155.43943 -148.17764 7.26179 2.50525 -148.71595 822.51424
2315.0000 -153.69148 -145.22804 8.46344 2.57746 -147.56072 881.34082
2320.0000 -153.62233 -146.85020 6.77213 2.61117 -147.02132 879.13776
2325.0000 -154.09491 -146.42456 7.67035 2.60800 -147.07197 894.15297
2330.0000 -152.14009 -145.18816 6.95193 2.71086 -145.42616 929.75592
2335.0000 -152.25441 -144.48850 7.76591 2.72997 -145.12049 966.44392
2340.0000 -154.54970 -145.79396 8.75574 2.71711 -145.32627 940.55249
2345.0000 -155.76379 -148.15331 7.61048 2.59904 -147.21535 853.50722
2350.0000 -154.90110 -149.24079 5.66031 2.47994 -149.12093 801.40091
2355.0000 -155.13620 -147.69938 7.43682 2.51720 -148.52480 819.94256
2360.0000 -156.10665 -149.51912 6.58753 2.46206 -149.40709 771.53079
2365.0000 -156.54444 -149.45175 7.09269 2.49594 -148.86489 813.07087
2370.0000 -156.32874 -150.66205 5.66669 2.44791 -149.63340 758.05650
2375.0000 -156.02215 -149.38058 6.64157 2.44017 -149.75722 734.54189
2380.0000 -155.06313 -147.83427 7.22885 2.51715 -148.52563 802.04438
2385.0000 -153.74246 -146.86562 6.87684 2.61384 -146.97852 899.95119
2390.0000 -155.33350 -148.69051 6.64300 2.52520 -148.39673 819.90465
2395.0000 -153.87825 -146.79835 7.07990 2.60236 -147.16224 866.52407
2400.0000 -154.89095 -147.61022 7.28073 2.65010 -146.39840 924.17250
2405.0000 -154.28791 -146.64212 7.64579 2.65559 -146.31055 913.85952
2410.0000 -154.71928 -145.72032 8.99896 2.63613 -146.62190 913.58080
2415.0000 -154.23733 -146.94004 7.29730 2.66981 -146.08299 925.96461
2420.0000 -156.71689 -151.36326 5.35364 2.49945 -148.80880 788.40541
2425.0000 -156.88716 -149.53320 7.35395 2.45573 -149.50827 762.83297
2430.0000 -154.52862 -147.83599 6.69263 2.51240 -148.60152 821.64430
2435.0000 -154.31637 -147.87973 6.43664 2.53441 -148.24951 795.88245
2440.0000 -154.68521 -147.27298 7.41223 2.57549 -147.59212 839.77392
2445.0000 -154.52367 -147.18426 7.33941 2.59124 -147.34016 868.73007
2450.0000 -154.03344 -146.88084 7.15259 2.58291 -147.47338 871.10798
2455.0000 -155.71901 -148.41670 7.30231 2.56717 -147.72528 860.07472
2460.0000 -155.30260 -148.17543 7.12717 2.53961 -148.16631 865.60856
2465.0000 -153.65052 -145.78891 7.86161 2.63430 -146.65117 929.33579
2470.0000 -154.41793 -147.07732 7.34060 2.63617 -146.62120 876.45968
2475.0000 -154.93121 -148.24391 6.68730 2.57155 -147.65516 850.67550
2480.0000 -155.59077 -147.75917 7.83160 2.54298 -148.11227 851.40072
2485.0000 -155.43895 -148.72258 6.71637 2.48810 -148.99045 817.71754
2490.0000 -156.00116 -148.69245 7.30871 2.50830 -148.66714 819.39249
2495.0000 -154.39489 -147.18192 7.21297 2.55395 -147.93685 845.09376
2500.0000 -153.17034 -147.07540 6.09494 2.54752 -148.03965 830.58873
FREEZING PROCESS: loop number 11 T-loop= 843.00000000000000
main_MD> interactions number 11 at Temperature= 843.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.60467 -1.57751 -0.36272
force_rgl> df(natom) 1.87145 -1.25413 -0.75031
2505.0000 -153.96961 -148.46437 5.50524 2.54347 -148.10445 845.51719
2510.0000 -154.42171 -147.47417 6.94755 2.50438 -148.72988 779.78316
2515.0000 -154.16210 -147.43484 6.72726 2.65083 -146.38670 871.50916
2520.0000 -156.02766 -149.69650 6.33116 2.51741 -148.52150 812.11765
2525.0000 -156.42776 -150.42526 6.00250 2.42603 -149.98349 718.55846
2530.0000 -155.74690 -149.55400 6.19290 2.45202 -149.56772 770.30081
2535.0000 -154.40949 -147.90402 6.50547 2.54774 -148.03610 818.07377
2540.0000 -155.49182 -148.16352 7.32830 2.53368 -148.26106 810.95774
2545.0000 -154.93903 -148.72490 6.21412 2.55725 -147.88402 849.37156
2550.0000 -155.62639 -149.06395 6.56245 2.54901 -148.01584 843.46541
2555.0000 -156.32777 -149.25847 7.06930 2.50188 -148.76990 821.39047
2560.0000 -155.63809 -148.77735 6.86074 2.46357 -149.38290 782.75745
2565.0000 -154.40864 -147.63621 6.77243 2.51372 -148.58052 801.19348
2570.0000 -153.43243 -146.85708 6.57535 2.59522 -147.27644 869.55204
2575.0000 -154.77481 -146.46681 8.30799 2.68133 -145.89866 955.90270
2580.0000 -155.37745 -149.13992 6.23752 2.58051 -147.51178 848.33346
2585.0000 -156.49747 -149.96125 6.53622 2.47178 -149.25157 769.58163
2590.0000 -156.39935 -149.60957 6.78978 2.46121 -149.42065 774.68030
2595.0000 -155.22140 -149.02896 6.19243 2.42900 -149.93594 784.65704
2600.0000 -154.15540 -146.37270 7.78270 2.59870 -147.22081 877.08270
2605.0000 -154.11306 -146.73125 7.38180 2.60091 -147.18551 847.74896
2610.0000 -155.21581 -148.92956 6.28625 2.56895 -147.69674 861.32667
2615.0000 -155.73731 -149.90843 5.82888 2.42018 -150.07707 741.41162
2620.0000 -155.41523 -148.48862 6.92661 2.50806 -148.67106 818.39189
2625.0000 -155.83374 -149.32012 6.51362 2.47578 -149.18753 794.03297
2630.0000 -155.00006 -148.44886 6.55120 2.51133 -148.61880 833.28687
2635.0000 -155.30711 -148.28839 7.01872 2.52466 -148.40536 794.29841
2640.0000 -155.34514 -147.76804 7.57710 2.56653 -147.73558 889.35237
2645.0000 -153.09610 -146.07071 7.02539 2.62295 -146.83276 896.46948
2650.0000 -154.46790 -146.29016 8.17774 2.73147 -145.09642 964.65069
2655.0000 -155.40160 -147.91042 7.49119 2.60833 -147.06680 876.51742
2660.0000 -154.58602 -148.19253 6.39350 2.56113 -147.82190 869.29106
2665.0000 -155.22678 -147.56753 7.65925 2.53170 -148.29283 827.30817
2670.0000 -155.30018 -149.18312 6.11706 2.53499 -148.24014 815.54233
2675.0000 -155.02209 -148.72655 6.29553 2.52242 -148.44122 818.92434
2680.0000 -155.90464 -147.46757 8.43708 2.53324 -148.26811 817.81847
2685.0000 -153.79972 -147.93865 5.86107 2.55570 -147.90887 847.20812
2690.0000 -153.24850 -145.68135 7.56715 2.64277 -146.51562 912.42056
2695.0000 -154.86996 -148.31252 6.55744 2.60839 -147.06584 914.13100
2700.0000 -155.92892 -149.49239 6.43653 2.49236 -148.92218 798.35008
2705.0000 -155.93660 -149.78027 6.15632 2.47488 -149.20189 778.79776
2710.0000 -155.42874 -149.33327 6.09547 2.45626 -149.49992 791.83278
2715.0000 -155.81425 -148.50267 7.31158 2.49660 -148.85446 813.40773
2720.0000 -154.61330 -148.07231 6.54099 2.52329 -148.42743 809.02718
2725.0000 -154.78898 -146.26600 8.52298 2.62892 -146.73728 907.88426
2730.0000 -154.39656 -147.88799 6.50857 2.55078 -147.98755 831.83607
2735.0000 -155.59397 -149.86079 5.73319 2.54058 -148.15076 851.76515
2740.0000 -155.90045 -149.91748 5.98297 2.45661 -149.49429 790.76223
2745.0000 -155.42264 -149.64837 5.77428 2.44867 -149.62127 766.27683
2750.0000 -155.05898 -148.23563 6.82334 2.51306 -148.59096 818.62425
FREEZING PROCESS: loop number 12 T-loop= 818.00000000000000
main_MD> interactions number 12 at Temperature= 818.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.50214 2.09106 0.43660
force_rgl> df(natom) 2.57841 -0.02679 -5.77657
2755.0000 -155.15464 -148.27585 6.87879 2.52486 -148.40225 812.86310
2760.0000 -156.12256 -149.89605 6.22651 2.47811 -149.15026 777.76256
2765.0000 -155.20217 -149.58995 5.61222 2.48075 -149.10803 779.87114
2770.0000 -154.09972 -147.93422 6.16550 2.49022 -148.95652 793.44270
2775.0000 -154.88322 -147.34550 7.53772 2.58730 -147.40313 854.92882
2780.0000 -154.95355 -147.52762 7.42593 2.56420 -147.77284 844.45059
2785.0000 -153.38135 -146.64278 6.73857 2.62238 -146.84188 874.12135
2790.0000 -155.91935 -148.58733 7.33202 2.61112 -147.02212 859.93837
2795.0000 -155.01284 -148.61832 6.39452 2.54311 -148.11021 842.55841
2800.0000 -155.67455 -148.36613 7.30843 2.54520 -148.07687 850.79042
2805.0000 -154.97191 -148.35570 6.61621 2.52421 -148.41265 828.83977
2810.0000 -156.50683 -148.33101 8.17581 2.50913 -148.65385 813.51694
2815.0000 -156.08815 -150.65948 5.42868 2.43690 -149.80967 779.62246
2820.0000 -155.72322 -149.75729 5.96593 2.38478 -150.64353 751.49753
2825.0000 -155.75326 -147.37300 8.38026 2.49224 -148.92413 801.56924
2830.0000 -154.80533 -148.10756 6.69776 2.58375 -147.45998 835.56092
2835.0000 -154.79743 -147.46487 7.33256 2.58419 -147.45291 862.32276
2840.0000 -156.77714 -150.51575 6.26139 2.51976 -148.48378 844.24131
2845.0000 -155.73969 -148.51933 7.22035 2.48563 -149.02989 815.54108
2850.0000 -155.41339 -149.07537 6.33803 2.47645 -149.17675 808.31147
2855.0000 -156.20580 -149.74836 6.45744 2.45045 -149.59272 776.81862
2860.0000 -157.37420 -151.05866 6.31554 2.43666 -149.81341 785.59842
2865.0000 -156.35200 -149.47805 6.87395 2.40926 -150.25177 747.67373
2870.0000 -155.71297 -147.78722 7.92575 2.50065 -148.78955 800.58849
2875.0000 -154.94748 -147.03522 7.91226 2.59043 -147.35312 872.94587
2880.0000 -153.79587 -147.69417 6.10170 2.60710 -147.08634 884.75263
2885.0000 -154.82791 -148.02541 6.80251 2.55940 -147.84955 840.79327
2890.0000 -152.97540 -146.65670 6.31870 2.57809 -147.55060 867.03246
2895.0000 -154.38324 -147.16358 7.21966 2.60437 -147.13000 892.23763
2900.0000 -154.43007 -148.77393 5.65614 2.52385 -148.41839 788.11272
2905.0000 -154.28177 -144.89999 9.38178 2.61336 -146.98631 905.72553
2910.0000 -154.44498 -147.77699 6.66800 2.62585 -146.78636 885.19365
2915.0000 -156.88371 -150.82289 6.06082 2.47973 -149.12425 801.75848
2920.0000 -155.54192 -149.13699 6.40493 2.41665 -150.13356 747.20587
2925.0000 -154.96165 -148.10401 6.85763 2.45632 -149.49893 753.00548
2930.0000 -155.66302 -149.08884 6.57417 2.51157 -148.61485 778.95864
2935.0000 -155.93900 -148.75109 7.18791 2.45146 -149.57666 749.28281
2940.0000 -155.11875 -148.60373 6.51503 2.48337 -149.06613 814.55895
2945.0000 -155.58605 -148.97999 6.60606 2.51127 -148.61974 822.63518
2950.0000 -155.60753 -149.07701 6.53052 2.48022 -149.11649 783.04351
2955.0000 -155.72300 -150.00485 5.71815 2.43667 -149.81326 745.43429
2960.0000 -154.90175 -148.25974 6.64201 2.51590 -148.54561 815.66660
2965.0000 -156.74792 -150.13922 6.60870 2.52986 -148.32225 852.46211
2970.0000 -155.59162 -149.21980 6.37182 2.46014 -149.43783 783.46189
2975.0000 -154.58088 -147.75610 6.82477 2.48999 -148.96012 800.08585
2980.0000 -153.56188 -146.03787 7.52401 2.61349 -146.98418 880.57024
2985.0000 -153.88412 -147.67745 6.20667 2.62165 -146.85366 872.51489
2990.0000 -157.24158 -149.63644 7.60515 2.49254 -148.91938 805.89004
2995.0000 -157.05399 -150.24138 6.81261 2.41660 -150.13441 761.42965
3000.0000 -155.93072 -149.87794 6.05278 2.45010 -149.59838 779.03658
FREEZING PROCESS: loop number 13 T-loop= 793.00000000000000
main_MD> interactions number 13 at Temperature= 793.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.67060 -0.54038 0.78923
force_rgl> df(natom) -0.71388 -2.70674 0.83299
3005.0000 -156.03979 -149.03933 7.00046 2.45619 -149.50092 793.28872
3010.0000 -154.42421 -148.49301 5.93120 2.48319 -149.06898 764.10183
3015.0000 -155.95254 -148.53595 7.41659 2.51633 -148.53877 833.62749
3020.0000 -157.07930 -150.12999 6.94932 2.48606 -149.02304 801.74851
3025.0000 -156.02992 -149.81370 6.21622 2.45143 -149.57711 784.24389
3030.0000 -155.58176 -149.74424 5.83753 2.46268 -149.39707 788.62877
3035.0000 -155.67337 -149.28102 6.39235 2.44562 -149.67015 789.81195
3040.0000 -155.49869 -149.07565 6.42304 2.47993 -149.12116 801.76828
3045.0000 -156.63110 -149.27576 7.35534 2.41554 -150.15131 731.12446
3050.0000 -156.54508 -149.67942 6.86566 2.45491 -149.52144 800.44347
3055.0000 -155.75217 -149.45741 6.29475 2.45179 -149.57140 790.76525
3060.0000 -155.36737 -149.19655 6.17082 2.45784 -149.47455 777.17709
3065.0000 -155.40781 -148.81744 6.59036 2.50025 -148.79600 783.88352
3070.0000 -154.18024 -147.91591 6.26433 2.52455 -148.40714 816.03913
3075.0000 -155.63756 -148.44788 7.18968 2.53648 -148.21626 838.24983
3080.0000 -154.98752 -148.61122 6.37630 2.47610 -149.18232 752.30381
3085.0000 -155.15257 -147.58481 7.56776 2.56266 -147.79749 849.20053
3090.0000 -155.66167 -148.43112 7.23056 2.56053 -147.83158 827.69436
3095.0000 -156.10026 -149.72942 6.37084 2.49049 -148.95216 770.66919
3100.0000 -155.82150 -149.94593 5.87557 2.45320 -149.54880 770.92260
3105.0000 -156.34705 -149.88863 6.45842 2.40361 -150.34218 757.23157
3110.0000 -156.67265 -150.44670 6.22595 2.40892 -150.25724 766.11169
3115.0000 -155.49903 -149.16720 6.33183 2.41250 -150.20001 761.38580
3120.0000 -157.19795 -150.97426 6.22369 2.41462 -150.16602 776.32705
3125.0000 -156.43335 -149.80421 6.62914 2.38868 -150.58118 737.88538
3130.0000 -155.99577 -147.93338 8.06239 2.48039 -149.11369 795.81828
3135.0000 -156.61497 -149.87189 6.74308 2.53288 -148.27389 868.62197
3140.0000 -156.60184 -150.92799 5.67386 2.40431 -150.33098 755.56053
3145.0000 -156.86957 -149.94365 6.92592 2.40094 -150.38490 773.16681
3150.0000 -157.49574 -151.50897 5.98677 2.40890 -150.25756 770.85591
3155.0000 -156.99976 -151.30874 5.69102 2.35644 -151.09700 751.33873
3160.0000 -155.93350 -148.85937 7.07414 2.43995 -149.76075 783.85287
3165.0000 -156.26479 -150.05673 6.20806 2.46753 -149.31955 777.81494
3170.0000 -157.63837 -151.35228 6.28609 2.39232 -150.52292 758.22724
3175.0000 -156.31016 -149.92088 6.38928 2.41446 -150.16858 762.32456
3180.0000 -156.26613 -149.53694 6.72919 2.44713 -149.64591 788.52643
3185.0000 -155.99164 -149.79597 6.19567 2.45315 -149.54961 779.60735
3190.0000 -156.35408 -149.76726 6.58683 2.45075 -149.58806 764.09166
3195.0000 -156.84118 -151.19398 5.64720 2.42971 -149.92471 736.54975
3200.0000 -155.91451 -150.25020 5.66430 2.39010 -150.55845 716.26151
3205.0000 -156.02937 -149.08908 6.94030 2.45715 -149.48554 784.11477
3210.0000 -155.21450 -148.49130 6.72320 2.46984 -149.28257 795.67451
3215.0000 -155.81034 -148.41502 7.39532 2.52195 -148.44878 819.44147
3220.0000 -155.44704 -148.73831 6.70873 2.49000 -148.96007 785.13263
3225.0000 -155.58680 -149.50330 6.08350 2.48826 -148.98782 797.97105
3230.0000 -156.66328 -149.28315 7.38013 2.43345 -149.86483 787.08591
3235.0000 -155.61644 -149.91363 5.70281 2.45908 -149.45468 753.20722
3240.0000 -155.05419 -148.87842 6.17577 2.45693 -149.48918 769.64802
3245.0000 -155.77802 -147.71351 8.06451 2.54893 -148.01713 830.79411
3250.0000 -155.53584 -148.44354 7.09230 2.53811 -148.19030 800.99695
FREEZING PROCESS: loop number 14 T-loop= 768.00000000000000
main_MD> interactions number 14 at Temperature= 768.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.13009 -4.07463 -0.13071
force_rgl> df(natom) 0.71894 3.36521 0.04942
3255.0000 -155.34629 -148.14070 7.20559 2.55717 -147.88524 848.68794
3260.0000 -155.94861 -149.12409 6.82453 2.53236 -148.28221 841.28110
3265.0000 -155.52938 -148.44693 7.08245 2.52060 -148.47040 830.89552
3270.0000 -154.62473 -148.62022 6.00451 2.54032 -148.15486 830.66233
3275.0000 -154.95085 -149.45571 5.49514 2.49504 -148.87942 790.94238
3280.0000 -157.00177 -150.41195 6.58982 2.37513 -150.79797 689.55254
3285.0000 -154.91259 -148.10847 6.80412 2.41796 -150.11270 734.18149
3290.0000 -154.95673 -148.43587 6.52086 2.52372 -148.42052 814.03245
3295.0000 -155.06574 -149.15204 5.91370 2.49206 -148.92707 819.24474
3300.0000 -156.02516 -150.53150 5.49366 2.42474 -150.00417 744.30769
3305.0000 -157.34958 -151.79389 5.55569 2.40778 -150.27552 732.94447
3310.0000 -156.26267 -150.16170 6.10097 2.33422 -151.45245 662.40275
3315.0000 -156.79795 -151.28406 5.51389 2.40516 -150.31741 742.18701
3320.0000 -158.07883 -151.81275 6.26608 2.37199 -150.84815 703.28084
3325.0000 -156.64243 -150.89387 5.74856 2.32104 -151.66337 695.37598
3330.0000 -155.09771 -148.70971 6.38800 2.41680 -150.13114 719.05357
3335.0000 -156.63063 -151.02886 5.60177 2.44994 -149.60098 765.45150
3340.0000 -156.48834 -150.87180 5.61654 2.35737 -151.08204 715.42611
3345.0000 -156.65884 -150.38771 6.27114 2.43352 -149.86375 771.11164
3350.0000 -156.73328 -151.43123 5.30205 2.38704 -150.60738 739.82332
3355.0000 -156.91275 -151.59545 5.31730 2.34823 -151.22826 710.51335
3360.0000 -156.12767 -149.31229 6.81539 2.39141 -150.53746 733.88340
3365.0000 -157.89347 -149.57942 8.31404 2.43975 -149.76394 809.42834
3370.0000 -156.69467 -149.10457 7.59009 2.43862 -149.78214 784.46235
3375.0000 -156.56513 -150.28331 6.28182 2.41981 -150.08310 756.70899
3380.0000 -156.81029 -149.55116 7.25913 2.38625 -150.61995 746.29061
3385.0000 -156.05840 -149.77285 6.28555 2.46531 -149.35511 784.45640
3390.0000 -154.97441 -148.58286 6.39154 2.44697 -149.64855 768.41364
3395.0000 -155.42636 -149.37916 6.04720 2.47848 -149.14437 761.41274
3400.0000 -157.54122 -150.86251 6.67871 2.40240 -150.36160 761.53017
3405.0000 -156.76120 -150.58460 6.17660 2.43626 -149.81979 761.43967
3410.0000 -157.62998 -150.67314 6.95684 2.40468 -150.32518 779.71533
3415.0000 -156.75807 -151.94515 4.81292 2.32951 -151.52785 747.11812
3420.0000 -156.48839 -150.03956 6.44883 2.37705 -150.76715 742.47588
3425.0000 -156.18875 -150.06688 6.12187 2.42710 -149.96639 760.23847
3430.0000 -156.76419 -151.55882 5.20537 2.40327 -150.34762 727.67683
3435.0000 -156.91832 -150.68374 6.23458 2.38710 -150.60643 719.92507
3440.0000 -156.18750 -149.82920 6.35830 2.41003 -150.23947 748.83424
3445.0000 -155.60560 -150.36739 5.23822 2.42115 -150.06164 751.89795
3450.0000 -155.65899 -148.80445 6.85454 2.46110 -149.42244 795.26603
3455.0000 -155.77366 -148.70577 7.06788 2.52224 -148.44413 820.52327
3460.0000 -156.25798 -150.52860 5.72938 2.44458 -149.68678 763.13967
3465.0000 -156.13682 -150.52656 5.61026 2.35383 -151.13868 710.42355
3470.0000 -155.61817 -149.35252 6.26566 2.42740 -149.96167 776.27858
3475.0000 -156.00083 -150.11545 5.88537 2.42445 -150.00875 753.80203
3480.0000 -155.33960 -147.82329 7.51631 2.46964 -149.28570 791.03439
3485.0000 -155.56357 -148.14224 7.42133 2.50433 -148.73072 810.74200
3490.0000 -157.13049 -149.72542 7.40508 2.52809 -148.35062 823.40026
3495.0000 -156.31948 -149.88490 6.43459 2.41176 -150.21188 744.40049
3500.0000 -157.72891 -151.54646 6.18246 2.39472 -150.48449 747.16279
FREEZING PROCESS: loop number 15 T-loop= 743.00000000000000
main_MD> interactions number 15 at Temperature= 743.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.59701 -2.33180 -5.45862
force_rgl> df(natom) 1.25591 -0.13130 -0.47620
3505.0000 -157.48166 -151.73520 5.74647 2.33657 -151.41482 701.68212
3510.0000 -156.46296 -151.66447 4.79849 2.33829 -151.38739 705.45202
3515.0000 -157.60427 -152.33063 5.27364 2.31120 -151.82072 677.39576
3520.0000 -155.52577 -150.10141 5.42436 2.36984 -150.88260 722.83155
3525.0000 -155.43440 -148.93613 6.49827 2.46543 -149.35311 768.41789
3530.0000 -154.71865 -148.34655 6.37210 2.48342 -149.06534 771.98084
3535.0000 -155.23373 -149.02926 6.20447 2.47880 -149.13914 791.18230
3540.0000 -156.60491 -151.52200 5.08292 2.39114 -150.54179 732.70561
3545.0000 -156.81375 -151.56490 5.24885 2.30319 -151.94898 677.15233
3550.0000 -156.54709 -150.21997 6.32712 2.40238 -150.36186 749.52441
3555.0000 -157.42574 -151.13922 6.28652 2.38622 -150.62053 738.87214
3560.0000 -155.31644 -148.96161 6.35483 2.36221 -151.00471 703.81873
3565.0000 -156.71424 -150.88105 5.83319 2.43850 -149.78399 760.69528
3570.0000 -156.90069 -151.09737 5.80331 2.39232 -150.52281 726.37720
3575.0000 -156.83042 -151.27174 5.55868 2.38665 -150.61361 712.29512
3580.0000 -155.73948 -149.61671 6.12277 2.39604 -150.46340 732.96039
3585.0000 -155.55419 -149.24097 6.31323 2.43736 -149.80219 771.85002
3590.0000 -157.49088 -151.22679 6.26409 2.41065 -150.22959 742.52202
3595.0000 -158.09428 -152.58878 5.50550 2.28872 -152.18045 672.26255
3600.0000 -157.98453 -153.02289 4.96163 2.24506 -152.87906 624.01542
3605.0000 -157.41101 -151.66246 5.74855 2.28407 -152.25487 656.80378
3610.0000 -157.23649 -151.01175 6.22474 2.31550 -151.75199 679.23660
3615.0000 -157.05882 -151.32585 5.73297 2.33938 -151.36998 709.07961
3620.0000 -157.62076 -151.27692 6.34384 2.31813 -151.70997 700.40778
3625.0000 -157.25192 -152.07913 5.17279 2.29768 -152.03713 665.35552
3630.0000 -156.29674 -151.34225 4.95449 2.30765 -151.87752 693.46555
3635.0000 -156.61952 -150.45926 6.16026 2.40735 -150.28245 753.16201
3640.0000 -157.13890 -150.60483 6.53407 2.40843 -150.26505 760.38656
3645.0000 -156.36587 -150.65362 5.71225 2.38848 -150.58427 748.50500
3650.0000 -157.40849 -151.87666 5.53184 2.36273 -150.99632 696.63609
3655.0000 -156.96401 -151.33089 5.63313 2.34393 -151.29705 689.16023
3660.0000 -157.90397 -151.64800 6.25597 2.34122 -151.34053 686.46198
3665.0000 -156.88495 -151.01645 5.86850 2.33827 -151.38772 705.82983
3670.0000 -156.26140 -150.79912 5.46228 2.38444 -150.64890 706.93441
3675.0000 -158.51599 -151.79157 6.72442 2.34923 -151.21236 693.90937
3680.0000 -157.74076 -152.04208 5.69868 2.31689 -151.72972 689.09624
3685.0000 -157.17749 -151.64632 5.53117 2.28449 -152.24811 655.73743
3690.0000 -156.39059 -150.14739 6.24320 2.38867 -150.58124 712.72932
3695.0000 -156.88526 -150.84874 6.03652 2.40193 -150.36914 736.63189
3700.0000 -156.36233 -149.75166 6.61067 2.42327 -150.02761 747.44744
3705.0000 -156.58605 -149.66345 6.92260 2.47498 -149.20029 768.70835
3710.0000 -156.14834 -150.72836 5.41998 2.38476 -150.64381 711.88443
3715.0000 -155.46592 -148.95630 6.50963 2.47041 -149.27336 778.58206
3720.0000 -157.73676 -149.82364 7.91312 2.43400 -149.85604 754.16424
3725.0000 -155.50454 -149.46541 6.03913 2.44046 -149.75266 762.61517
3730.0000 -154.33603 -147.89310 6.44293 2.51756 -148.51898 816.82375
3735.0000 -156.39631 -149.91617 6.48015 2.51799 -148.51223 815.05806
3740.0000 -157.26894 -151.93262 5.33632 2.38973 -150.56429 742.44903
3745.0000 -157.08944 -150.59179 6.49765 2.35455 -151.12727 698.19992
3750.0000 -157.29401 -151.32692 5.96710 2.41746 -150.12067 746.27823
FREEZING PROCESS: loop number 16 T-loop= 718.00000000000000
main_MD> interactions number 16 at Temperature= 718.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.57600 1.36177 4.79224
force_rgl> df(natom) 0.68200 -4.66263 -1.48022
3755.0000 -157.13189 -150.95338 6.17851 2.34206 -151.32698 693.48864
3760.0000 -157.94596 -153.27158 4.67437 2.33899 -151.37616 708.32207
3765.0000 -159.06277 -153.32854 5.73423 2.21291 -153.39339 603.77641
3770.0000 -158.22196 -152.55656 5.66540 2.26900 -152.49599 658.52871
3775.0000 -157.87932 -151.95050 5.92883 2.25674 -152.69215 647.64153
3780.0000 -157.81657 -151.70694 6.10963 2.34076 -151.34785 708.22460
3785.0000 -156.65223 -150.32722 6.32501 2.38158 -150.69473 719.44853
3790.0000 -157.02770 -151.88635 5.14135 2.34595 -151.26483 718.26030
3795.0000 -157.80822 -152.32707 5.48116 2.30759 -151.87863 681.54493
3800.0000 -157.34881 -151.95911 5.38970 2.26292 -152.59334 653.53118
3805.0000 -156.39446 -150.68111 5.71336 2.33600 -151.42396 709.88765
3810.0000 -156.11747 -150.91520 5.20228 2.35538 -151.11398 702.93016
3815.0000 -157.18768 -151.10972 6.07796 2.40334 -150.34654 740.82064
3820.0000 -156.11957 -150.71262 5.40695 2.35696 -151.08865 705.69046
3825.0000 -158.27830 -152.59174 5.68656 2.35611 -151.10232 733.53075
3830.0000 -158.41470 -152.82351 5.59119 2.24460 -152.88635 672.01625
3835.0000 -158.20945 -152.87125 5.33820 2.25420 -152.73282 673.02049
3840.0000 -157.62342 -152.01183 5.61159 2.28908 -152.17477 687.79494
3845.0000 -156.64169 -151.00690 5.63479 2.33292 -151.47331 689.59819
3850.0000 -156.97311 -151.40522 5.56789 2.31815 -151.70962 669.87808
3855.0000 -156.73576 -150.33750 6.39826 2.35061 -151.19028 701.17057
3860.0000 -155.81973 -149.42450 6.39523 2.45191 -149.56941 764.60995
3865.0000 -157.21019 -151.58438 5.62581 2.39684 -150.45056 734.73460
3870.0000 -157.38300 -150.96470 6.41830 2.33694 -151.40894 721.37301
3875.0000 -156.45064 -151.11060 5.34004 2.37998 -150.72036 726.39985
3880.0000 -156.90625 -151.85519 5.05106 2.35674 -151.09222 696.43971
3885.0000 -157.41717 -151.16019 6.25698 2.26950 -152.48804 638.76295
3890.0000 -156.94643 -151.13028 5.81616 2.32760 -151.55839 692.26350
3895.0000 -158.35225 -152.13869 6.21356 2.30129 -151.97937 679.21866
3900.0000 -158.16026 -152.19432 5.96594 2.26091 -152.62549 637.25329
3905.0000 -157.60565 -151.41668 6.18896 2.30678 -151.89146 702.83398
3910.0000 -157.91994 -152.64912 5.27082 2.31379 -151.77935 702.19186
3915.0000 -156.18477 -149.81542 6.36935 2.36647 -150.93649 721.68303
3920.0000 -156.70556 -149.84969 6.85587 2.47945 -149.12885 784.42539
3925.0000 -156.26289 -149.94484 6.31805 2.44454 -149.68728 787.27276
3930.0000 -157.12856 -151.49549 5.63307 2.39174 -150.53223 740.81402
3935.0000 -157.99606 -151.42039 6.57568 2.33639 -151.41775 710.09919
3940.0000 -157.45726 -151.22904 6.22822 2.36076 -151.02786 719.40862
3945.0000 -156.93607 -151.28669 5.64938 2.36083 -151.02672 722.89991
3950.0000 -158.40380 -153.39863 5.00517 2.26849 -152.50417 641.31986
3955.0000 -158.36683 -152.87736 5.48946 2.25143 -152.77712 649.69056
3960.0000 -159.11081 -153.70279 5.40802 2.25080 -152.78722 660.12732
3965.0000 -157.98600 -151.38527 6.60073 2.25983 -152.64265 651.53332
3970.0000 -158.46462 -152.92646 5.53815 2.25676 -152.69187 660.57290
3975.0000 -158.54233 -153.06066 5.48167 2.24260 -152.91847 645.60654
3980.0000 -157.93704 -151.62369 6.31335 2.24976 -152.80380 658.37425
3985.0000 -157.54515 -152.29827 5.24688 2.34445 -151.28875 725.36728
3990.0000 -157.41696 -152.37048 5.04648 2.26787 -152.51404 630.58773
3995.0000 -157.26130 -151.12181 6.13949 2.27368 -152.42112 656.43753
4000.0000 -155.70193 -149.19914 6.50279 2.39938 -150.40994 704.87372
FREEZING PROCESS: loop number 17 T-loop= 693.00000000000000
main_MD> interactions number 17 at Temperature= 693.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.23538 -0.72337 -2.05524
force_rgl> df(natom) -5.18588 -6.37515 1.85180
4005.0000 -155.17327 -149.60746 5.56581 2.42302 -150.03169 741.33978
4010.0000 -157.10078 -151.23908 5.86170 2.35185 -151.17045 696.14767
4015.0000 -157.19426 -151.12137 6.07288 2.38558 -150.63068 721.43899
4020.0000 -156.31721 -149.61720 6.70000 2.43049 -149.91216 748.12731
4025.0000 -156.88620 -151.24183 5.64436 2.35127 -151.17969 700.73262
4030.0000 -157.33290 -151.47101 5.86189 2.29618 -152.06114 671.64929
4035.0000 -157.57495 -151.97537 5.59958 2.30419 -151.93293 666.52663
4040.0000 -158.40990 -152.22355 6.18635 2.28600 -152.22408 675.12094
4045.0000 -156.81320 -151.33096 5.48224 2.30688 -151.88985 698.37064
4050.0000 -158.46809 -152.55733 5.91076 2.26046 -152.63271 651.27261
4055.0000 -156.86764 -150.56554 6.30210 2.33590 -151.42564 712.51888
4060.0000 -157.72105 -152.84814 4.87291 2.33376 -151.45976 719.11605
4065.0000 -156.14839 -150.00451 6.14388 2.36462 -150.96604 720.44301
4070.0000 -156.54170 -150.70110 5.84059 2.41491 -150.16140 760.45937
4075.0000 -156.60864 -151.73697 4.87167 2.35003 -151.19946 673.30107
4080.0000 -157.20031 -151.64950 5.55080 2.35252 -151.15975 693.86034
4085.0000 -157.98487 -151.76170 6.22317 2.27785 -152.35445 657.31521
4090.0000 -157.11045 -151.28430 5.82615 2.33513 -151.43789 705.26976
4095.0000 -156.79468 -150.33576 6.45892 2.39082 -150.54680 738.56324
4100.0000 -157.89538 -151.63780 6.25759 2.32905 -151.53527 682.30467
4105.0000 -156.34255 -150.02795 6.31459 2.37223 -150.84433 714.24494
4110.0000 -155.19233 -148.39356 6.79877 2.50074 -148.78809 788.85055
4115.0000 -156.66423 -150.22304 6.44119 2.43321 -149.86869 774.91086
4120.0000 -156.81014 -150.98494 5.82520 2.35466 -151.12547 722.91461
4125.0000 -157.80993 -152.04184 5.76810 2.31043 -151.83318 685.19286
4130.0000 -156.73169 -150.93841 5.79328 2.36172 -151.01243 733.08283
4135.0000 -156.85768 -150.44979 6.40789 2.38634 -150.61854 732.75467
4140.0000 -156.03808 -150.34981 5.68828 2.38620 -150.62087 749.72977
4145.0000 -156.48877 -149.84241 6.64636 2.43249 -149.88010 765.26523
4150.0000 -157.22333 -151.96744 5.25588 2.38660 -150.61445 727.50326
4155.0000 -157.61371 -152.80378 4.80993 2.25481 -152.72298 671.96404
4160.0000 -158.24330 -153.40449 4.83881 2.25867 -152.66133 648.55021
4165.0000 -158.11898 -152.77003 5.34895 2.21921 -153.29256 630.72501
4170.0000 -157.12505 -151.25608 5.86896 2.33396 -151.45670 690.46249
4175.0000 -156.63607 -151.15596 5.48011 2.34640 -151.25764 682.76153
4180.0000 -157.63014 -152.51597 5.11417 2.31767 -151.71727 696.08829
4185.0000 -157.12677 -151.42021 5.70656 2.29752 -152.03961 677.96179
4190.0000 -157.43023 -151.81656 5.61367 2.32710 -151.56641 660.96466
4195.0000 -156.41111 -150.84681 5.56430 2.36797 -150.91254 714.10793
4200.0000 -157.62856 -151.11830 6.51026 2.34516 -151.27739 708.73112
4205.0000 -157.12854 -150.83260 6.29594 2.36787 -150.91407 730.44877
4210.0000 -157.66409 -151.62113 6.04296 2.37020 -150.87677 723.32601
4215.0000 -158.54402 -153.70808 4.83594 2.23205 -153.08727 637.00666
4220.0000 -158.79898 -153.21376 5.58522 2.17708 -153.96673 620.54350
4225.0000 -159.25447 -152.50740 6.74707 2.23944 -152.96895 670.11280
4230.0000 -158.24733 -152.93508 5.31225 2.24620 -152.86073 687.25714
4235.0000 -158.10912 -152.07092 6.03820 2.30819 -151.86897 683.72576
4240.0000 -156.41767 -150.50168 5.91599 2.33814 -151.38980 690.07585
4245.0000 -157.59961 -151.35867 6.24094 2.40577 -150.30773 714.85889
4250.0000 -156.85152 -151.39349 5.45804 2.26479 -152.56342 656.34723
FREEZING PROCESS: loop number 18 T-loop= 668.00000000000000
main_MD> interactions number 18 at Temperature= 668.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.50436 1.46969 -0.62670
force_rgl> df(natom) 0.40314 3.75887 -0.50412
4255.0000 -158.67373 -152.74892 5.92480 2.31686 -151.73026 680.26368
4260.0000 -157.34204 -151.98010 5.36195 2.27087 -152.46609 645.47928
4265.0000 -156.01505 -150.28407 5.73098 2.34105 -151.34318 697.84323
4270.0000 -155.89429 -150.91374 4.98055 2.43118 -149.90114 750.21855
4275.0000 -156.63241 -150.06710 6.56531 2.37497 -150.80041 695.23786
4280.0000 -156.98154 -149.75411 7.22743 2.44578 -149.66747 781.00410
4285.0000 -156.38138 -150.84643 5.53495 2.38927 -150.57164 730.40787
4290.0000 -157.30160 -151.85194 5.44966 2.37865 -150.74154 703.08333
4295.0000 -156.30481 -151.00121 5.30361 2.31973 -151.68428 669.14267
4300.0000 -158.36256 -153.76398 4.59857 2.25799 -152.67217 651.09642
4305.0000 -159.03704 -154.41234 4.62470 2.17290 -154.03361 593.33284
4310.0000 -158.09522 -151.96609 6.12912 2.21253 -153.39952 613.50453
4315.0000 -157.60707 -151.92630 5.68077 2.31679 -151.73135 691.82759
4320.0000 -157.73830 -151.01056 6.72774 2.32570 -151.58882 711.77856
4325.0000 -158.60700 -152.23654 6.37046 2.30583 -151.90666 709.42690
4330.0000 -158.55795 -152.50801 6.04994 2.27501 -152.39983 690.91962
4335.0000 -157.86638 -152.36383 5.50255 2.28947 -152.16843 674.88111
4340.0000 -158.72342 -153.10279 5.62063 2.26604 -152.54341 637.63690
4345.0000 -158.12119 -151.36289 6.75830 2.30323 -151.94826 695.09424
4350.0000 -156.79618 -152.07972 4.71647 2.31857 -151.70295 678.88225
4355.0000 -158.00600 -151.36953 6.63647 2.30379 -151.93932 665.30758
4360.0000 -158.63529 -153.68248 4.95281 2.27963 -152.32592 692.61740
4365.0000 -159.14079 -153.52109 5.61970 2.20684 -153.49055 620.47699
4370.0000 -158.78473 -153.21639 5.56834 2.20287 -153.55415 617.11619
4375.0000 -158.84897 -153.05819 5.79079 2.23461 -153.04617 640.46072
4380.0000 -156.92138 -151.20537 5.71601 2.29768 -152.03711 668.12668
4385.0000 -156.91412 -151.48372 5.43040 2.30739 -151.88172 665.40100
4390.0000 -158.14836 -151.24501 6.90335 2.36342 -150.98523 715.53729
4395.0000 -158.20757 -152.19486 6.01271 2.27746 -152.36058 659.03194
4400.0000 -158.13154 -152.61634 5.51520 2.28780 -152.19526 667.78399
4405.0000 -157.80329 -152.37629 5.42701 2.26399 -152.57609 646.22046
4410.0000 -158.22364 -152.06424 6.15940 2.30898 -151.85626 681.27899
4415.0000 -158.07371 -153.04637 5.02734 2.26847 -152.50450 644.47398
4420.0000 -157.96421 -152.77065 5.19356 2.22424 -153.21219 633.20640
4425.0000 -158.94859 -153.70187 5.24672 2.20227 -153.56362 644.26326
4430.0000 -158.58940 -152.96085 5.62855 2.23021 -153.11669 649.91050
4435.0000 -158.64925 -154.23831 4.41094 2.17145 -154.05676 556.64264
4440.0000 -158.40795 -153.62685 4.78110 2.15255 -154.35925 544.70788
4445.0000 -157.79365 -152.18102 5.61263 2.25731 -152.68299 633.08321
4450.0000 -156.87822 -150.95720 5.92102 2.34931 -151.21112 687.13055
4455.0000 -156.10188 -150.62667 5.47521 2.41744 -150.12100 728.42084
4460.0000 -158.96949 -151.99768 6.97181 2.35551 -151.11186 721.51292
4465.0000 -159.16472 -153.46417 5.70054 2.29285 -152.11438 696.96342
4470.0000 -158.34436 -152.61526 5.72910 2.20288 -153.55395 620.97433
4475.0000 -158.61582 -152.95290 5.66292 2.27679 -152.37140 684.23117
4480.0000 -158.76842 -153.73353 5.03489 2.21181 -153.41097 616.71281
4485.0000 -157.94329 -153.44837 4.49492 2.18610 -153.82247 597.62870
4490.0000 -157.85277 -152.59146 5.26130 2.19555 -153.67119 611.80478
4495.0000 -159.05861 -153.74462 5.31399 2.20117 -153.58130 601.83604
4500.0000 -157.59439 -152.69218 4.90220 2.20445 -153.52881 597.67330
FREEZING PROCESS: loop number 19 T-loop= 643.00000000000000
main_MD> interactions number 19 at Temperature= 643.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.39113 4.35344 -1.35405
force_rgl> df(natom) 0.88020 3.35092 9.86889
4505.0000 -158.76157 -153.05025 5.71132 2.22500 -153.19994 649.22736
4510.0000 -159.89055 -153.25058 6.63997 2.21871 -153.30058 647.21692
4515.0000 -157.31690 -151.92120 5.39570 2.24773 -152.83632 628.95655
4520.0000 -157.97680 -152.53251 5.44428 2.26327 -152.58770 635.47766
4525.0000 -156.99286 -150.06264 6.93021 2.31856 -151.70312 691.51960
4530.0000 -157.92271 -153.38262 4.54008 2.32632 -151.57883 695.82750
4535.0000 -158.18218 -153.51081 4.67138 2.18766 -153.79742 589.18247
4540.0000 -157.27817 -151.48172 5.79645 2.24900 -152.81603 649.66246
4545.0000 -158.75708 -153.06296 5.69412 2.27125 -152.45993 655.88288
4550.0000 -157.72466 -151.99967 5.72499 2.28987 -152.16202 680.89068
4555.0000 -158.12279 -152.22585 5.89694 2.32929 -151.53135 726.95495
4560.0000 -158.38694 -153.20485 5.18209 2.25219 -152.76494 676.60124
4565.0000 -158.64374 -152.73091 5.91283 2.21622 -153.34041 611.55718
4570.0000 -158.89455 -153.05302 5.84153 2.24079 -152.94739 656.73749
4575.0000 -159.63153 -153.94049 5.69104 2.20625 -153.49995 606.80036
4580.0000 -158.46790 -153.81071 4.65719 2.16690 -154.12962 593.88972
4585.0000 -158.90820 -153.51295 5.39525 2.18432 -153.85089 606.28907
4590.0000 -158.71199 -154.10425 4.60774 2.22154 -153.25536 631.13860
4595.0000 -158.34584 -153.07839 5.26744 2.22361 -153.22225 619.93104
4600.0000 -159.37292 -153.54659 5.82633 2.21230 -153.40320 617.87958
4605.0000 -158.45825 -153.30162 5.15663 2.22649 -153.17616 636.36834
4610.0000 -158.30614 -153.19678 5.10935 2.22611 -153.18220 641.15717
4615.0000 -157.99826 -153.24878 4.74949 2.21965 -153.28566 628.13655
4620.0000 -158.22531 -153.88655 4.33876 2.20873 -153.46030 597.54367
4625.0000 -159.62897 -155.08719 4.54178 2.12173 -154.85232 543.55844
4630.0000 -159.37515 -153.94100 5.43415 2.14630 -154.45921 597.79753
4635.0000 -159.15643 -153.04851 6.10792 2.20225 -153.56408 634.34485
4640.0000 -157.55467 -152.43479 5.11988 2.22691 -153.16941 626.41850
4645.0000 -158.16082 -152.90614 5.25468 2.26764 -152.51775 663.32884
4650.0000 -158.53894 -153.89623 4.64272 2.20322 -153.54842 623.63651
4655.0000 -158.72640 -153.60587 5.12053 2.19184 -153.73062 615.29794
4660.0000 -159.21858 -154.39528 4.82329 2.20523 -153.51625 664.77633
4665.0000 -159.13923 -153.03506 6.10417 2.19573 -153.66825 658.89936
4670.0000 -157.74185 -153.07175 4.67010 2.24097 -152.94447 647.84303
4675.0000 -157.32671 -152.55574 4.77096 2.24367 -152.90122 641.23092
4680.0000 -158.33189 -152.54797 5.78393 2.27286 -152.43419 676.74225
4685.0000 -157.73496 -152.65616 5.07880 2.30062 -151.99002 686.23604
4690.0000 -158.29326 -153.20954 5.08372 2.27831 -152.34712 652.14885
4695.0000 -157.33787 -152.27172 5.06615 2.21149 -153.41611 587.94714
4700.0000 -157.54250 -151.83638 5.70612 2.27903 -152.33554 661.98287
4705.0000 -158.35430 -151.90035 6.45395 2.30877 -151.85961 690.55337
4710.0000 -158.11709 -153.04481 5.07228 2.26452 -152.56763 664.30603
4715.0000 -158.97130 -154.58323 4.38807 2.19787 -153.63403 610.30291
4720.0000 -157.60398 -151.83699 5.76699 2.25862 -152.66214 649.52562
4725.0000 -157.86157 -151.57243 6.28914 2.28713 -152.20585 674.15862
4730.0000 -156.66013 -151.85532 4.80481 2.33580 -151.42721 726.45589
4735.0000 -158.45449 -154.06044 4.39406 2.22917 -153.13334 604.25765
4740.0000 -159.39883 -154.63026 4.76857 2.18954 -153.76728 582.45819
4745.0000 -158.70528 -153.92546 4.77982 2.12723 -154.76440 531.10036
4750.0000 -158.87322 -153.10991 5.76331 2.21463 -153.36600 624.01982
FREEZING PROCESS: loop number 20 T-loop= 618.00000000000000
main_MD> interactions number 20 at Temperature= 618.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.77839 -1.04625 0.64024
force_rgl> df(natom) 0.70139 0.19943 -1.45960
4755.0000 -158.25292 -152.13586 6.11706 2.25378 -152.73945 658.01685
4760.0000 -156.94214 -151.86046 5.08168 2.29167 -152.13327 693.03158
4765.0000 -157.24334 -152.22718 5.01616 2.28667 -152.21335 668.02475
4770.0000 -158.39643 -153.06602 5.33041 2.23657 -153.01483 623.24845
4775.0000 -158.69927 -152.97573 5.72353 2.27133 -152.45865 660.71123
4780.0000 -158.88647 -154.54650 4.33997 2.19875 -153.62003 600.80553
4785.0000 -159.25138 -153.95170 5.29968 2.15319 -154.34894 566.83584
4790.0000 -159.68216 -155.22028 4.46187 2.13084 -154.70650 577.98809
4795.0000 -158.12503 -153.31022 4.81480 2.15783 -154.27470 589.95979
4800.0000 -158.08740 -152.92300 5.16439 2.21770 -153.31676 622.56642
4805.0000 -157.48541 -152.66431 4.82110 2.26151 -152.61589 631.53721
4810.0000 -157.18110 -153.66687 3.51423 2.24301 -152.91184 610.27534
4815.0000 -158.04527 -152.68790 5.35737 2.21090 -153.42555 600.16361
4820.0000 -158.86002 -153.01050 5.84952 2.28152 -152.29570 659.45440
4825.0000 -158.33339 -152.84016 5.49323 2.21037 -153.43408 611.59956
4830.0000 -158.32228 -154.17535 4.14692 2.20196 -153.56870 595.97834
4835.0000 -158.25262 -153.18575 5.06687 2.19369 -153.70093 587.16012
4840.0000 -158.20803 -152.46058 5.74744 2.23879 -152.97929 632.33803
4845.0000 -158.88676 -153.88152 5.00524 2.25427 -152.73163 619.86836
4850.0000 -158.57377 -153.46338 5.11040 2.20175 -153.57199 598.20771
4855.0000 -158.24906 -152.99308 5.25598 2.22674 -153.17209 621.09113
4860.0000 -157.80902 -153.25592 4.55310 2.22755 -153.15921 614.11818
4865.0000 -158.65081 -152.74528 5.90553 2.24950 -152.80800 638.31819
4870.0000 -156.92826 -152.00704 4.92122 2.29332 -152.10682 675.10836
4875.0000 -158.97937 -152.48583 6.49354 2.24839 -152.82573 642.90141
4880.0000 -158.07042 -153.32180 4.74862 2.26802 -152.51176 642.27727
4885.0000 -159.27553 -154.05805 5.21748 2.18472 -153.84443 604.03392
4890.0000 -158.56481 -152.85372 5.71109 2.21701 -153.32786 638.00260
4895.0000 -157.93632 -152.95770 4.97863 2.20318 -153.54908 600.19328
4900.0000 -157.84192 -152.38976 5.45217 2.24083 -152.94668 616.16500
4905.0000 -157.85352 -152.60424 5.24929 2.24210 -152.92639 635.93907
4910.0000 -158.37642 -153.20490 5.17153 2.25285 -152.75439 656.96848
4915.0000 -158.85674 -154.21053 4.64621 2.20486 -153.52226 608.14034
4920.0000 -158.64706 -154.21932 4.42774 2.16680 -154.13113 583.75135
4925.0000 -158.68318 -153.61062 5.07256 2.18160 -153.89438 590.88910
4930.0000 -159.44886 -153.96661 5.48225 2.21246 -153.40060 635.01205
4935.0000 -158.50951 -153.28159 5.22792 2.21287 -153.39406 664.39340
4940.0000 -159.93014 -155.00228 4.92786 2.16385 -154.17837 585.13281
4945.0000 -159.58327 -154.03516 5.54812 2.14543 -154.47313 588.18646
4950.0000 -158.21912 -153.18618 5.03294 2.19417 -153.69336 622.33483
4955.0000 -159.85489 -154.66528 5.18961 2.16026 -154.23588 587.68702
4960.0000 -158.99852 -154.05805 4.94047 2.16055 -154.23119 616.03412
4965.0000 -158.64561 -154.18098 4.46463 2.17741 -153.96150 606.61104
4970.0000 -159.07448 -153.44301 5.63147 2.18578 -153.82747 618.29200
4975.0000 -159.02910 -153.39211 5.63699 2.21255 -153.39914 656.43131
4980.0000 -158.99840 -153.48480 5.51360 2.23329 -153.06741 662.57191
4985.0000 -158.31105 -153.45377 4.85728 2.18669 -153.81292 584.24477
4990.0000 -158.27616 -152.93888 5.33728 2.22945 -153.12877 604.21915
4995.0000 -158.91907 -153.44877 5.47030 2.20083 -153.58673 599.79061
5000.0000 -159.31746 -154.50095 4.81651 2.20516 -153.51743 606.38615
FREEZING PROCESS: loop number 21 T-loop= 593.00000000000000
main_MD> interactions number 21 at Temperature= 593.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 4.90688 -0.16115 5.44689
force_rgl> df(natom) -4.13053 5.95510 0.35661
5005.0000 -158.47624 -154.15489 4.32135 2.16755 -154.11924 566.89721
5010.0000 -158.66429 -154.08918 4.57511 2.18032 -153.91485 605.50546
5015.0000 -159.15579 -154.52191 4.63388 2.15944 -154.24894 583.49996
5020.0000 -159.38913 -154.29259 5.09654 2.15650 -154.29592 579.29139
5025.0000 -159.04995 -154.28693 4.76302 2.14057 -154.55091 607.22076
5030.0000 -158.37626 -153.22541 5.15085 2.22586 -153.18616 621.88391
5035.0000 -158.39204 -152.98473 5.40731 2.23469 -153.04500 623.77000
5040.0000 -158.11918 -153.06951 5.04967 2.21511 -153.35825 613.45036
5045.0000 -158.80698 -153.05047 5.75650 2.21942 -153.28931 627.65715
5050.0000 -157.77942 -152.72801 5.05142 2.22038 -153.27398 624.63106
5055.0000 -159.73778 -154.22851 5.50927 2.19980 -153.60317 592.73039
5060.0000 -159.72505 -154.56595 5.15910 2.13931 -154.57102 549.34910
5065.0000 -158.43502 -153.68093 4.75409 2.16803 -154.11150 592.25409
5070.0000 -159.66504 -154.98736 4.67768 2.14343 -154.50510 586.06383
5075.0000 -159.13468 -154.89385 4.24083 2.10344 -155.14493 558.48774
5080.0000 -158.87331 -153.71140 5.16191 2.16696 -154.12869 578.95045
5085.0000 -159.49306 -154.24459 5.24846 2.16014 -154.23780 577.68333
5090.0000 -158.52977 -154.45303 4.07674 2.14671 -154.45258 561.98335
5095.0000 -158.94967 -153.66951 5.28016 2.17528 -153.99550 572.87615
5100.0000 -158.86805 -153.06344 5.80461 2.21508 -153.35879 623.60768
5105.0000 -158.35534 -153.39793 4.95741 2.21831 -153.30705 637.34687
5110.0000 -158.23864 -153.92223 4.31642 2.20263 -153.55790 601.66768
5115.0000 -157.98751 -152.87153 5.11598 2.20937 -153.45008 595.66827
5120.0000 -159.55537 -153.40573 6.14964 2.24363 -152.90195 642.16384
5125.0000 -159.09859 -154.73384 4.36475 2.17027 -154.07561 595.58608
5130.0000 -158.85375 -154.67619 4.17755 2.16556 -154.15105 591.96723
5135.0000 -159.19238 -154.70881 4.48357 2.16537 -154.15411 584.02001
5140.0000 -159.48913 -155.49425 3.99488 2.10475 -155.12399 537.47657
5145.0000 -159.77841 -155.27526 4.50315 2.10641 -155.09743 527.23982
5150.0000 -159.21174 -153.90656 5.30518 2.14993 -154.40111 582.43290
5155.0000 -159.45856 -154.13809 5.32047 2.18342 -153.86523 604.43053
5160.0000 -159.58774 -154.62986 4.95789 2.17430 -154.01113 607.16688
5165.0000 -158.84081 -154.45384 4.38697 2.12879 -154.73940 571.37774
5170.0000 -158.76684 -153.50518 5.26166 2.18401 -153.85581 609.99148
5175.0000 -159.51205 -154.48662 5.02543 2.13110 -154.70246 592.10566
5180.0000 -158.71674 -154.61140 4.10534 2.12863 -154.74189 578.27662
5185.0000 -159.02469 -154.64516 4.37953 2.14967 -154.40529 577.48316
5190.0000 -158.65629 -154.14939 4.50690 2.14799 -154.43212 565.02428
5195.0000 -159.51891 -155.56389 3.95501 2.08227 -155.48363 497.46792
5200.0000 -158.95641 -153.38334 5.57307 2.13892 -154.57732 565.51554
5205.0000 -157.99412 -153.13063 4.86350 2.18681 -153.81106 578.96496
5210.0000 -158.29766 -153.52641 4.77124 2.24189 -152.92971 631.76251
5215.0000 -157.90098 -152.91913 4.98186 2.24081 -152.94710 598.53457
5220.0000 -159.23765 -153.93693 5.30072 2.22518 -153.19704 627.50984
5225.0000 -158.62931 -154.17069 4.45862 2.15203 -154.36745 561.51943
5230.0000 -159.10938 -154.29999 4.80939 2.19630 -153.65916 578.51790
5235.0000 -158.65641 -154.05074 4.60568 2.17881 -153.93905 600.68817
5240.0000 -158.83704 -154.43108 4.40596 2.16719 -154.12494 562.41134
5245.0000 -158.19694 -152.98103 5.21591 2.20196 -153.56863 612.98652
5250.0000 -159.00511 -154.05448 4.95062 2.21987 -153.28207 647.42524
FREEZING PROCESS: loop number 22 T-loop= 568.00000000000000
main_MD> interactions number 22 at Temperature= 568.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.84476 -0.55181 -1.43613
force_rgl> df(natom) -3.84718 1.42012 1.33316
5255.0000 -158.78885 -154.13667 4.65218 2.16036 -154.23425 614.10740
5260.0000 -158.29736 -154.09604 4.20132 2.12679 -154.77142 574.21761
5265.0000 -158.76574 -155.17010 3.59564 2.13616 -154.62141 556.14605
5270.0000 -159.89381 -155.32843 4.56538 2.08645 -155.41680 520.19192
5275.0000 -159.92610 -155.72900 4.19710 2.08474 -155.44413 545.26304
5280.0000 -159.65198 -154.63330 5.01868 2.08349 -155.46412 532.06876
5285.0000 -160.40978 -155.66360 4.74618 2.09677 -155.25170 549.40529
5290.0000 -160.47966 -156.32454 4.15512 2.05161 -155.97427 521.63321
5295.0000 -159.68265 -154.79576 4.88690 2.10356 -155.14303 577.90635
5300.0000 -159.79039 -154.39293 5.39746 2.13211 -154.68627 583.86226
5305.0000 -159.34080 -155.76402 3.57679 2.09313 -155.30993 522.24914
5310.0000 -159.65779 -155.78750 3.87029 2.08120 -155.50080 530.28422
5315.0000 -159.98294 -155.88479 4.09815 2.07537 -155.59411 536.67020
5320.0000 -161.62154 -157.97916 3.64239 2.01707 -156.52683 505.22960
5325.0000 -160.77440 -157.18773 3.58667 1.94774 -157.63620 455.14566
5330.0000 -160.27617 -155.39030 4.88588 2.05345 -155.94479 532.50678
5335.0000 -160.49024 -155.54388 4.94636 2.08114 -155.50174 547.39279
5340.0000 -160.88593 -155.51012 5.37581 2.08987 -155.36213 588.18818
5345.0000 -160.62054 -155.11937 5.50117 2.06835 -155.70638 581.71033
5350.0000 -159.60335 -155.02978 4.57357 2.12987 -154.72213 577.33655
5355.0000 -160.13769 -155.80367 4.33402 2.13004 -154.71931 587.53355
5360.0000 -160.41537 -155.97222 4.44315 2.07188 -155.64989 556.50470
5365.0000 -160.21916 -156.07569 4.14347 2.04001 -156.15988 548.28814
5370.0000 -160.27839 -155.53285 4.74554 2.10027 -155.19574 583.47494
5375.0000 -159.43464 -154.87846 4.55619 2.09583 -155.26670 549.97214
5380.0000 -158.92978 -154.17554 4.75425 2.10125 -155.18006 579.34868
5385.0000 -158.87017 -154.81913 4.05105 2.15160 -154.37433 620.29579
5390.0000 -160.29799 -155.61732 4.68067 2.14889 -154.41781 617.63528
5395.0000 -160.09991 -156.12432 3.97559 2.07148 -155.65625 530.08972
5400.0000 -160.47644 -155.19568 5.28076 2.10182 -155.17090 576.04816
5405.0000 -160.31564 -155.12438 5.19126 2.09233 -155.32271 581.48658
5410.0000 -159.36575 -154.92398 4.44177 2.11783 -154.91475 577.20555
5415.0000 -160.52578 -156.59938 3.92640 2.07653 -155.57553 539.39617
5420.0000 -159.74773 -155.51537 4.23236 2.03827 -156.18775 507.65915
5425.0000 -160.17841 -156.01125 4.16716 2.06273 -155.79631 546.84149
5430.0000 -160.07549 -155.10803 4.96746 2.06566 -155.74949 527.99195
5435.0000 -160.34566 -155.40956 4.93610 2.10901 -155.05579 545.68269
5440.0000 -160.49192 -155.41838 5.07354 2.07305 -155.63119 552.80067
5445.0000 -159.86388 -155.41872 4.44517 2.09506 -155.27907 564.36093
5450.0000 -159.53295 -155.37184 4.16111 2.11923 -154.89231 543.73745
5455.0000 -160.47576 -156.12888 4.34688 2.07504 -155.59938 524.93693
5460.0000 -160.09041 -155.40372 4.68669 2.05249 -155.96013 513.10823
5465.0000 -160.17295 -155.28610 4.88685 2.08845 -155.38478 555.38901
5470.0000 -159.97552 -156.10111 3.87441 2.11229 -155.00333 586.19014
5475.0000 -160.36298 -156.00979 4.35318 2.04407 -156.09484 515.31160
5480.0000 -160.14029 -156.33403 3.80626 2.03138 -156.29795 533.85139
5485.0000 -160.26100 -155.90906 4.35194 2.05443 -155.92914 553.52031
5490.0000 -160.24660 -155.24322 5.00339 2.08781 -155.39508 579.01430
5495.0000 -160.69520 -156.15234 4.54286 2.04912 -156.01409 557.11297
5500.0000 -160.52380 -155.66001 4.86379 2.06087 -155.82607 559.21490
FREEZING PROCESS: loop number 23 T-loop= 543.00000000000000
main_MD> interactions number 23 at Temperature= 543.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.08837 1.05992 2.28780
force_rgl> df(natom) 1.01845 -2.28973 1.41161
5505.0000 -160.76770 -156.83808 3.92962 2.03808 -156.19065 548.07613
5510.0000 -161.21857 -156.22055 4.99801 2.01054 -156.63139 521.92679
5515.0000 -159.77553 -155.95767 3.81786 2.07156 -155.65500 542.28880
5520.0000 -159.92029 -155.10352 4.81677 2.09110 -155.34247 534.42735
5525.0000 -159.69345 -155.54364 4.14981 2.11922 -154.89250 551.78208
5530.0000 -159.87567 -156.45658 3.41908 2.05329 -155.94742 486.38742
5535.0000 -159.19531 -154.56779 4.62752 2.10209 -155.16656 507.37512
5540.0000 -159.82103 -155.63325 4.18779 2.09436 -155.29031 512.38146
5545.0000 -159.88820 -155.54186 4.34633 2.08906 -155.37509 543.91357
5550.0000 -159.63398 -154.42236 5.21161 2.09816 -155.22951 562.41143
5555.0000 -160.97880 -155.80965 5.16914 2.09844 -155.22502 558.46981
5560.0000 -160.18799 -156.21864 3.96934 2.03283 -156.27470 507.52089
5565.0000 -160.12976 -155.62274 4.50702 2.03676 -156.21183 508.71848
5570.0000 -159.95210 -155.73464 4.21746 2.07927 -155.53169 523.32839
5575.0000 -159.47607 -155.39214 4.08393 2.03709 -156.20663 498.60576
5580.0000 -159.85760 -155.40362 4.45399 2.06854 -155.70342 506.66890
5585.0000 -159.39291 -154.71199 4.68092 2.09300 -155.31192 509.36320
5590.0000 -159.22835 -155.12461 4.10375 2.09700 -155.24807 520.86547
5595.0000 -159.09357 -154.26659 4.82698 2.11233 -155.00276 558.23284
5600.0000 -159.60707 -155.44045 4.16663 2.10795 -155.07282 561.01365
5605.0000 -160.39988 -156.34606 4.05382 2.05755 -155.87919 508.59440
5610.0000 -160.40920 -156.11726 4.29194 2.04133 -156.13878 506.92078
5615.0000 -159.62734 -156.20222 3.42512 2.05214 -155.96583 504.07989
5620.0000 -159.03553 -154.46322 4.57231 2.08585 -155.42640 526.93389
5625.0000 -158.81407 -154.42058 4.39349 2.12087 -154.86603 545.76643
5630.0000 -158.99423 -154.01130 4.98293 2.14116 -154.54137 560.78450
5635.0000 -157.87825 -153.77516 4.10309 2.20055 -153.59115 599.71428
5640.0000 -159.27350 -154.17132 5.10219 2.16634 -154.13849 570.89842
5645.0000 -159.40767 -154.54753 4.86014 2.14791 -154.43344 584.82548
5650.0000 -159.69636 -155.15972 4.53664 2.12923 -154.73232 556.28402
5655.0000 -159.21126 -154.81321 4.39805 2.13308 -154.67066 577.20308
5660.0000 -158.99246 -154.40417 4.58830 2.14703 -154.44755 591.56874
5665.0000 -159.13613 -155.19740 3.93873 2.13088 -154.70591 566.28662
5670.0000 -159.97097 -155.68318 4.28779 2.11062 -155.03015 539.77109
5675.0000 -159.24369 -154.68591 4.55778 2.14163 -154.53398 562.30772
5680.0000 -160.07148 -155.98345 4.08804 2.08384 -155.45864 510.77315
5685.0000 -160.49082 -156.34233 4.14850 2.06192 -155.80935 507.40531
5690.0000 -159.76541 -155.92357 3.84185 2.04607 -156.06295 506.21481
5695.0000 -159.90973 -154.65778 5.25195 2.10014 -155.19771 536.07935
5700.0000 -159.15457 -154.15357 5.00099 2.13439 -154.64983 556.21240
5705.0000 -159.28040 -155.12904 4.15136 2.12056 -154.87110 540.15848
5710.0000 -159.56238 -154.65666 4.90572 2.12636 -154.77822 529.90652
5715.0000 -158.80875 -154.31126 4.49749 2.13028 -154.71558 554.63171
5720.0000 -158.97560 -154.03650 4.93909 2.14210 -154.52643 538.67254
5725.0000 -159.30699 -154.22364 5.08336 2.19081 -153.74708 594.65185
5730.0000 -159.02203 -153.74188 5.28015 2.17254 -154.03939 592.54727
5735.0000 -159.12241 -154.38086 4.74155 2.16195 -154.20887 581.13823
5740.0000 -159.44204 -154.80423 4.63781 2.16400 -154.17605 592.43232
5745.0000 -159.81869 -155.59068 4.22801 2.08934 -155.37062 515.71683
5750.0000 -160.17601 -155.31535 4.86066 2.09201 -155.32780 534.93595
FREEZING PROCESS: loop number 24 T-loop= 518.00000000000000
main_MD> interactions number 24 at Temperature= 518.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.15361 1.61749 0.06394
force_rgl> df(natom) 0.40457 1.62203 2.81959
5755.0000 -160.28550 -156.48534 3.80016 2.03323 -156.26833 496.93473
5760.0000 -159.61502 -154.81227 4.80275 2.07842 -155.54521 528.33371
5765.0000 -160.17703 -156.19784 3.97919 2.09018 -155.35715 513.83191
5770.0000 -158.88435 -155.18302 3.70133 2.04708 -156.04669 497.64705
5775.0000 -159.83501 -155.78832 4.04669 2.07133 -155.65873 513.10367
5780.0000 -159.66123 -155.02114 4.64009 2.07406 -155.61499 524.88408
5785.0000 -160.35141 -155.92022 4.43120 2.09463 -155.28586 531.06818
5790.0000 -160.28505 -156.34640 3.93865 2.03999 -156.16023 502.02069
5795.0000 -160.59268 -156.74951 3.84316 2.02043 -156.47309 496.90079
5800.0000 -160.66195 -156.49231 4.16964 1.98693 -157.00905 458.89266
5805.0000 -159.98418 -155.73006 4.25412 2.01658 -156.53469 494.23185
5810.0000 -159.59740 -155.06150 4.53590 2.09992 -155.20126 543.72514
5815.0000 -159.00209 -155.03425 3.96784 2.09334 -155.30660 522.92331
5820.0000 -159.64624 -155.42500 4.22125 2.11228 -155.00356 533.76194
5825.0000 -160.00656 -155.78034 4.22622 2.02936 -156.33019 480.58350
5830.0000 -160.03811 -156.09558 3.94254 2.04729 -156.04344 497.57937
5835.0000 -161.04513 -156.41745 4.62768 2.03738 -156.20196 493.50328
5840.0000 -160.90635 -156.54019 4.36616 1.98527 -157.03576 469.06127
5845.0000 -160.71421 -155.87822 4.83599 2.02112 -156.46201 493.71073
5850.0000 -161.10033 -156.94406 4.15627 2.04314 -156.10972 510.98970
5855.0000 -161.45929 -157.96340 3.49589 1.95951 -157.44791 456.28283
5860.0000 -159.82980 -155.61844 4.21136 2.01578 -156.54757 478.39137
5865.0000 -160.54979 -155.91890 4.63088 2.04457 -156.08686 525.86386
5870.0000 -159.89145 -155.18722 4.70424 2.06281 -155.79505 544.03343
5875.0000 -159.63465 -155.02369 4.61097 2.09029 -155.35544 547.54739
5880.0000 -159.77582 -154.89191 4.88391 2.12778 -154.75546 572.26918
5885.0000 -159.48396 -155.23628 4.24768 2.06647 -155.73650 512.44417
5890.0000 -159.03178 -154.43193 4.59985 2.10885 -155.05845 547.77427
5895.0000 -159.87454 -156.12670 3.74783 2.08345 -155.46486 536.12032
5900.0000 -160.18726 -156.20266 3.98460 2.05731 -155.88298 516.13123
5905.0000 -160.11001 -155.32316 4.78685 2.06748 -155.72033 514.30724
5910.0000 -158.61402 -154.33976 4.27426 2.07942 -155.52936 519.34936
5915.0000 -158.88435 -154.71445 4.16990 2.11380 -154.97923 536.58399
5920.0000 -158.54672 -154.33333 4.21339 2.14355 -154.50325 555.94445
5925.0000 -159.85778 -155.81490 4.04288 2.09589 -155.26576 529.19242
5930.0000 -160.52451 -156.88589 3.63862 2.04014 -156.15779 465.70337
5935.0000 -160.51556 -156.65532 3.86024 2.01097 -156.62445 474.67790
5940.0000 -160.13043 -155.86633 4.26409 2.03002 -156.31966 508.00408
5945.0000 -161.28199 -157.35965 3.92233 2.03918 -156.17309 500.13307
5950.0000 -160.84492 -156.67259 4.17233 1.97965 -157.12557 477.29692
5955.0000 -160.07928 -156.30329 3.77599 1.99126 -156.93991 467.05480
5960.0000 -159.87522 -155.68293 4.19229 2.06634 -155.73861 499.94074
5965.0000 -159.67894 -155.10352 4.57542 2.04432 -156.09090 477.58975
5970.0000 -159.21194 -154.95359 4.25834 2.13493 -154.64108 561.24210
5975.0000 -159.06220 -155.06077 4.00143 2.10026 -155.19580 549.89281
5980.0000 -158.19116 -154.46910 3.72206 2.14209 -154.52663 549.92113
5985.0000 -159.58197 -155.15882 4.42316 2.10322 -155.14848 551.46965
5990.0000 -159.82687 -154.32031 5.50656 2.12045 -154.87282 565.01683
5995.0000 -158.34783 -152.90721 5.44061 2.19840 -153.62563 611.38002
6000.0000 -158.32513 -154.03064 4.29449 2.18799 -153.79212 587.04810
FREEZING PROCESS: loop number 25 T-loop= 493.00000000000000
main_MD> interactions number 25 at Temperature= 493.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.16207 -1.51072 -1.17816
force_rgl> df(natom) -1.61362 -0.86645 1.73777
6005.0000 -159.71941 -155.13286 4.58655 2.11682 -154.93096 537.31582
6010.0000 -160.26459 -155.87745 4.38714 2.08552 -155.43160 526.87196
6015.0000 -159.32686 -156.12683 3.20004 2.05596 -155.90462 504.83935
6020.0000 -159.94697 -155.35384 4.59313 2.10461 -155.12632 549.89083
6025.0000 -159.03031 -154.59818 4.43213 2.09895 -155.21682 517.74439
6030.0000 -160.16885 -155.90622 4.26264 2.12367 -154.82136 542.04095
6035.0000 -159.52814 -155.39678 4.13136 2.08326 -155.46776 509.79528
6040.0000 -159.17141 -155.53485 3.63656 2.07680 -155.57124 503.84081
6045.0000 -160.88211 -157.37219 3.50993 2.02867 -156.34121 477.37358
6050.0000 -160.97472 -156.68556 4.28915 2.01004 -156.63928 465.91944
6055.0000 -159.68573 -155.56098 4.12475 2.07123 -155.66038 518.29964
6060.0000 -160.49436 -156.68267 3.81169 2.06522 -155.75648 519.88982
6065.0000 -160.22514 -156.64843 3.57670 1.99668 -156.85310 462.10306
6070.0000 -160.05844 -156.04195 4.01650 2.00129 -156.77934 469.70310
6075.0000 -160.07219 -155.95711 4.11509 2.03715 -156.20566 492.71581
6080.0000 -160.05334 -156.30450 3.74884 2.06690 -155.72953 500.06327
6085.0000 -159.79009 -155.41502 4.37506 2.09758 -155.23878 534.41601
6090.0000 -159.17359 -154.96927 4.20432 2.08145 -155.49683 533.76948
6095.0000 -159.40705 -155.31169 4.09536 2.09940 -155.20959 521.61633
6100.0000 -160.77622 -156.91156 3.86467 2.06448 -155.76826 512.31006
6105.0000 -159.79741 -155.43332 4.36409 2.04942 -156.00923 509.12258
6110.0000 -161.00670 -156.39368 4.61301 2.04233 -156.12265 532.55057
6115.0000 -160.55760 -156.23466 4.32294 2.03215 -156.28560 527.28419
6120.0000 -160.48927 -156.52547 3.96381 2.02344 -156.42491 492.58491
6125.0000 -160.25574 -156.13708 4.11866 2.01520 -156.55674 481.00647
6130.0000 -160.93957 -157.11698 3.82259 2.00748 -156.68024 475.94043
6135.0000 -160.60336 -157.07633 3.52704 2.00075 -156.78800 460.78105
6140.0000 -161.05744 -156.66201 4.39543 2.01356 -156.58310 477.77857
6145.0000 -160.11828 -155.08392 5.03436 2.05927 -155.85170 519.72013
6150.0000 -160.77936 -157.35875 3.42062 2.03310 -156.27048 494.59947
6155.0000 -161.70708 -157.45339 4.25368 1.95880 -157.45919 470.82171
6160.0000 -160.90961 -156.79461 4.11500 1.98367 -157.06126 477.27461
6165.0000 -161.19101 -157.21885 3.97216 2.00814 -156.66978 502.47340
6170.0000 -160.80977 -157.02878 3.78098 1.98506 -157.03899 482.06171
6175.0000 -161.57110 -158.00562 3.56548 1.95104 -157.58328 459.57111
6180.0000 -160.85833 -156.79188 4.06645 1.96978 -157.28359 475.96748
6185.0000 -161.38528 -157.89361 3.49167 1.97474 -157.20415 495.67839
6190.0000 -161.41728 -157.35433 4.06295 1.94015 -157.75752 462.31515
6195.0000 -161.51622 -157.70089 3.81533 1.97680 -157.17124 482.10183
6200.0000 -161.18962 -156.74236 4.44725 1.96175 -157.41201 465.69516
6205.0000 -160.69064 -156.68945 4.00119 2.00765 -156.67764 506.83266
6210.0000 -161.11910 -156.79215 4.32694 1.98303 -157.07156 494.69944
6215.0000 -161.95667 -157.76156 4.19511 1.96416 -157.37350 494.81623
6220.0000 -160.49834 -156.94770 3.55064 1.97035 -157.27446 492.90005
6225.0000 -160.80257 -156.75450 4.04807 1.99825 -156.82804 518.08347
6230.0000 -160.52195 -156.19833 4.32362 2.02867 -156.34121 536.00565
6235.0000 -161.15232 -157.22401 3.92832 2.02778 -156.35556 536.99188
6240.0000 -161.31721 -157.57593 3.74128 1.96808 -157.31065 477.30242
6245.0000 -161.00779 -156.97434 4.03345 1.96083 -157.42672 467.32075
6250.0000 -161.52306 -157.24102 4.28204 1.96930 -157.29125 486.42866
FREEZING PROCESS: loop number 26 T-loop= 468.00000000000000
main_MD> interactions number 26 at Temperature= 468.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.05121 -0.83037 -1.11832
force_rgl> df(natom) -1.65269 -3.67355 3.69494
6255.0000 -160.45425 -156.98543 3.46883 1.98687 -157.01002 502.49679
6260.0000 -161.65938 -157.90128 3.75809 1.96994 -157.28091 488.26980
6265.0000 -161.02362 -157.29173 3.73189 1.95713 -157.48597 470.06778
6270.0000 -160.87840 -156.27601 4.60239 1.98659 -157.01451 507.46296
6275.0000 -161.28579 -156.90003 4.38575 2.02338 -156.42585 540.64292
6280.0000 -161.49100 -157.53251 3.95849 1.94618 -157.66116 472.41258
6285.0000 -161.77338 -157.87293 3.90045 1.94943 -157.60906 471.50412
6290.0000 -162.21867 -158.34064 3.87803 1.90091 -158.38537 451.50005
6295.0000 -162.35984 -158.86433 3.49551 1.87513 -158.79785 429.54626
6300.0000 -162.14772 -158.08521 4.06251 1.88131 -158.69902 437.85723
6305.0000 -162.01772 -157.82536 4.19236 1.93755 -157.79919 483.78750
6310.0000 -161.23384 -157.51652 3.71732 1.93318 -157.86910 480.19944
6315.0000 -162.01889 -157.66272 4.35616 1.94933 -157.61069 488.94956
6320.0000 -162.16553 -158.55627 3.60926 1.93137 -157.89812 476.04187
6325.0000 -162.44859 -157.95384 4.49476 1.91688 -158.12990 466.34644
6330.0000 -161.70585 -157.54344 4.16241 1.92027 -158.07564 468.43356
6335.0000 -161.31881 -158.06808 3.25073 1.93628 -157.81959 468.89985
6340.0000 -160.62716 -157.04891 3.57825 1.96560 -157.35045 480.91586
6345.0000 -161.70205 -157.59499 4.10706 1.97536 -157.19430 474.64958
6350.0000 -161.26400 -157.68800 3.57600 1.93625 -157.81998 446.97342
6355.0000 -161.06313 -157.81050 3.25263 1.96134 -157.41861 464.76549
6360.0000 -161.15171 -157.57976 3.57196 1.95092 -157.58531 451.91901
6365.0000 -161.84658 -158.22845 3.61814 1.93014 -157.91782 442.83530
6370.0000 -162.61571 -158.88499 3.73072 1.89569 -158.46889 414.47221
6375.0000 -161.87203 -158.05683 3.81519 1.88015 -158.71759 404.73144
6380.0000 -161.74356 -157.48014 4.26342 1.93604 -157.82340 458.03551
6385.0000 -161.88185 -158.24419 3.63766 1.93213 -157.88589 448.96101
6390.0000 -161.38203 -157.89995 3.48208 1.91705 -158.12717 426.40702
6395.0000 -161.93512 -158.32963 3.60549 1.89981 -158.40307 417.98767
6400.0000 -161.41360 -158.02151 3.39210 1.91912 -158.09402 423.11208
6405.0000 -161.69202 -157.88358 3.80843 1.92003 -158.07957 432.21916
6410.0000 -161.27187 -156.86971 4.40216 1.92259 -158.03850 437.66605
6415.0000 -161.13165 -157.03311 4.09855 1.99229 -156.92333 514.12768
6420.0000 -160.90456 -156.95472 3.94984 1.97389 -157.21781 495.07240
6425.0000 -161.20575 -157.28617 3.91959 1.96887 -157.29804 490.53436
6430.0000 -161.02068 -157.31192 3.70876 1.96883 -157.29877 484.32558
6435.0000 -160.72585 -157.15356 3.57229 1.96880 -157.29920 477.82015
6440.0000 -160.94844 -156.92712 4.02132 1.97801 -157.15188 476.51775
6445.0000 -161.98867 -157.94391 4.04476 1.93585 -157.82642 460.05343
6450.0000 -162.12187 -158.69804 3.42383 1.90896 -158.25672 435.34737
6455.0000 -161.06166 -157.23054 3.83112 1.93101 -157.90378 459.09259
6460.0000 -161.57909 -157.47608 4.10301 1.96522 -157.35646 484.02070
6465.0000 -161.60656 -157.53994 4.06662 1.92678 -157.97152 463.65048
6470.0000 -161.09473 -156.72761 4.36712 1.97194 -157.24889 490.58269
6475.0000 -161.16823 -157.49946 3.66877 2.00315 -156.74952 516.46973
6480.0000 -161.44081 -157.50818 3.93263 1.97831 -157.14697 500.61109
6485.0000 -161.82026 -157.65272 4.16754 1.94407 -157.69485 476.86905
6490.0000 -161.19885 -157.37648 3.82237 1.95035 -157.59440 487.36342
6495.0000 -161.36320 -157.80278 3.56043 1.92969 -157.92503 460.96641
6500.0000 -162.17339 -158.28048 3.89291 1.94639 -157.65777 470.73495
FREEZING PROCESS: loop number 27 T-loop= 443.00000000000000
main_MD> interactions number 27 at Temperature= 443.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.31616 -1.03075 1.64108
force_rgl> df(natom) 2.06067 3.04891 -0.17435
6505.0000 -161.94243 -158.15754 3.78489 1.92259 -158.03854 452.45405
6510.0000 -161.95145 -158.48104 3.47041 1.89498 -158.48025 431.74029
6515.0000 -161.57544 -158.54096 3.03449 1.91036 -158.23428 438.27536
6520.0000 -162.60366 -159.11973 3.48394 1.88776 -158.59579 425.37001
6525.0000 -161.80401 -158.51093 3.29308 1.84884 -159.21862 403.26383
6530.0000 -162.24921 -159.13951 3.10970 1.88876 -158.57983 436.12456
6535.0000 -162.37390 -158.11499 4.25891 1.88151 -158.69585 430.73223
6540.0000 -161.90959 -158.40282 3.50677 1.89858 -158.42270 444.54733
6545.0000 -162.18794 -158.73402 3.45392 1.87879 -158.73929 413.97944
6550.0000 -162.27478 -158.88930 3.38548 1.91538 -158.15396 441.55588
6555.0000 -161.85358 -158.20379 3.64980 1.87510 -158.79841 412.73162
6560.0000 -162.43873 -158.62070 3.81804 1.90569 -158.30891 434.86741
6565.0000 -161.78780 -158.31227 3.47553 1.89075 -158.54793 420.10892
6570.0000 -161.94862 -157.98838 3.96024 1.90935 -158.25034 434.07734
6575.0000 -162.46739 -158.94349 3.52390 1.91078 -158.22752 433.06418
6580.0000 -162.17519 -158.51409 3.66110 1.88321 -158.66857 415.87784
6585.0000 -162.01356 -158.76206 3.25150 1.88062 -158.71012 410.64033
6590.0000 -161.84448 -158.69820 3.14627 1.89137 -158.53806 421.62912
6595.0000 -162.03094 -158.67560 3.35534 1.91087 -158.22601 434.60219
6600.0000 -161.88153 -158.78568 3.09585 1.87546 -158.79258 395.41885
6605.0000 -161.56630 -158.03191 3.53439 1.90024 -158.39623 427.18831
6610.0000 -161.94981 -157.89644 4.05337 1.93637 -157.81812 456.78984
6615.0000 -161.61106 -158.14736 3.46370 1.92982 -157.92289 465.69277
6620.0000 -161.60212 -158.80931 2.79281 1.91511 -158.15821 445.66852
6625.0000 -162.65381 -159.16787 3.48594 1.86798 -158.91237 400.10104
6630.0000 -161.85159 -158.28088 3.57071 1.87623 -158.78031 391.98791
6635.0000 -162.09923 -158.44340 3.65583 1.93665 -157.81362 446.84568
6640.0000 -161.64972 -158.49243 3.15729 1.88187 -158.69003 405.34868
6645.0000 -161.54115 -158.19310 3.34805 1.91970 -158.08486 437.67355
6650.0000 -161.64415 -158.22387 3.42028 1.88933 -158.57064 413.23925
6655.0000 -161.42238 -157.69867 3.72371 1.93795 -157.79275 454.94834
6660.0000 -161.59988 -157.80437 3.79550 1.95863 -157.46185 472.06744
6665.0000 -161.72320 -158.17091 3.55229 1.93485 -157.84244 446.22091
6670.0000 -161.32518 -157.59961 3.72557 1.95072 -157.58852 442.87222
6675.0000 -161.08928 -157.26043 3.82886 1.94930 -157.61121 435.69399
6680.0000 -161.28616 -157.68204 3.60411 1.95064 -157.58979 429.16161
6685.0000 -160.60775 -157.61715 2.99060 1.95217 -157.56532 420.78102
6690.0000 -159.74768 -156.14851 3.59917 2.01040 -156.63353 465.32328
6695.0000 -160.16357 -156.41104 3.75253 2.03603 -156.22356 480.28090
6700.0000 -160.05942 -156.14772 3.91170 2.05734 -155.88255 493.70141
6705.0000 -160.85895 -156.40325 4.45570 2.03735 -156.20247 478.94277
6710.0000 -160.95966 -157.02635 3.93330 2.01100 -156.62408 476.46039
6715.0000 -160.70092 -156.27191 4.42901 2.01144 -156.61693 485.50078
6720.0000 -160.44663 -156.81769 3.62894 2.02775 -156.35605 498.31590
6725.0000 -161.12887 -157.23219 3.89668 1.97392 -157.21722 452.10341
6730.0000 -161.05305 -156.86810 4.18495 1.97394 -157.21695 465.92145
6735.0000 -160.52565 -156.85457 3.67108 1.98838 -156.98595 467.88072
6740.0000 -161.34967 -156.90055 4.44912 1.99082 -156.94689 478.44144
6745.0000 -161.20433 -157.40891 3.79542 1.95840 -157.46564 466.28031
6750.0000 -161.79175 -158.42834 3.36341 1.92534 -157.99460 431.44573
FREEZING PROCESS: loop number 28 T-loop= 418.00000000000000
main_MD> interactions number 28 at Temperature= 418.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.52426 0.90503 -0.66531
force_rgl> df(natom) 1.68147 2.50423 -2.52212
6755.0000 -162.59859 -159.48263 3.11596 1.86203 -159.00750 381.99889
6760.0000 -161.81374 -159.16603 2.64771 1.84092 -159.34535 360.00313
6765.0000 -161.89580 -158.88333 3.01247 1.86516 -158.95747 385.71296
6770.0000 -161.29183 -157.96299 3.32884 1.93638 -157.81797 443.10864
6775.0000 -161.09235 -157.15478 3.93757 1.95782 -157.47493 462.45639
6780.0000 -161.53045 -157.87069 3.65976 1.97067 -157.26924 470.08555
6785.0000 -161.41665 -157.43851 3.97814 1.95459 -157.52660 463.24579
6790.0000 -161.79128 -157.92912 3.86216 1.95001 -157.59988 460.69663
6795.0000 -162.03769 -159.17311 2.86458 1.86926 -158.89186 396.50533
6800.0000 -162.14361 -159.52901 2.61460 1.83592 -159.42523 364.99536
6805.0000 -161.61051 -158.69522 2.91529 1.86942 -158.88925 402.96057
6810.0000 -161.98619 -158.47297 3.51323 1.88401 -158.65579 412.60879
6815.0000 -162.22398 -158.73020 3.49378 1.87873 -158.74037 412.84031
6820.0000 -161.91704 -158.34541 3.57163 1.88576 -158.62783 420.47824
6825.0000 -161.67075 -158.67676 2.99399 1.89185 -158.53035 427.54791
6830.0000 -161.20434 -158.45633 2.74801 1.87154 -158.85531 401.46339
6835.0000 -162.13358 -158.77994 3.35364 1.89002 -158.55966 415.83942
6840.0000 -162.16543 -158.77949 3.38594 1.88344 -158.66502 429.91755
6845.0000 -162.27194 -158.77568 3.49625 1.87481 -158.80304 429.55419
6850.0000 -162.44804 -159.21055 3.23749 1.86907 -158.89483 425.95407
6855.0000 -162.48912 -159.19565 3.29347 1.85456 -159.12707 411.26258
6860.0000 -162.80178 -159.56346 3.23832 1.82325 -159.62798 379.48592
6865.0000 -162.76881 -159.80895 2.95985 1.81485 -159.76242 375.10269
6870.0000 -162.51199 -159.44125 3.07074 1.82888 -159.53792 399.18092
6875.0000 -162.73928 -159.69394 3.04534 1.82246 -159.64067 382.89842
6880.0000 -162.18434 -159.50574 2.67860 1.83164 -159.49371 383.34990
6885.0000 -162.73914 -159.62714 3.11200 1.84667 -159.25334 402.50909
6890.0000 -162.44794 -159.06424 3.38370 1.84696 -159.24861 399.56537
6895.0000 -162.71463 -159.36987 3.34476 1.87055 -158.87126 425.25943
6900.0000 -162.53981 -159.82302 2.71679 1.82995 -159.52077 388.36369
6905.0000 -162.39813 -158.68059 3.71753 1.83027 -159.51571 391.78967
6910.0000 -162.62645 -158.71260 3.91385 1.89013 -158.55785 446.90022
6915.0000 -162.70214 -159.22674 3.47541 1.85992 -159.04120 419.26435
6920.0000 -162.84647 -159.40472 3.44175 1.83601 -159.42381 394.29382
6925.0000 -161.90083 -158.90910 2.99173 1.85952 -159.04760 413.30023
6930.0000 -162.58278 -158.71250 3.87028 1.86786 -158.91429 421.10249
6935.0000 -162.74658 -159.38915 3.35744 1.85802 -159.07174 412.83143
6940.0000 -162.63882 -159.64992 2.98889 1.82941 -159.52941 375.13658
6945.0000 -163.30706 -159.55201 3.75504 1.85324 -159.14823 416.73749
6950.0000 -163.04223 -159.90727 3.13496 1.80501 -159.91984 370.08969
6955.0000 -162.60597 -158.93975 3.66622 1.84599 -159.26411 405.15651
6960.0000 -162.51742 -158.97741 3.54000 1.85777 -159.07570 414.23302
6965.0000 -162.45879 -159.45882 2.99997 1.86000 -159.03994 407.83912
6970.0000 -162.07009 -158.86499 3.20510 1.85310 -159.15047 413.46890
6975.0000 -162.08254 -157.94402 4.13852 1.89771 -158.43665 447.23570
6980.0000 -162.14779 -159.16360 2.98418 1.87281 -158.83506 424.53585
6985.0000 -161.76486 -158.71168 3.05318 1.84995 -159.20086 397.48477
6990.0000 -162.11384 -159.07091 3.04293 1.88540 -158.63360 426.82670
6995.0000 -162.53565 -159.50807 3.02758 1.83346 -159.46460 383.32236
7000.0000 -162.92657 -159.82337 3.10320 1.82393 -159.61712 384.55645
FREEZING PROCESS: loop number 29 T-loop= 393.00000000000000
main_MD> interactions number 29 at Temperature= 393.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.91877 0.25007 1.04791
force_rgl> df(natom) 2.39031 0.59024 -0.33875
7005.0000 -162.70841 -159.85539 2.85302 1.81537 -159.75416 379.27682
7010.0000 -162.03979 -159.20920 2.83059 1.81626 -159.73981 377.65942
7015.0000 -162.58035 -159.32057 3.25978 1.81102 -159.82369 375.96786
7020.0000 -162.58753 -160.13083 2.45670 1.85944 -159.04900 416.64776
7025.0000 -162.72609 -159.98413 2.74196 1.78941 -160.16952 355.08321
7030.0000 -163.28859 -160.41915 2.86944 1.81248 -159.80032 377.76004
7035.0000 -162.68600 -159.48840 3.19760 1.82139 -159.65780 377.94750
7040.0000 -162.84062 -159.39500 3.44562 1.84914 -159.21368 403.05221
7045.0000 -163.08209 -159.23101 3.85108 1.84529 -159.27542 402.77935
7050.0000 -163.18252 -159.11167 4.07085 1.84479 -159.28334 406.02470
7055.0000 -162.55760 -158.95722 3.60037 1.84151 -159.33583 401.90355
7060.0000 -162.55973 -159.40152 3.15821 1.84327 -159.30762 399.47667
7065.0000 -163.01402 -159.93637 3.07765 1.84860 -159.22245 409.61701
7070.0000 -162.91563 -159.68582 3.22980 1.82591 -159.58545 382.30646
7075.0000 -163.00887 -159.74832 3.26055 1.81676 -159.73179 373.76849
7080.0000 -162.69974 -159.37853 3.32122 1.84164 -159.33383 388.08937
7085.0000 -162.93519 -159.33503 3.60016 1.84577 -159.26770 400.02156
7090.0000 -162.06775 -159.16526 2.90249 1.83870 -159.38076 402.33303
7095.0000 -162.60870 -159.60666 3.00204 1.83697 -159.40841 385.69509
7100.0000 -163.12088 -160.24671 2.87418 1.79840 -160.02557 362.87981
7105.0000 -162.84539 -159.69441 3.15098 1.80408 -159.93474 366.12619
7110.0000 -162.61971 -159.89556 2.72415 1.79420 -160.09278 361.61117
7115.0000 -163.01210 -160.17739 2.83471 1.79995 -160.00073 365.51397
7120.0000 -162.42923 -158.56325 3.86598 1.81973 -159.68425 378.18819
7125.0000 -162.54247 -159.01847 3.52399 1.86100 -159.02400 421.69086
7130.0000 -162.54853 -159.17530 3.37323 1.85777 -159.07563 409.49393
7135.0000 -162.66738 -159.18235 3.48504 1.86116 -159.02138 417.51634
7140.0000 -162.90218 -159.67669 3.22549 1.83832 -159.38694 390.92435
7145.0000 -162.77425 -159.16614 3.60811 1.81612 -159.74206 375.54077
7150.0000 -162.69874 -159.54248 3.15626 1.85713 -159.08590 408.81388
7155.0000 -162.62836 -160.17697 2.45139 1.82655 -159.57522 382.36652
7160.0000 -162.65383 -159.33842 3.31541 1.82282 -159.63485 387.47414
7165.0000 -162.77143 -159.32427 3.44715 1.82959 -159.52662 373.39344
7170.0000 -162.19120 -158.59668 3.59452 1.86133 -159.01879 390.68625
7175.0000 -161.74967 -158.50625 3.24342 1.88936 -158.57025 405.58827
7180.0000 -162.38343 -159.11708 3.26635 1.87398 -158.81635 390.71678
7185.0000 -163.11041 -159.73117 3.37925 1.83683 -159.41079 365.59986
7190.0000 -162.76885 -159.35538 3.41347 1.82132 -159.65893 358.20984
7195.0000 -161.90461 -158.74085 3.16376 1.89095 -158.54486 423.00160
7200.0000 -162.63685 -158.73624 3.90062 1.87273 -158.83632 411.33420
7205.0000 -161.86586 -159.04478 2.82109 1.85327 -159.14773 390.77996
7210.0000 -161.65453 -158.33398 3.32054 1.87380 -158.81917 411.28701
7215.0000 -162.26324 -159.11577 3.14747 1.89210 -158.52634 427.29945
7220.0000 -161.86882 -157.58833 4.28049 1.89687 -158.45001 414.93323
7225.0000 -161.98219 -158.91053 3.07166 1.91308 -158.19068 431.35909
7230.0000 -162.55120 -159.46456 3.08665 1.84452 -159.28770 377.33703
7235.0000 -162.40251 -159.41758 2.98492 1.82684 -159.57055 361.71221
7240.0000 -162.57839 -159.45260 3.12579 1.84841 -159.22549 372.00392
7245.0000 -162.22611 -159.31609 2.91002 1.82268 -159.63706 356.03565
7250.0000 -162.32725 -158.60165 3.72559 1.85485 -159.12237 386.37225
FREEZING PROCESS: loop number 30 T-loop= 368.00000000000000
main_MD> interactions number 30 at Temperature= 368.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.05915 -0.41135 -0.04142
force_rgl> df(natom) 1.11940 -1.09248 -3.70298
7255.0000 -162.32535 -159.44613 2.87923 1.86113 -159.02192 386.75276
7260.0000 -162.50522 -159.59886 2.90637 1.84247 -159.32047 377.68285
7265.0000 -162.48562 -159.35984 3.12579 1.83120 -159.50075 349.85879
7270.0000 -162.57602 -159.44360 3.13242 1.83368 -159.46119 350.59285
7275.0000 -162.34894 -159.71250 2.63643 1.81290 -159.79360 336.66993
7280.0000 -162.41857 -159.40601 3.01256 1.83972 -159.36444 365.63268
7285.0000 -162.00413 -158.74730 3.25683 1.84143 -159.33711 377.38431
7290.0000 -162.52509 -159.20211 3.32298 1.87067 -158.86929 405.33827
7295.0000 -162.98592 -159.26410 3.72183 1.82817 -159.54928 373.48531
7300.0000 -162.95498 -159.80215 3.15283 1.81985 -159.68234 364.82431
7305.0000 -162.77073 -159.54079 3.22994 1.82529 -159.59534 361.81183
7310.0000 -162.70222 -159.75096 2.95126 1.82989 -159.52173 369.45679
7315.0000 -163.18134 -160.20085 2.98049 1.79553 -160.07149 343.36182
7320.0000 -162.64275 -159.62250 3.02025 1.80723 -159.88426 350.01267
7325.0000 -162.37690 -159.37800 2.99890 1.82833 -159.54670 364.66516
7330.0000 -162.07505 -158.47472 3.60033 1.87137 -158.85815 400.83907
7335.0000 -162.09376 -158.72822 3.36555 1.88641 -158.61741 420.96175
7340.0000 -162.23612 -159.11182 3.12430 1.86226 -159.00391 407.77003
7345.0000 -162.18189 -159.37950 2.80240 1.83233 -159.48273 374.66391
7350.0000 -162.77106 -159.72019 3.05087 1.82469 -159.60495 371.01174
7355.0000 -162.23552 -158.79319 3.44233 1.84807 -159.23092 391.31857
7360.0000 -163.35870 -160.15949 3.19921 1.83406 -159.45500 382.36000
7365.0000 -162.73265 -159.17249 3.56017 1.81037 -159.83411 353.09164
7370.0000 -162.57190 -159.30462 3.26728 1.86027 -159.03563 392.80387
7375.0000 -162.74332 -159.71771 3.02561 1.84676 -159.25182 384.73435
7380.0000 -162.65280 -159.38953 3.26327 1.82759 -159.55862 375.69622
7385.0000 -162.62603 -159.49458 3.13146 1.84306 -159.31106 381.12983
7390.0000 -162.36713 -159.24315 3.12399 1.84072 -159.34847 368.60117
7395.0000 -162.66785 -159.66605 3.00180 1.81473 -159.76436 356.26641
7400.0000 -162.53489 -159.24288 3.29201 1.85462 -159.12613 395.78855
7405.0000 -162.97422 -160.15381 2.82041 1.82138 -159.65797 366.05543
7410.0000 -162.60154 -159.60678 2.99476 1.79435 -160.09040 345.31424
7415.0000 -162.74138 -160.31574 2.42564 1.79703 -160.04752 343.35231
7420.0000 -163.11562 -160.19705 2.91857 1.78665 -160.21361 337.79517
7425.0000 -161.71627 -158.62077 3.09550 1.84614 -159.26170 388.92111
7430.0000 -162.69901 -159.44705 3.25196 1.86815 -158.90966 405.50693
7435.0000 -162.71778 -159.28683 3.43094 1.84191 -159.32952 389.58298
7440.0000 -162.57167 -159.16104 3.41064 1.85806 -159.07108 396.47777
7445.0000 -162.17363 -159.35393 2.81970 1.85025 -159.19593 386.12430
7450.0000 -162.31223 -159.67462 2.63761 1.82782 -159.55495 355.58395
7455.0000 -162.98055 -159.76067 3.21988 1.81140 -159.81757 344.54168
7460.0000 -162.81598 -159.80368 3.01230 1.83462 -159.44611 369.81193
7465.0000 -161.75363 -158.72507 3.02856 1.83548 -159.43237 371.88568
7470.0000 -163.28811 -160.43615 2.85196 1.83571 -159.42864 377.32832
7475.0000 -162.73717 -159.96930 2.76787 1.79484 -160.08250 341.73437
7480.0000 -163.24012 -160.55953 2.68060 1.78631 -160.21908 333.96514
7485.0000 -162.80474 -159.89841 2.90633 1.77693 -160.36904 322.40180
7490.0000 -162.79694 -160.08037 2.71657 1.78456 -160.24705 329.88506
7495.0000 -163.17961 -160.53307 2.64654 1.77764 -160.35774 327.60566
7500.0000 -162.72439 -159.81558 2.90881 1.77767 -160.35721 327.55512
FREEZING PROCESS: loop number 31 T-loop= 343.00000000000000
main_MD> interactions number 31 at Temperature= 343.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.40611 -0.48018 -2.30057
force_rgl> df(natom) -1.27649 0.02466 -2.15604
7505.0000 -162.68446 -159.79529 2.88917 1.78657 -160.21494 334.40330
7510.0000 -162.94759 -159.99242 2.95517 1.78684 -160.21061 334.16788
7515.0000 -162.71957 -160.06160 2.65796 1.79376 -160.09985 344.68431
7520.0000 -162.96629 -160.30644 2.65985 1.78095 -160.30487 327.05510
7525.0000 -163.38264 -160.70303 2.67961 1.77395 -160.41677 326.27027
7530.0000 -162.88081 -159.98231 2.89850 1.77767 -160.35729 329.86489
7535.0000 -162.76042 -159.61315 3.14727 1.81543 -159.75311 359.87307
7540.0000 -162.73856 -160.14434 2.59423 1.79986 -160.00229 346.42931
7545.0000 -163.45034 -160.61693 2.83340 1.76250 -160.60006 314.19338
7550.0000 -162.92965 -160.25624 2.67340 1.77660 -160.37447 330.49595
7555.0000 -162.88832 -160.26135 2.62697 1.79264 -160.11783 344.24556
7560.0000 -162.74939 -159.65814 3.09125 1.81171 -159.81264 352.43225
7565.0000 -163.03927 -160.35563 2.68364 1.82085 -159.66640 362.79949
7570.0000 -162.85582 -160.30386 2.55196 1.76821 -160.50860 320.50358
7575.0000 -163.59852 -161.04628 2.55224 1.77254 -160.43928 326.62801
7580.0000 -162.81137 -160.04246 2.76890 1.76245 -160.60085 315.27711
7585.0000 -162.31602 -159.92545 2.39056 1.81320 -159.78876 359.88776
7590.0000 -162.52390 -159.61426 2.90964 1.80603 -159.90347 352.66537
7595.0000 -163.41440 -160.79852 2.61589 1.79583 -160.06678 345.67790
7600.0000 -163.25091 -160.07371 3.17720 1.76533 -160.55464 318.29948
7605.0000 -162.36761 -159.55276 2.81485 1.81246 -159.80069 361.72753
7610.0000 -162.91753 -160.15248 2.76506 1.79874 -160.02024 347.71551
7615.0000 -163.11127 -160.04981 3.06145 1.78705 -160.20721 333.65524
7620.0000 -163.05561 -160.27241 2.78320 1.78820 -160.18878 336.22259
7625.0000 -162.92942 -160.55469 2.37474 1.78649 -160.21624 332.03126
7630.0000 -162.32698 -159.38583 2.94114 1.81602 -159.74362 350.91664
7635.0000 -162.40185 -159.44563 2.95622 1.82892 -159.53734 360.78089
7640.0000 -163.09412 -159.89757 3.19655 1.81804 -159.71137 360.84965
7645.0000 -163.07304 -160.26777 2.80526 1.77097 -160.46452 320.66948
7650.0000 -163.01139 -160.27894 2.73245 1.78181 -160.29103 326.29432
7655.0000 -162.71038 -159.88557 2.82481 1.78086 -160.30618 331.42725
7660.0000 -162.88610 -160.35718 2.52892 1.79361 -160.10219 338.43644
7665.0000 -163.12796 -160.40937 2.71859 1.77961 -160.32623 318.23469
7670.0000 -162.88677 -160.24464 2.64213 1.79917 -160.01321 348.00443
7675.0000 -162.93747 -159.88469 3.05277 1.80478 -159.92351 352.63154
7680.0000 -162.59246 -160.21606 2.37640 1.78467 -160.24530 333.40077
7685.0000 -162.43045 -159.74436 2.68609 1.78993 -160.16114 338.82276
7690.0000 -162.78780 -160.28084 2.50696 1.81513 -159.75785 360.59365
7695.0000 -163.23800 -160.28585 2.95214 1.77707 -160.36696 327.87834
7700.0000 -162.66849 -159.80625 2.86224 1.77530 -160.39514 323.18667
7705.0000 -162.75494 -160.09566 2.65928 1.80837 -159.86614 346.51741
7710.0000 -162.55634 -159.78161 2.77473 1.79711 -160.04628 339.91389
7715.0000 -163.05357 -160.52982 2.52375 1.79343 -160.10504 341.85665
7720.0000 -162.95777 -160.27737 2.68040 1.76725 -160.52398 321.30980
7725.0000 -162.67604 -160.25994 2.41610 1.78950 -160.16798 336.87755
7730.0000 -162.35008 -158.90079 3.44930 1.83200 -159.48805 370.75634
7735.0000 -162.79749 -159.60018 3.19731 1.85630 -159.09912 393.08781
7740.0000 -162.86633 -159.97765 2.88868 1.81361 -159.78217 353.64609
7745.0000 -162.74293 -159.99566 2.74727 1.80854 -159.86339 349.48990
7750.0000 -162.50752 -159.84471 2.66281 1.82125 -159.65995 371.27659
FREEZING PROCESS: loop number 32 T-loop= 318.00000000000000
main_MD> interactions number 32 at Temperature= 318.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.31033 -1.11386 -1.98189
force_rgl> df(natom) -0.95122 -2.72241 3.16187
7755.0000 -162.78895 -160.08995 2.69899 1.79243 -160.12109 339.24670
7760.0000 -163.20635 -160.62349 2.58286 1.79538 -160.07393 345.92474
7765.0000 -162.82902 -160.44827 2.38075 1.77517 -160.39733 319.11434
7770.0000 -163.38471 -160.85511 2.52961 1.76490 -160.56155 313.81183
7775.0000 -163.30575 -160.87359 2.43216 1.75162 -160.77403 303.51142
7780.0000 -163.42448 -161.32206 2.10242 1.74170 -160.93276 295.22496
7785.0000 -163.33090 -160.92942 2.40147 1.74183 -160.93065 296.83294
7790.0000 -163.36959 -160.91806 2.45154 1.75342 -160.74528 305.26795
7795.0000 -163.19394 -160.83932 2.35462 1.76009 -160.63855 308.36263
7800.0000 -162.81159 -160.18186 2.62973 1.76850 -160.50402 310.44610
7805.0000 -163.40183 -161.00012 2.40170 1.75260 -160.75833 301.57236
7810.0000 -163.06029 -160.68306 2.37723 1.75295 -160.75280 301.17138
7815.0000 -162.96268 -160.47448 2.48820 1.76745 -160.52082 313.32425
7820.0000 -162.50411 -160.37465 2.12947 1.77176 -160.45185 310.17397
7825.0000 -162.53332 -160.32315 2.21017 1.76483 -160.56271 310.77839
7830.0000 -162.62184 -160.05484 2.56700 1.79358 -160.10278 336.90116
7835.0000 -163.50411 -160.47594 3.02817 1.77603 -160.38344 326.06557
7840.0000 -163.41463 -160.65052 2.76411 1.75696 -160.68863 304.47828
7845.0000 -162.93283 -160.29400 2.63883 1.77266 -160.43740 312.58896
7850.0000 -163.19694 -160.92347 2.27347 1.75157 -160.77482 306.61056
7855.0000 -163.02317 -160.50755 2.51562 1.75393 -160.73707 305.50393
7860.0000 -162.99118 -160.13486 2.85633 1.78380 -160.25924 330.07272
7865.0000 -162.83261 -159.73019 3.10242 1.80118 -159.98115 347.45987
7870.0000 -163.23541 -160.59172 2.64369 1.78968 -160.16508 338.42446
7875.0000 -163.53169 -160.94586 2.58584 1.76342 -160.58528 315.13685
7880.0000 -163.45211 -160.59085 2.86126 1.73791 -160.99337 292.43750
7885.0000 -162.77022 -160.34982 2.42039 1.79112 -160.14200 340.35844
7890.0000 -162.75261 -160.02872 2.72389 1.80366 -159.94149 350.71275
7895.0000 -163.64845 -160.95776 2.69068 1.76461 -160.56629 314.02219
7900.0000 -162.81023 -160.37845 2.43178 1.75537 -160.71408 306.77344
7905.0000 -163.11522 -160.43014 2.68508 1.77575 -160.38803 326.60610
7910.0000 -162.96325 -160.74203 2.22122 1.75591 -160.70544 308.91881
7915.0000 -163.49712 -160.66681 2.83031 1.75369 -160.74094 307.52663
7920.0000 -163.05021 -160.77948 2.27073 1.75891 -160.65752 306.20698
7925.0000 -163.16625 -160.57944 2.58682 1.74898 -160.81640 301.63424
7930.0000 -162.86156 -160.46056 2.40100 1.77485 -160.40234 320.68265
7935.0000 -163.62158 -160.87810 2.74348 1.76810 -160.51035 314.79971
7940.0000 -162.89083 -160.54894 2.34188 1.75702 -160.68767 305.87088
7945.0000 -163.05059 -160.30226 2.74834 1.76269 -160.59699 314.33518
7950.0000 -163.23716 -160.49762 2.73954 1.75619 -160.70097 308.57743
7955.0000 -163.68844 -161.28032 2.40812 1.72854 -161.14328 285.23653
7960.0000 -162.91664 -160.59640 2.32024 1.74260 -160.91837 296.60939
7965.0000 -163.17064 -160.07212 3.09852 1.77606 -160.38297 327.26555
7970.0000 -163.71656 -161.00192 2.71464 1.75526 -160.71591 309.61347
7975.0000 -163.11230 -160.43709 2.67521 1.77179 -160.45136 323.21217
7980.0000 -163.00396 -160.42293 2.58102 1.78100 -160.30392 333.91351
7985.0000 -162.33034 -159.17878 3.15156 1.81893 -159.69709 364.58770
7990.0000 -163.14304 -159.93204 3.21100 1.82293 -159.63317 361.15286
7995.0000 -162.47991 -159.90295 2.57696 1.80296 -159.95263 333.90495
8000.0000 -162.99055 -160.58016 2.41039 1.80023 -159.99627 323.08615
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 13 [min], 20.6079554 [s].
main_MD> Deallocating global variables
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