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nanoparticlesims/growth_Melting_Silver_ICO_2451/freezeSims/run_28/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_28.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 = 28 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: 28 2800
main_MD> Size of nv and nvoiz: 28 2800
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 = 28
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> -2.4264767390845470E-002 -0.16065799969060635 -0.11181623973981251 initial drift of cluster / NP1 for coalescence
init> 0.33755600760539550 0.39166061496196952 0.34886609355988402 scaling for velocity /for coalescence NP1
init.f90 > facguy = 3.5786534384281234E-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) 1.53803 -0.52349 -3.92270
force_rgl> df(natom) -0.19172 1.98392 -2.62185
preparo> THERMALIZATION PROCESS AT 1115.2659522732461
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -60.565585683065883 2.3893615502909618 -62.954947233356847 5.4157501762344055E-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= 1086.0000000000000
main_MD> interactions number 1 at Temperature= 1086.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.70224 3.70256 1.78176
force_rgl> df(natom) -3.24074 -4.25555 -0.58970
5.0000 -64.31510 -60.52357 3.79153 2.41840 -60.30026 972.10306
10.0000 -62.94500 -58.58488 4.36012 2.52324 -59.33352 1072.99371
15.0000 -64.11929 -60.57633 3.54296 2.48764 -59.66177 1104.06574
20.0000 -65.33287 -59.84000 5.49287 2.42350 -60.25326 1057.36378
25.0000 -64.91241 -60.14329 4.76912 2.32868 -61.12756 929.26783
30.0000 -63.56873 -60.12892 3.43980 2.47690 -59.76085 1060.25441
35.0000 -63.49246 -59.79907 3.69339 2.52720 -59.29700 1092.33455
40.0000 -63.70463 -59.99157 3.71307 2.41836 -60.30062 980.98332
45.0000 -63.19835 -60.16909 3.02926 2.48052 -59.72744 1053.40783
50.0000 -63.22612 -59.68123 3.54488 2.41756 -60.30800 1017.81655
55.0000 -63.74313 -59.48893 4.25421 2.53070 -59.26475 1095.21157
60.0000 -62.46999 -58.06133 4.40867 2.64046 -58.25267 1220.97575
65.0000 -63.81003 -59.93751 3.87252 2.51533 -59.40644 1111.10435
70.0000 -63.43586 -58.67718 4.75868 2.47776 -59.75291 1041.25139
75.0000 -63.73701 -59.71929 4.01773 2.53118 -59.26028 1063.25904
80.0000 -63.53924 -60.38917 3.15007 2.37943 -60.65957 993.06541
85.0000 -62.81857 -59.52926 3.28931 2.48794 -59.65904 1068.05916
90.0000 -63.45991 -60.09677 3.36314 2.50422 -59.50890 1092.56019
95.0000 -63.55789 -60.38594 3.17195 2.35890 -60.84888 918.31532
100.0000 -63.66190 -60.58985 3.07205 2.41573 -60.32484 1024.09626
105.0000 -63.21371 -59.32332 3.89040 2.43907 -60.10966 1023.07415
110.0000 -63.14598 -59.49675 3.64923 2.53813 -59.19627 1114.32116
115.0000 -64.67945 -61.22569 3.45377 2.43798 -60.11966 982.98883
120.0000 -63.31207 -59.78651 3.52556 2.38089 -60.64611 1002.66574
125.0000 -64.10360 -60.26103 3.84258 2.43220 -60.17302 1046.50213
130.0000 -63.21655 -59.34428 3.87227 2.39376 -60.52741 964.44745
135.0000 -62.05113 -58.93997 3.11116 2.54484 -59.13431 1133.42603
140.0000 -61.17916 -57.59391 3.58525 2.69454 -57.75400 1283.69068
145.0000 -63.35121 -59.24716 4.10406 2.59727 -58.65094 1092.93605
150.0000 -64.49048 -60.96702 3.52346 2.40380 -60.43482 1017.45536
155.0000 -64.93359 -61.43771 3.49589 2.30799 -61.31831 877.00118
160.0000 -64.98752 -61.92662 3.06090 2.31226 -61.27897 899.90679
165.0000 -65.35244 -62.11775 3.23469 2.21672 -62.15993 873.40526
170.0000 -64.73347 -61.88767 2.84580 2.29115 -61.47358 938.34066
175.0000 -64.61809 -59.88252 4.73557 2.38716 -60.58833 943.57302
180.0000 -63.82318 -59.47936 4.34382 2.51390 -59.41967 1094.17626
185.0000 -63.55940 -59.99386 3.56554 2.47847 -59.74635 1080.00090
190.0000 -62.68480 -58.53733 4.14747 2.52313 -59.33455 1086.57400
195.0000 -63.24187 -58.51116 4.73071 2.58893 -58.72781 1196.77912
200.0000 -64.06762 -59.98632 4.08129 2.57413 -58.86423 1178.34509
205.0000 -62.91809 -58.79575 4.12235 2.56039 -58.99099 1121.42590
210.0000 -63.86844 -59.90961 3.95883 2.49518 -59.59224 1059.47899
215.0000 -65.78557 -62.07832 3.70726 2.32590 -61.15321 944.18145
220.0000 -63.13198 -59.15769 3.97428 2.41103 -60.36821 1017.07061
225.0000 -64.15312 -59.86986 4.28326 2.41805 -60.30349 1048.70458
230.0000 -63.25920 -60.00595 3.25324 2.46490 -59.87146 1077.04747
235.0000 -64.26111 -59.51280 4.74831 2.49286 -59.61366 1018.58276
240.0000 -64.42515 -60.46693 3.95821 2.44309 -60.07253 1036.47887
245.0000 -63.47087 -59.47446 3.99640 2.43094 -60.18460 1031.95303
250.0000 -64.00619 -59.98441 4.02178 2.44983 -60.01047 997.60413
FREEZING PROCESS: loop number 2 T-loop= 1061.0000000000000
main_MD> interactions number 2 at Temperature= 1061.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.18350 0.57003 -1.26482
force_rgl> df(natom) -2.21563 0.38430 -0.99362
255.0000 -63.53273 -59.89002 3.64271 2.44842 -60.02339 1063.17271
260.0000 -64.08579 -60.36480 3.72099 2.44318 -60.07173 1012.33251
265.0000 -63.38896 -61.05306 2.33591 2.33513 -61.06803 951.05596
270.0000 -63.77524 -60.10172 3.67352 2.37611 -60.69022 926.64644
275.0000 -63.26547 -59.27462 3.99086 2.50931 -59.46196 1092.71509
280.0000 -63.94967 -59.82867 4.12100 2.57258 -58.87855 1169.20692
285.0000 -63.67615 -60.68999 2.98616 2.44136 -60.08857 966.61165
290.0000 -64.41500 -60.57750 3.83750 2.37717 -60.68039 972.35063
295.0000 -64.39769 -61.00503 3.39266 2.43276 -60.16783 1043.64309
300.0000 -63.00168 -59.12076 3.88092 2.46145 -59.90331 1024.85987
305.0000 -63.21667 -59.42844 3.78824 2.58221 -58.78977 1104.35160
310.0000 -62.01695 -58.14303 3.87391 2.46890 -59.83461 1075.25213
315.0000 -64.28445 -60.25453 4.02992 2.54306 -59.15075 1146.39670
320.0000 -64.11381 -59.42185 4.69196 2.52291 -59.33654 1165.83204
325.0000 -63.36331 -59.39448 3.96884 2.50927 -59.46235 1093.52604
330.0000 -62.96336 -59.18332 3.78003 2.59231 -58.69663 1219.03907
335.0000 -63.66857 -59.48566 4.18291 2.56324 -58.96468 1093.18326
340.0000 -62.12806 -57.91430 4.21376 2.54678 -59.11647 1071.16627
345.0000 -63.46607 -59.79157 3.67450 2.58071 -58.80364 1139.05315
350.0000 -63.56197 -59.98047 3.58150 2.48467 -59.68921 1071.67941
355.0000 -64.38751 -61.05149 3.33602 2.42113 -60.27509 984.44065
360.0000 -64.25038 -59.75597 4.49441 2.40766 -60.39923 1024.08202
365.0000 -63.26306 -59.64532 3.61774 2.50339 -59.51658 1094.18793
370.0000 -64.09271 -60.00282 4.08989 2.46564 -59.86466 1079.85484
375.0000 -62.40544 -58.41441 3.99103 2.60101 -58.61637 1146.48670
380.0000 -63.23900 -59.44668 3.79232 2.57172 -58.88648 1152.39291
385.0000 -63.59669 -60.04482 3.55187 2.50776 -59.47627 1126.00681
390.0000 -62.67952 -59.39142 3.28810 2.51530 -59.40675 1062.31577
395.0000 -63.16196 -59.02929 4.13267 2.44560 -60.04940 1020.27347
400.0000 -63.27330 -59.48143 3.79187 2.54413 -59.14091 1127.29920
405.0000 -63.61297 -59.48342 4.12955 2.50002 -59.54766 1071.74601
410.0000 -63.65456 -59.95082 3.70374 2.50351 -59.51544 1079.53096
415.0000 -63.04456 -58.50895 4.53561 2.54171 -59.16324 1130.91309
420.0000 -63.69082 -59.83245 3.85837 2.50799 -59.47411 1087.81712
425.0000 -63.29682 -60.90278 2.39404 2.41684 -60.31461 1014.39295
430.0000 -64.61053 -60.40211 4.20842 2.38666 -60.59287 971.41171
435.0000 -64.01945 -59.98207 4.03737 2.40191 -60.45227 1022.68351
440.0000 -65.44442 -61.88506 3.55936 2.40622 -60.41254 1032.50484
445.0000 -64.22982 -60.17539 4.05443 2.32759 -61.13755 885.90453
450.0000 -63.75210 -59.89018 3.86192 2.48986 -59.64135 1076.40924
455.0000 -63.48919 -59.77572 3.71347 2.45409 -59.97118 1095.60737
460.0000 -64.18763 -60.09909 4.08854 2.41775 -60.30626 1000.67599
465.0000 -64.20983 -59.80122 4.40862 2.44042 -60.09721 1059.39972
470.0000 -63.53704 -59.77369 3.76335 2.48420 -59.69354 1103.45121
475.0000 -62.48980 -57.47313 5.01667 2.51091 -59.44721 1142.62107
480.0000 -62.49696 -56.98015 5.51681 2.78547 -56.91553 1354.39694
485.0000 -62.69678 -59.48897 3.20781 2.62621 -58.38410 1152.54293
490.0000 -61.90287 -58.47033 3.43254 2.56138 -58.98184 1077.71674
495.0000 -63.25648 -60.64560 2.61089 2.54889 -59.09697 1077.96656
500.0000 -63.87467 -60.17105 3.70361 2.40369 -60.43589 1023.83549
FREEZING PROCESS: loop number 3 T-loop= 1036.0000000000000
main_MD> interactions number 3 at Temperature= 1036.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.40209 2.15340 0.82222
force_rgl> df(natom) 0.37952 -0.32587 1.01911
505.0000 -63.85627 -58.91958 4.93669 2.41175 -60.36159 978.52278
510.0000 -61.93796 -58.55723 3.38073 2.60810 -58.55105 1189.40339
515.0000 -63.33273 -58.85708 4.47565 2.56823 -58.91872 1103.11361
520.0000 -62.67140 -58.22541 4.44599 2.54999 -59.08689 1116.02537
525.0000 -64.37774 -60.29568 4.08207 2.50585 -59.49391 1092.44464
530.0000 -63.66552 -59.78806 3.87746 2.45580 -59.95542 1052.95192
535.0000 -65.08345 -59.81586 5.26759 2.43909 -60.10946 1086.03102
540.0000 -63.69565 -59.87161 3.82404 2.47681 -59.76162 1019.02621
545.0000 -63.75172 -61.62215 2.12957 2.37040 -60.74283 948.18606
550.0000 -64.25698 -60.24656 4.01042 2.27454 -61.62673 870.53448
555.0000 -63.92311 -60.76424 3.15887 2.36773 -60.76747 969.79409
560.0000 -62.60763 -59.23148 3.37614 2.51988 -59.36448 1102.86439
565.0000 -63.39086 -59.67525 3.71561 2.47621 -59.76722 1077.52387
570.0000 -62.84082 -59.15322 3.68760 2.47751 -59.75522 1083.38888
575.0000 -64.07735 -59.84189 4.23547 2.57294 -58.87524 1178.81578
580.0000 -64.12591 -59.25450 4.87141 2.54503 -59.13257 1176.56675
585.0000 -62.98319 -59.18223 3.80096 2.48956 -59.64408 1050.80786
590.0000 -63.77617 -59.54451 4.23166 2.51542 -59.40562 1097.17685
595.0000 -63.71472 -60.22786 3.48685 2.43150 -60.17943 1033.14778
600.0000 -63.04056 -59.65276 3.38780 2.45199 -59.99051 1011.47901
605.0000 -64.86620 -61.76729 3.09891 2.38429 -60.61476 1025.36883
610.0000 -64.17247 -60.80332 3.36915 2.31692 -61.23601 980.63727
615.0000 -62.90409 -59.30673 3.59736 2.45481 -59.96450 1053.92876
620.0000 -63.83441 -59.71126 4.12314 2.54413 -59.14087 1103.23901
625.0000 -64.01459 -59.80181 4.21279 2.43935 -60.10710 1081.09939
630.0000 -63.46997 -59.70201 3.76796 2.45551 -59.95805 1069.06008
635.0000 -62.68316 -58.48840 4.19476 2.49206 -59.62106 1070.79781
640.0000 -62.17982 -57.98801 4.19180 2.58768 -58.73934 1144.29153
645.0000 -63.92450 -59.71992 4.20459 2.60894 -58.54331 1187.36231
650.0000 -63.38016 -59.41092 3.96923 2.51003 -59.45534 1082.44954
655.0000 -63.53516 -58.52871 5.00645 2.47702 -59.75974 1063.63689
660.0000 -61.48496 -57.22776 4.25721 2.69288 -57.76926 1252.42819
665.0000 -64.67513 -60.29497 4.38015 2.54576 -59.12586 1089.05933
670.0000 -64.04429 -60.21771 3.82657 2.37331 -60.71604 960.48043
675.0000 -62.42371 -59.60893 2.81477 2.44649 -60.04122 1016.52705
680.0000 -63.79669 -60.52913 3.26756 2.43533 -60.14413 996.35187
685.0000 -64.17911 -61.16049 3.01862 2.40030 -60.46709 995.90175
690.0000 -64.33376 -60.41859 3.91517 2.34855 -60.94430 1003.32359
695.0000 -63.22602 -59.90410 3.32192 2.45404 -59.97162 1086.12252
700.0000 -63.62530 -60.20472 3.42058 2.51445 -59.41459 1122.25440
705.0000 -63.54003 -60.54995 2.99008 2.48785 -59.65986 1077.94229
710.0000 -63.26872 -59.58558 3.68314 2.46903 -59.83334 1007.54751
715.0000 -64.24460 -59.62168 4.62292 2.41223 -60.35709 1012.65050
720.0000 -63.55511 -59.68994 3.86517 2.50246 -59.52510 1103.57845
725.0000 -63.32000 -59.85969 3.46030 2.50320 -59.51831 1119.38672
730.0000 -64.69934 -60.26703 4.43231 2.46249 -59.89370 1047.51313
735.0000 -63.66748 -59.93709 3.73039 2.47982 -59.73389 1060.06554
740.0000 -64.04228 -60.14878 3.89350 2.39749 -60.49306 952.48007
745.0000 -64.55886 -60.82854 3.73032 2.36342 -60.80723 958.67128
750.0000 -64.41281 -60.17557 4.23725 2.37358 -60.71356 1043.43061
FREEZING PROCESS: loop number 4 T-loop= 1011.0000000000000
main_MD> interactions number 4 at Temperature= 1011.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.96821 2.30005 -5.93351
force_rgl> df(natom) 0.41781 -2.43211 1.09014
755.0000 -63.58510 -60.24088 3.34422 2.47461 -59.78193 1125.07439
760.0000 -63.27213 -59.53601 3.73611 2.48705 -59.66722 1050.67507
765.0000 -65.00955 -61.53210 3.47745 2.36360 -60.80551 1010.88351
770.0000 -64.03141 -59.78151 4.24990 2.34761 -60.95303 947.96934
775.0000 -62.47002 -59.15653 3.31349 2.52616 -59.30657 1095.21409
780.0000 -63.85359 -59.94882 3.90477 2.46058 -59.91126 1028.07387
785.0000 -64.45478 -60.97563 3.47915 2.48385 -59.69671 1095.18347
790.0000 -64.28869 -60.66474 3.62394 2.36055 -60.83371 1032.06721
795.0000 -64.04189 -60.79953 3.24236 2.41414 -60.33955 1026.33015
800.0000 -64.86047 -62.27391 2.58655 2.34467 -60.98008 936.18184
805.0000 -63.59738 -59.54775 4.04963 2.38668 -60.59270 984.05552
810.0000 -62.60786 -58.57534 4.03252 2.48359 -59.69916 1091.14418
815.0000 -63.94797 -59.92368 4.02428 2.52061 -59.35779 1093.20237
820.0000 -62.64854 -59.47327 3.17527 2.53454 -59.22937 1085.66250
825.0000 -63.29914 -59.45204 3.84710 2.46518 -59.86890 1048.79569
830.0000 -62.73070 -58.75157 3.97913 2.57005 -58.90188 1175.67711
835.0000 -62.79022 -58.47467 4.31555 2.61390 -58.49759 1163.88983
840.0000 -62.58758 -58.84580 3.74178 2.65336 -58.13369 1164.94725
845.0000 -62.58896 -58.62772 3.96125 2.58664 -58.74895 1149.74558
850.0000 -63.14892 -58.61841 4.53052 2.66089 -58.06427 1255.43931
855.0000 -64.00877 -60.48689 3.52188 2.49316 -59.61091 1088.46653
860.0000 -63.86911 -60.85635 3.01276 2.41698 -60.31337 1036.95498
865.0000 -63.10740 -58.85689 4.25050 2.52045 -59.35927 1136.66366
870.0000 -64.54396 -60.65259 3.89137 2.49891 -59.55790 1078.41642
875.0000 -63.59750 -59.17165 4.42585 2.41488 -60.33267 1003.86962
880.0000 -64.12660 -59.87570 4.25090 2.50834 -59.47094 1114.83052
885.0000 -63.18462 -59.47112 3.71350 2.41712 -60.31201 979.38857
890.0000 -64.68905 -60.70735 3.98170 2.50763 -59.47747 1063.02555
895.0000 -63.50137 -60.02768 3.47369 2.37991 -60.65517 1002.86456
900.0000 -64.96716 -60.87417 4.09299 2.39472 -60.51856 981.55095
905.0000 -63.70736 -60.21812 3.48924 2.45956 -59.92073 1072.98242
910.0000 -62.95403 -59.05418 3.89985 2.50940 -59.46114 1076.32185
915.0000 -62.94540 -58.68696 4.25844 2.51465 -59.41277 1070.17945
920.0000 -63.62065 -58.70157 4.91907 2.61354 -58.50092 1177.94998
925.0000 -63.07810 -58.84743 4.23067 2.61471 -58.49009 1177.15132
930.0000 -63.96151 -60.73683 3.22468 2.54282 -59.15295 1109.88247
935.0000 -65.03591 -60.71056 4.32536 2.27996 -61.57675 905.58916
940.0000 -64.84481 -61.17333 3.67147 2.34305 -60.99499 964.39637
945.0000 -65.21387 -61.60522 3.60865 2.31629 -61.24182 978.14655
950.0000 -63.88395 -60.15155 3.73240 2.33192 -61.09768 966.86252
955.0000 -63.38591 -59.49825 3.88766 2.50034 -59.54465 1090.45632
960.0000 -63.65216 -59.01134 4.64082 2.57020 -58.90053 1191.33992
965.0000 -63.42274 -60.18322 3.23952 2.45916 -59.92441 982.31129
970.0000 -63.66794 -59.49901 4.16894 2.46438 -59.87630 993.46184
975.0000 -64.43127 -60.57429 3.85698 2.41652 -60.31758 990.81210
980.0000 -62.57643 -59.05429 3.52213 2.45241 -59.98668 1008.12336
985.0000 -63.93653 -59.98551 3.95102 2.54811 -59.10420 1089.54174
990.0000 -64.12933 -59.74249 4.38684 2.40007 -60.46927 996.51160
995.0000 -64.08072 -60.73205 3.34867 2.41233 -60.35622 1030.44631
1000.0000 -62.30227 -59.06531 3.23697 2.51718 -59.38941 1132.77304
FREEZING PROCESS: loop number 5 T-loop= 986.00000000000000
main_MD> interactions number 5 at Temperature= 986.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -6.53970 -5.31726 -5.29064
force_rgl> df(natom) 6.65273 5.18435 6.68110
1005.0000 -62.40302 -59.53221 2.87082 2.58839 -58.73282 1163.95125
1010.0000 -63.89374 -60.01138 3.88236 2.45616 -59.95210 1037.84236
1015.0000 -63.00688 -59.25135 3.75554 2.43370 -60.15913 1021.33617
1020.0000 -64.52642 -61.04227 3.48416 2.39684 -60.49909 1034.40232
1025.0000 -64.22899 -60.79847 3.43052 2.36455 -60.79676 957.77750
1030.0000 -63.93312 -60.37924 3.55388 2.39165 -60.54686 985.01335
1035.0000 -64.60732 -61.27413 3.33319 2.41053 -60.37279 1038.36747
1040.0000 -64.15349 -60.81759 3.33590 2.31213 -61.28015 920.87579
1045.0000 -64.04172 -59.88161 4.16011 2.39021 -60.56014 998.50597
1050.0000 -63.49400 -60.37108 3.12293 2.41823 -60.30177 1042.82176
1055.0000 -62.80370 -58.81462 3.98908 2.43677 -60.13082 994.22437
1060.0000 -63.60623 -60.97960 2.62663 2.39814 -60.48709 991.81985
1065.0000 -63.42747 -60.64732 2.78015 2.32409 -61.16988 895.10226
1070.0000 -63.74502 -60.57142 3.17360 2.36668 -60.77717 972.54478
1075.0000 -64.06199 -60.64314 3.41886 2.39574 -60.50919 981.55076
1080.0000 -64.29729 -59.96497 4.33232 2.43786 -60.12081 1049.13882
1085.0000 -64.33823 -59.91549 4.42274 2.46746 -59.84786 993.17446
1090.0000 -64.56559 -60.92280 3.64279 2.45570 -59.95630 1064.66739
1095.0000 -64.24553 -60.94713 3.29840 2.33802 -61.04142 906.74066
1100.0000 -64.44215 -60.51112 3.93103 2.38848 -60.57609 969.80691
1105.0000 -64.58673 -60.60593 3.98081 2.40216 -60.44995 1032.78840
1110.0000 -64.11465 -60.59064 3.52401 2.43187 -60.17600 1075.15005
1115.0000 -65.02057 -60.95081 4.06977 2.37750 -60.67736 970.06464
1120.0000 -65.21759 -61.30882 3.90877 2.34356 -60.99037 978.58160
1125.0000 -64.43426 -61.38681 3.04745 2.35743 -60.86246 1039.98745
1130.0000 -63.76932 -60.13323 3.63609 2.31002 -61.29960 965.38338
1135.0000 -63.44572 -60.31798 3.12775 2.52578 -59.31008 1102.02878
1140.0000 -63.32123 -59.75565 3.56558 2.46105 -59.90696 1017.11707
1145.0000 -64.64425 -61.38962 3.25463 2.37133 -60.73426 991.97249
1150.0000 -64.63495 -61.90520 2.72975 2.29830 -61.40767 936.55295
1155.0000 -63.96233 -60.63966 3.32266 2.33176 -61.09916 904.44692
1160.0000 -63.89572 -61.32012 2.57560 2.39060 -60.55657 974.30296
1165.0000 -64.50884 -60.75057 3.75828 2.34337 -60.99205 889.50514
1170.0000 -64.40366 -60.37419 4.02948 2.37435 -60.70639 975.77854
1175.0000 -63.45739 -58.95835 4.49904 2.42384 -60.25010 1019.78447
1180.0000 -63.11557 -58.53031 4.58525 2.60414 -58.58759 1213.19907
1185.0000 -63.61992 -60.55695 3.06297 2.52756 -59.29366 1072.85504
1190.0000 -63.19741 -60.12635 3.07106 2.45996 -59.91704 1041.98321
1195.0000 -64.98403 -60.83330 4.15073 2.33491 -61.07008 885.15298
1200.0000 -63.00817 -60.16048 2.84769 2.42071 -60.27895 980.94061
1205.0000 -63.38619 -59.56289 3.82330 2.49736 -59.57219 1101.15287
1210.0000 -63.70125 -60.16449 3.53676 2.40084 -60.46215 984.81831
1215.0000 -63.72434 -60.95862 2.76572 2.30667 -61.33045 953.76932
1220.0000 -63.23224 -59.32389 3.90835 2.42934 -60.19935 1041.64718
1225.0000 -64.91330 -60.92223 3.99107 2.35747 -60.86211 931.24291
1230.0000 -65.67961 -61.60339 4.07622 2.33426 -61.07608 959.54963
1235.0000 -64.03377 -60.15138 3.88239 2.33499 -61.06937 947.36097
1240.0000 -64.35504 -61.10315 3.25189 2.39942 -60.47525 1024.31144
1245.0000 -63.90669 -59.92042 3.98626 2.43721 -60.12683 1069.45312
1250.0000 -63.89432 -59.45426 4.44005 2.48700 -59.66768 1103.41784
FREEZING PROCESS: loop number 6 T-loop= 961.00000000000000
main_MD> interactions number 6 at Temperature= 961.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.19055 0.92844 0.81951
force_rgl> df(natom) -1.34415 2.55658 1.06703
1255.0000 -63.72432 -60.02116 3.70315 2.52532 -59.31437 1094.54324
1260.0000 -64.69819 -60.84289 3.85530 2.50337 -59.51676 1138.36437
1265.0000 -65.25278 -61.39490 3.85788 2.33821 -61.03962 1019.38070
1270.0000 -65.19438 -62.33334 2.86104 2.27430 -61.62901 846.26168
1275.0000 -66.26209 -62.15184 4.11025 2.23575 -61.98448 855.94064
1280.0000 -64.89918 -61.16181 3.73737 2.26945 -61.67374 883.51590
1285.0000 -63.18763 -60.46565 2.72197 2.35502 -60.88463 953.67299
1290.0000 -64.94131 -60.36505 4.57626 2.38737 -60.58635 959.26970
1295.0000 -63.56031 -58.79584 4.76447 2.55785 -59.01436 1119.85911
1300.0000 -63.95638 -59.73558 4.22080 2.54777 -59.10736 1147.93347
1305.0000 -64.39740 -60.39757 3.99982 2.44191 -60.08342 1077.19617
1310.0000 -63.35836 -58.87192 4.48644 2.50179 -59.53130 1106.67502
1315.0000 -62.94703 -59.17945 3.76759 2.51154 -59.44142 1089.03781
1320.0000 -64.05837 -60.15415 3.90422 2.42510 -60.23843 950.51997
1325.0000 -65.03595 -61.21956 3.81638 2.37215 -60.72671 941.64624
1330.0000 -63.55956 -60.56024 2.99933 2.36879 -60.75769 965.11249
1335.0000 -65.17297 -61.46042 3.71254 2.23153 -62.02339 809.00354
1340.0000 -63.79029 -61.53333 2.25696 2.36594 -60.78395 929.90876
1345.0000 -63.92223 -60.45354 3.46868 2.40813 -60.39497 1002.61266
1350.0000 -64.54955 -61.38585 3.16370 2.34333 -60.99249 968.45586
1355.0000 -64.90010 -60.74325 4.15685 2.34818 -60.94772 922.02681
1360.0000 -65.40233 -62.64230 2.76003 2.30318 -61.36267 942.62541
1365.0000 -65.01767 -60.88255 4.13512 2.28705 -61.51141 878.10350
1370.0000 -64.07315 -60.33568 3.73747 2.37250 -60.72353 946.52058
1375.0000 -64.42413 -60.47165 3.95249 2.35837 -60.85373 999.56174
1380.0000 -64.56316 -59.66400 4.89916 2.51113 -59.44520 1117.27743
1385.0000 -63.08630 -58.49065 4.59565 2.53327 -59.24103 1122.96351
1390.0000 -63.98434 -60.80236 3.18199 2.48802 -59.65826 1094.42346
1395.0000 -64.98980 -62.40987 2.57993 2.22728 -62.06255 836.71881
1400.0000 -64.76380 -61.69375 3.07005 2.22147 -62.11612 862.35005
1405.0000 -63.90253 -61.11980 2.78273 2.34929 -60.93752 929.54053
1410.0000 -64.78241 -61.46897 3.31344 2.36818 -60.76328 936.19117
1415.0000 -65.77747 -62.98078 2.79669 2.25246 -61.83031 867.38356
1420.0000 -65.75920 -62.58162 3.17758 2.12603 -62.99619 758.91245
1425.0000 -65.09402 -61.97212 3.12190 2.17598 -62.53560 802.19611
1430.0000 -64.69423 -62.14020 2.55403 2.19345 -62.37447 825.38665
1435.0000 -64.69793 -61.00619 3.69174 2.30132 -61.37981 936.51472
1440.0000 -64.17428 -60.61405 3.56023 2.40920 -60.38509 1004.98105
1445.0000 -65.24559 -60.15698 5.08861 2.35539 -60.88125 899.73663
1450.0000 -63.72591 -60.27291 3.45300 2.34277 -60.99759 942.47606
1455.0000 -64.45794 -60.34526 4.11267 2.34650 -60.96324 981.40574
1460.0000 -64.44028 -61.14453 3.29576 2.34716 -60.95711 965.11724
1465.0000 -64.30370 -61.06752 3.23618 2.29930 -61.39844 927.68251
1470.0000 -63.32769 -60.05486 3.27284 2.40888 -60.38801 951.22464
1475.0000 -65.03595 -60.90698 4.12898 2.38856 -60.57538 949.81527
1480.0000 -64.94006 -61.76080 3.17927 2.35533 -60.88178 969.60731
1485.0000 -64.65101 -61.85292 2.79809 2.25491 -61.80776 835.37406
1490.0000 -64.09326 -60.25428 3.83898 2.36305 -60.81065 939.81005
1495.0000 -64.87469 -60.88931 3.98538 2.42134 -60.27313 1009.78144
1500.0000 -64.92408 -62.06193 2.86215 2.32923 -61.12251 936.65752
FREEZING PROCESS: loop number 7 T-loop= 936.00000000000000
main_MD> interactions number 7 at Temperature= 936.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -7.88524 3.26140 1.55515
force_rgl> df(natom) 0.25125 -2.24002 -1.29359
1505.0000 -64.93020 -61.81835 3.11185 2.16961 -62.59430 792.50321
1510.0000 -64.86059 -61.33715 3.52344 2.26880 -61.67966 877.40822
1515.0000 -63.81583 -60.45903 3.35679 2.37973 -60.65681 998.14909
1520.0000 -64.41832 -62.37593 2.04240 2.35249 -60.90798 992.59935
1525.0000 -64.41825 -61.08952 3.32873 2.22780 -62.05774 855.33948
1530.0000 -64.27603 -62.18758 2.08845 2.29905 -61.40078 908.53836
1535.0000 -64.26380 -61.74404 2.51976 2.23651 -61.97742 797.56368
1540.0000 -64.26486 -61.21804 3.04681 2.29876 -61.40346 885.41843
1545.0000 -64.63453 -61.00643 3.62811 2.33277 -61.08986 898.17621
1550.0000 -64.68849 -61.82111 2.86738 2.32347 -61.17554 895.17727
1555.0000 -64.11274 -59.93571 4.17703 2.37811 -60.67171 982.49631
1560.0000 -65.03635 -61.29638 3.73996 2.36307 -60.81045 933.31304
1565.0000 -63.89643 -60.25583 3.64059 2.38059 -60.64888 951.31401
1570.0000 -64.22496 -60.54168 3.68328 2.42973 -60.19574 1039.82394
1575.0000 -63.14791 -59.54266 3.60525 2.47544 -59.77427 1066.10715
1580.0000 -64.07049 -61.00015 3.07034 2.43203 -60.17456 1003.98847
1585.0000 -65.57271 -62.16832 3.40440 2.25717 -61.78690 840.16226
1590.0000 -64.14601 -61.33900 2.80701 2.26956 -61.67266 866.97755
1595.0000 -63.90519 -60.51565 3.38954 2.35979 -60.84071 939.04268
1600.0000 -64.73443 -60.32133 4.41310 2.39007 -60.56147 1010.22854
1605.0000 -64.63590 -61.02377 3.61214 2.33367 -61.08155 945.24538
1610.0000 -64.62896 -61.10471 3.52425 2.35944 -60.84392 972.19759
1615.0000 -63.71567 -60.44230 3.27337 2.43144 -60.18002 1010.01082
1620.0000 -64.88890 -60.53192 4.35698 2.38183 -60.63749 1010.87829
1625.0000 -65.30881 -62.61993 2.68888 2.23948 -61.95001 856.36004
1630.0000 -65.00392 -60.66540 4.33852 2.27663 -61.60751 876.16539
1635.0000 -63.98864 -60.71038 3.27827 2.37222 -60.72606 987.12625
1640.0000 -64.23046 -61.06757 3.16289 2.31687 -61.23646 912.33736
1645.0000 -64.85696 -60.87401 3.98296 2.36925 -60.75343 972.79049
1650.0000 -64.82840 -60.97070 3.85770 2.31377 -61.26505 913.61002
1655.0000 -64.46466 -61.27602 3.18864 2.35550 -60.88026 970.63303
1660.0000 -65.19271 -61.81242 3.38029 2.25685 -61.78987 882.88245
1665.0000 -64.52232 -59.69618 4.82614 2.34239 -61.00116 908.83377
1670.0000 -64.29347 -61.30525 2.98821 2.32889 -61.12565 972.11573
1675.0000 -64.76928 -62.19399 2.57529 2.33244 -61.09285 937.91864
1680.0000 -65.14051 -62.15007 2.99044 2.20439 -62.27360 818.92717
1685.0000 -64.79043 -61.49889 3.29154 2.29666 -61.42282 878.10557
1690.0000 -64.56266 -60.55325 4.00941 2.33729 -61.04814 935.31210
1695.0000 -63.38486 -59.78916 3.59569 2.48576 -59.67912 1077.83721
1700.0000 -65.49775 -62.01117 3.48658 2.32073 -61.20084 942.71114
1705.0000 -63.50093 -60.43532 3.06561 2.35882 -60.84962 953.66827
1710.0000 -64.10698 -61.06174 3.04524 2.42560 -60.23388 1010.12272
1715.0000 -64.89794 -61.78863 3.10931 2.34235 -61.00148 937.09288
1720.0000 -63.85997 -60.56431 3.29566 2.28093 -61.56781 885.31201
1725.0000 -63.98314 -60.94687 3.03627 2.35370 -60.89682 947.09849
1730.0000 -66.18451 -62.30888 3.87563 2.28816 -61.50118 899.11856
1735.0000 -65.37229 -62.60245 2.76985 2.15777 -62.70350 756.33548
1740.0000 -65.15986 -62.69328 2.46657 2.14608 -62.81129 785.02973
1745.0000 -63.89415 -61.17921 2.71495 2.26441 -61.72018 866.37823
1750.0000 -62.66607 -59.02747 3.63860 2.44529 -60.05231 1032.98988
FREEZING PROCESS: loop number 8 T-loop= 911.00000000000000
main_MD> interactions number 8 at Temperature= 911.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.39715 -1.00131 -3.05547
force_rgl> df(natom) 3.32927 -0.53220 -8.21475
1755.0000 -63.67732 -59.68827 3.98905 2.53009 -59.27038 1084.55331
1760.0000 -64.25574 -61.43986 2.81588 2.41640 -60.31871 990.08299
1765.0000 -64.48786 -61.26147 3.22639 2.30192 -61.37430 885.67031
1770.0000 -65.06326 -61.95881 3.10445 2.29727 -61.41718 868.64982
1775.0000 -65.13139 -62.13522 2.99617 2.18236 -62.47675 802.63150
1780.0000 -64.46004 -60.92542 3.53462 2.28371 -61.54219 883.78825
1785.0000 -64.39294 -61.29583 3.09710 2.27904 -61.58528 842.92234
1790.0000 -64.69951 -61.72366 2.97585 2.31077 -61.29268 916.22020
1795.0000 -64.86484 -61.72525 3.13960 2.23061 -62.03179 817.30305
1800.0000 -64.96062 -62.45709 2.50353 2.21821 -62.14621 827.51388
1805.0000 -65.29250 -62.65284 2.63966 2.17197 -62.57256 783.65264
1810.0000 -65.09015 -62.12782 2.96233 2.18334 -62.46770 793.82649
1815.0000 -64.37567 -60.64159 3.73408 2.33133 -61.10312 921.28018
1820.0000 -66.22563 -62.37330 3.85232 2.30227 -61.37109 863.84154
1825.0000 -65.20868 -61.60575 3.60293 2.21513 -62.17456 873.12814
1830.0000 -64.20392 -60.53355 3.67037 2.33432 -61.07552 937.00875
1835.0000 -64.39024 -61.38200 3.00824 2.30425 -61.35277 847.28958
1840.0000 -64.95430 -61.13124 3.82306 2.30148 -61.37832 868.11991
1845.0000 -64.80660 -62.15801 2.64860 2.28814 -61.50133 857.53359
1850.0000 -65.27425 -61.49027 3.78397 2.30103 -61.38247 896.09354
1855.0000 -64.56773 -61.75111 2.81662 2.31707 -61.23460 894.03688
1860.0000 -65.07342 -61.34003 3.73339 2.30997 -61.30008 918.87306
1865.0000 -64.17647 -61.51028 2.66619 2.29959 -61.39576 873.90626
1870.0000 -64.86540 -61.31427 3.55113 2.30856 -61.31306 883.21778
1875.0000 -65.04237 -61.95382 3.08855 2.27704 -61.60371 907.65585
1880.0000 -63.06585 -59.56139 3.50446 2.36070 -60.83229 980.26730
1885.0000 -63.88458 -59.06551 4.81907 2.53918 -59.18653 1044.70139
1890.0000 -64.58208 -60.57340 4.00867 2.48082 -59.72468 1026.69033
1895.0000 -63.67399 -60.40753 3.26646 2.41360 -60.34449 1028.03254
1900.0000 -63.40934 -60.50951 2.89984 2.37264 -60.72223 902.77102
1905.0000 -63.47623 -59.80549 3.67073 2.43739 -60.12518 956.25368
1910.0000 -64.03566 -61.39721 2.63846 2.37420 -60.70780 949.31510
1915.0000 -64.20391 -61.10172 3.10219 2.34799 -60.94944 903.41411
1920.0000 -64.66773 -61.06628 3.60145 2.34625 -60.96556 945.56408
1925.0000 -64.05102 -60.71216 3.33886 2.33121 -61.10422 956.94027
1930.0000 -63.93342 -61.10571 2.82770 2.32855 -61.12878 933.59860
1935.0000 -64.72019 -60.87109 3.84909 2.35220 -60.91071 906.77097
1940.0000 -64.06296 -61.45057 2.61239 2.31648 -61.24007 899.87918
1945.0000 -63.21787 -61.05187 2.16601 2.29480 -61.43993 884.43721
1950.0000 -64.31158 -61.76678 2.54480 2.24006 -61.94471 825.20319
1955.0000 -64.12086 -60.91385 3.20701 2.24745 -61.87651 844.55945
1960.0000 -64.52476 -61.44340 3.08137 2.25800 -61.77931 863.70484
1965.0000 -65.05316 -61.75109 3.30207 2.23545 -61.98720 844.96211
1970.0000 -64.73889 -60.60842 4.13047 2.28152 -61.56235 871.70151
1975.0000 -63.69170 -60.59280 3.09891 2.42432 -60.24564 1003.86331
1980.0000 -64.54213 -60.55252 3.98962 2.40202 -60.45130 1019.40327
1985.0000 -64.69141 -61.77149 2.91991 2.34588 -60.96895 897.84679
1990.0000 -64.93614 -61.72794 3.20820 2.25446 -61.81193 861.54340
1995.0000 -65.34887 -61.54428 3.80459 2.27764 -61.59817 926.86426
2000.0000 -63.59755 -60.95099 2.64656 2.32169 -61.19203 906.13235
FREEZING PROCESS: loop number 9 T-loop= 886.00000000000000
main_MD> interactions number 9 at Temperature= 886.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.58705 0.50838 0.96493
force_rgl> df(natom) -0.15219 -1.78152 -3.83063
2005.0000 -64.77696 -61.10683 3.67013 2.34953 -60.93524 958.63509
2010.0000 -64.51565 -61.92857 2.58708 2.31000 -61.29979 919.92211
2015.0000 -64.34399 -61.18806 3.15593 2.28789 -61.50361 857.43871
2020.0000 -64.45746 -61.53009 2.92737 2.32424 -61.16852 926.80805
2025.0000 -64.85756 -61.95975 2.89781 2.27205 -61.64969 848.03251
2030.0000 -64.90933 -61.82756 3.08177 2.28419 -61.53775 946.08365
2035.0000 -65.08739 -61.72159 3.36581 2.25927 -61.76756 811.96274
2040.0000 -65.12043 -61.76816 3.35227 2.26254 -61.73739 876.22304
2045.0000 -63.88119 -59.43807 4.44312 2.40531 -60.42093 934.93761
2050.0000 -64.09258 -60.84986 3.24272 2.47785 -59.75210 1067.29013
2055.0000 -64.43398 -61.37151 3.06246 2.31281 -61.27387 916.43654
2060.0000 -65.71170 -62.30588 3.40582 2.32632 -61.14933 911.62907
2065.0000 -64.85472 -61.05700 3.79772 2.30383 -61.35665 915.40919
2070.0000 -65.31902 -62.76519 2.55383 2.27959 -61.58020 917.49882
2075.0000 -64.65396 -61.62893 3.02504 2.17033 -62.58764 775.21125
2080.0000 -64.88510 -62.03647 2.84863 2.22138 -62.11691 840.45711
2085.0000 -64.47454 -61.63730 2.83724 2.28259 -61.55254 908.42455
2090.0000 -65.59469 -62.63735 2.95734 2.27676 -61.60633 854.59241
2095.0000 -65.35559 -62.51606 2.83953 2.23072 -62.03077 809.15302
2100.0000 -65.22156 -61.97563 3.24593 2.22833 -62.05282 847.01736
2105.0000 -64.34937 -61.69769 2.65169 2.27833 -61.59184 865.96857
2110.0000 -64.59025 -61.06873 3.52152 2.31008 -61.29906 912.89727
2115.0000 -63.45391 -60.79239 2.66152 2.32365 -61.17389 893.51162
2120.0000 -64.16367 -60.66190 3.50177 2.41275 -60.35231 1029.58334
2125.0000 -65.58514 -61.19763 4.38752 2.31897 -61.21709 930.15033
2130.0000 -65.57967 -62.43434 3.14532 2.23090 -62.02915 870.68281
2135.0000 -65.23259 -62.18563 3.04696 2.14822 -62.79153 781.79635
2140.0000 -65.35193 -62.52473 2.82720 2.20794 -62.24082 837.08851
2145.0000 -65.53487 -61.50798 4.02689 2.20019 -62.31229 834.38335
2150.0000 -63.91363 -60.48490 3.42874 2.42853 -60.20681 1021.94389
2155.0000 -64.30095 -61.77317 2.52778 2.33798 -61.04181 946.17843
2160.0000 -65.48118 -62.05640 3.42478 2.24696 -61.88106 846.72959
2165.0000 -64.48861 -61.48904 2.99957 2.22536 -62.08023 826.17699
2170.0000 -64.88175 -61.65818 3.22358 2.25799 -61.77936 872.17276
2175.0000 -64.39907 -61.43742 2.96165 2.26250 -61.73777 909.56189
2180.0000 -65.26557 -62.34782 2.91775 2.26985 -61.66999 905.79995
2185.0000 -65.43881 -62.31443 3.12438 2.17620 -62.53354 795.32576
2190.0000 -65.52710 -62.70693 2.82016 2.18923 -62.41335 801.92959
2195.0000 -64.63480 -61.32169 3.31312 2.21686 -62.15860 820.12281
2200.0000 -64.78197 -61.27755 3.50443 2.28357 -61.54346 911.44038
2205.0000 -64.41932 -60.68267 3.73664 2.33987 -61.02435 933.94063
2210.0000 -64.58819 -61.37813 3.21006 2.30858 -61.31291 958.59211
2215.0000 -65.23592 -61.42972 3.80620 2.32234 -61.18599 939.40774
2220.0000 -64.59260 -62.11532 2.47728 2.25126 -61.84143 898.37491
2225.0000 -65.00014 -60.69192 4.30822 2.28459 -61.53410 912.33451
2230.0000 -64.46495 -60.15722 4.30773 2.35141 -60.91791 896.84375
2235.0000 -63.32594 -60.34465 2.98129 2.42701 -60.22085 1002.55611
2240.0000 -64.90328 -61.99130 2.91199 2.28562 -61.52459 831.83702
2245.0000 -64.24656 -60.56597 3.68060 2.34968 -60.93390 950.24954
2250.0000 -64.79325 -61.02308 3.77016 2.34339 -60.99194 929.51466
FREEZING PROCESS: loop number 10 T-loop= 861.00000000000000
main_MD> interactions number 10 at Temperature= 861.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.34338 -0.72511 1.21251
force_rgl> df(natom) 0.09242 2.74439 1.11658
2255.0000 -64.54140 -61.14027 3.40113 2.32887 -61.12576 940.49941
2260.0000 -64.71818 -60.00333 4.71485 2.40646 -60.41037 993.29790
2265.0000 -64.84438 -61.98226 2.86213 2.35482 -60.88646 983.72528
2270.0000 -64.50662 -60.77285 3.73378 2.23278 -62.01181 843.39607
2275.0000 -66.31076 -63.28400 3.02676 2.24719 -61.87896 872.03525
2280.0000 -65.71062 -62.35034 3.36027 2.11069 -63.13760 748.20469
2285.0000 -64.75530 -62.66143 2.09387 2.16111 -62.67265 733.55530
2290.0000 -66.28053 -62.38026 3.90026 2.18577 -62.44528 799.72505
2295.0000 -64.91674 -62.32192 2.59482 2.24998 -61.85326 846.57360
2300.0000 -64.54764 -61.17819 3.36945 2.26033 -61.75782 899.73559
2305.0000 -64.31819 -61.58152 2.73666 2.35434 -60.89089 1028.09686
2310.0000 -65.05648 -61.70890 3.34758 2.29733 -61.41657 915.30461
2315.0000 -64.85184 -62.15733 2.69451 2.19619 -62.34920 821.92874
2320.0000 -65.04779 -61.63504 3.41275 2.23170 -62.02181 904.07459
2325.0000 -65.50610 -62.18281 3.32328 2.25833 -61.77620 877.59952
2330.0000 -64.84947 -61.44279 3.40668 2.26262 -61.73667 869.84844
2335.0000 -64.93065 -62.12140 2.80925 2.22982 -62.03910 872.99596
2340.0000 -66.21133 -63.32192 2.88941 2.19071 -62.39970 835.37336
2345.0000 -65.63084 -63.14350 2.48734 2.14335 -62.83644 777.89236
2350.0000 -65.25062 -62.18295 3.06768 2.12912 -62.96765 729.31330
2355.0000 -63.89929 -61.66333 2.23596 2.26561 -61.70913 807.91002
2360.0000 -65.00687 -61.85428 3.15259 2.24344 -61.91355 837.20081
2365.0000 -65.20918 -61.76916 3.44003 2.35894 -60.84849 953.11455
2370.0000 -63.97535 -60.64447 3.33088 2.28082 -61.56882 841.81396
2375.0000 -64.15633 -61.06992 3.08641 2.33531 -61.06643 926.82259
2380.0000 -65.28741 -61.98108 3.30634 2.23045 -62.03330 839.41836
2385.0000 -65.52902 -63.68243 1.84658 2.14982 -62.77682 799.49965
2390.0000 -65.89024 -63.01414 2.87611 2.12673 -62.98971 755.87571
2395.0000 -65.86949 -62.87015 2.99934 2.09877 -63.24750 743.69494
2400.0000 -65.90965 -63.63465 2.27500 2.14465 -62.82443 801.78100
2405.0000 -65.94565 -63.43060 2.51505 2.09079 -63.32112 732.70814
2410.0000 -65.51832 -62.77333 2.74499 2.14232 -62.84593 750.40442
2415.0000 -64.10737 -61.20788 2.89949 2.26542 -61.71082 865.32407
2420.0000 -65.39269 -61.30569 4.08700 2.29255 -61.46072 893.29534
2425.0000 -64.64735 -61.25451 3.39285 2.34596 -60.96823 951.14051
2430.0000 -64.54189 -60.83185 3.71003 2.31609 -61.24364 929.18527
2435.0000 -65.34961 -61.69845 3.65116 2.30543 -61.34191 922.07882
2440.0000 -64.64520 -61.41008 3.23512 2.27252 -61.64536 856.29481
2445.0000 -65.13962 -62.39027 2.74935 2.19634 -62.34784 816.37807
2450.0000 -64.05090 -61.52634 2.52456 2.25004 -61.85270 847.17775
2455.0000 -64.71590 -61.80500 2.91090 2.29610 -61.42793 941.12580
2460.0000 -64.24103 -61.37368 2.86734 2.29299 -61.45663 834.40624
2465.0000 -64.99670 -62.14581 2.85089 2.23742 -61.96902 832.71054
2470.0000 -65.19961 -62.06519 3.13442 2.26349 -61.72861 857.55206
2475.0000 -65.06547 -62.02872 3.03675 2.20306 -62.28583 861.16434
2480.0000 -65.28659 -62.83045 2.45615 2.19191 -62.38871 833.17730
2485.0000 -65.77470 -62.13630 3.63840 2.17859 -62.51146 803.37136
2490.0000 -65.10430 -61.42510 3.67920 2.26868 -61.68076 857.44587
2495.0000 -64.34564 -61.63166 2.71398 2.28524 -61.52805 904.88945
2500.0000 -63.41566 -60.79065 2.62501 2.31525 -61.25137 948.30282
FREEZING PROCESS: loop number 11 T-loop= 836.00000000000000
main_MD> interactions number 11 at Temperature= 836.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.57773 4.40725 1.34865
force_rgl> df(natom) 0.53789 0.12784 -1.72625
2505.0000 -64.46550 -61.55064 2.91486 2.29409 -61.44648 872.00212
2510.0000 -64.28543 -60.31138 3.97405 2.36464 -60.79592 916.43292
2515.0000 -64.29410 -61.24070 3.05340 2.33942 -61.02854 891.57372
2520.0000 -64.84461 -62.58215 2.26246 2.26646 -61.70130 854.88521
2525.0000 -66.09474 -62.87678 3.21796 2.11755 -63.07432 761.80955
2530.0000 -65.36752 -61.68172 3.68580 2.18218 -62.47838 839.28635
2535.0000 -64.17338 -61.18115 2.99223 2.23182 -62.02070 890.43519
2540.0000 -64.47572 -61.46863 3.00709 2.28760 -61.50634 880.84070
2545.0000 -65.11826 -61.68981 3.42846 2.30753 -61.32257 928.90949
2550.0000 -65.09774 -62.36415 2.73359 2.26559 -61.70925 890.61962
2555.0000 -64.75138 -62.21192 2.53946 2.15478 -62.73105 764.10014
2560.0000 -63.11461 -60.00924 3.10537 2.31775 -61.22832 862.59806
2565.0000 -64.96598 -62.04612 2.91986 2.26359 -61.72769 839.97505
2570.0000 -65.17750 -62.23220 2.94530 2.22349 -62.09749 828.29030
2575.0000 -65.39943 -62.47731 2.92212 2.18324 -62.46867 784.96430
2580.0000 -66.39399 -63.33977 3.05422 2.16551 -62.63211 857.48805
2585.0000 -65.97302 -62.99971 2.97332 2.13755 -62.88992 776.98968
2590.0000 -65.62583 -62.41284 3.21299 2.13154 -62.94530 735.84607
2595.0000 -65.16648 -62.31550 2.85098 2.17275 -62.56538 797.89770
2600.0000 -66.13239 -63.50821 2.62418 2.15644 -62.71572 833.11405
2605.0000 -65.78221 -63.60278 2.17943 2.09036 -63.32507 736.16499
2610.0000 -65.53532 -62.99347 2.54185 2.08322 -63.39091 707.97898
2615.0000 -66.13631 -62.95664 3.17967 2.12733 -62.98418 775.37786
2620.0000 -65.71310 -62.97241 2.74069 2.13010 -62.95866 775.69497
2625.0000 -64.90786 -61.90702 3.00085 2.15505 -62.72855 782.93479
2630.0000 -65.16566 -61.92910 3.23655 2.28034 -61.57326 897.19795
2635.0000 -66.12000 -62.53129 3.58871 2.21642 -62.16269 849.12593
2640.0000 -65.30493 -61.86306 3.44187 2.20983 -62.22348 860.05768
2645.0000 -64.76145 -61.30800 3.45345 2.27324 -61.63872 905.19339
2650.0000 -65.74589 -62.32503 3.42087 2.18320 -62.46896 822.48738
2655.0000 -64.86729 -62.00454 2.86274 2.19342 -62.37476 847.24554
2660.0000 -66.12925 -63.68370 2.44555 2.14128 -62.85552 758.23740
2665.0000 -65.86746 -63.31615 2.55131 2.07896 -63.43020 695.57421
2670.0000 -65.29421 -62.43530 2.85891 2.12161 -63.03694 742.66740
2675.0000 -64.85801 -62.45561 2.40240 2.17493 -62.54528 766.57158
2680.0000 -64.81812 -62.29049 2.52763 2.14825 -62.79122 733.51464
2685.0000 -65.63539 -62.69646 2.93892 2.17842 -62.51309 800.74381
2690.0000 -65.16914 -62.56736 2.60177 2.10883 -63.15470 740.92841
2695.0000 -65.24608 -61.78007 3.46601 2.19150 -62.39250 780.34886
2700.0000 -65.23024 -61.89008 3.34016 2.20756 -62.24435 826.80037
2705.0000 -65.32309 -62.41364 2.90944 2.22514 -62.08229 860.68358
2710.0000 -64.78622 -62.07094 2.71528 2.19555 -62.35508 834.49858
2715.0000 -65.24206 -62.55194 2.69013 2.26357 -61.72793 848.69694
2720.0000 -65.16580 -61.98312 3.18268 2.22718 -62.06342 852.51898
2725.0000 -65.47585 -62.68141 2.79445 2.22054 -62.12464 854.99367
2730.0000 -65.82700 -63.31031 2.51668 2.11147 -63.13043 743.11641
2735.0000 -65.69820 -63.30459 2.39361 2.08409 -63.38291 742.60367
2740.0000 -65.64640 -62.87302 2.77338 2.07773 -63.44155 696.29100
2745.0000 -66.00782 -63.61821 2.38961 2.09425 -63.28918 713.35685
2750.0000 -66.45341 -63.44456 3.00886 2.04534 -63.74022 687.00593
FREEZING PROCESS: loop number 12 T-loop= 811.00000000000000
main_MD> interactions number 12 at Temperature= 811.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.27016 -0.58031 4.32200
force_rgl> df(natom) -0.28398 1.80779 1.70241
2755.0000 -66.40520 -63.22638 3.17883 2.09163 -63.31337 704.72627
2760.0000 -65.65248 -62.80373 2.84875 2.11670 -63.08222 753.13235
2765.0000 -65.54547 -62.88706 2.65841 2.15382 -62.73992 771.87286
2770.0000 -65.83362 -62.71550 3.11811 2.14796 -62.79395 771.17570
2775.0000 -66.23333 -63.12629 3.10704 2.13851 -62.88106 740.55076
2780.0000 -65.11585 -62.37099 2.74485 2.17556 -62.53940 801.19726
2785.0000 -65.43128 -63.04508 2.38620 2.17818 -62.51527 772.59081
2790.0000 -65.08931 -62.26379 2.82553 2.15350 -62.74283 737.78470
2795.0000 -65.55547 -63.47213 2.08334 2.13070 -62.95312 766.79733
2800.0000 -65.17065 -62.45204 2.71861 2.08327 -63.39042 718.70713
2805.0000 -66.10018 -63.62972 2.47045 2.11007 -63.14329 747.96075
2810.0000 -65.08547 -63.02769 2.05778 2.05001 -63.69709 695.38055
2815.0000 -65.00952 -62.84609 2.16343 2.17501 -62.54450 758.12701
2820.0000 -65.75419 -62.87910 2.87509 2.13325 -62.92961 729.97776
2825.0000 -65.10942 -62.30489 2.80453 2.13020 -62.95773 726.80567
2830.0000 -65.23037 -62.82617 2.40420 2.12986 -62.96082 745.18994
2835.0000 -64.46118 -61.73022 2.73096 2.22040 -62.12596 831.77446
2840.0000 -65.71001 -62.35220 3.35780 2.18538 -62.44893 803.07986
2845.0000 -66.24930 -62.62860 3.62070 2.19384 -62.37088 823.39011
2850.0000 -66.09070 -63.59276 2.49793 2.08839 -63.34320 776.38934
2855.0000 -64.55953 -62.57476 1.98477 2.13013 -62.95831 715.51267
2860.0000 -65.11249 -63.08101 2.03149 2.13768 -62.88874 755.51455
2865.0000 -65.86521 -63.28668 2.57853 2.07267 -63.48817 708.44033
2870.0000 -64.42355 -62.35411 2.06944 2.16055 -62.67788 756.32091
2875.0000 -63.99317 -60.34533 3.64784 2.30317 -61.36273 851.44068
2880.0000 -63.70610 -61.28896 2.41714 2.36199 -60.82036 954.87584
2885.0000 -65.05916 -62.27841 2.78075 2.29104 -61.47465 900.40122
2890.0000 -63.67952 -61.21075 2.46877 2.30139 -61.37913 887.80357
2895.0000 -65.02851 -62.25699 2.77152 2.17864 -62.51106 796.68869
2900.0000 -64.80947 -60.76278 4.04669 2.25213 -61.83343 808.67654
2905.0000 -65.27566 -62.48122 2.79444 2.28685 -61.51322 905.03181
2910.0000 -64.69099 -61.98295 2.70803 2.20758 -62.24418 858.72816
2915.0000 -66.00071 -63.64542 2.35529 2.17362 -62.55730 773.00769
2920.0000 -65.80898 -63.38278 2.42620 2.13005 -62.95908 764.17738
2925.0000 -65.21049 -62.23974 2.97074 2.14109 -62.85733 757.59522
2930.0000 -64.06172 -61.55867 2.50305 2.22277 -62.10414 814.90249
2935.0000 -64.37601 -61.76035 2.61566 2.31023 -61.29762 906.19489
2940.0000 -65.48667 -62.39622 3.09045 2.21872 -62.14143 856.78239
2945.0000 -65.29011 -62.53253 2.75758 2.17341 -62.55925 796.72556
2950.0000 -65.98989 -63.55175 2.43814 2.08986 -63.32964 727.65965
2955.0000 -65.66759 -63.04329 2.62430 2.12907 -62.96814 753.36755
2960.0000 -65.11780 -61.63012 3.48768 2.18411 -62.46063 816.90203
2965.0000 -64.72277 -62.12473 2.59804 2.26747 -61.69191 878.04921
2970.0000 -65.61703 -62.99174 2.62528 2.16358 -62.64993 817.09874
2975.0000 -65.57849 -63.34119 2.23729 2.11348 -63.11183 729.54614
2980.0000 -66.43405 -63.42759 3.00646 2.11387 -63.10825 751.28996
2985.0000 -65.64272 -62.58957 3.05315 2.14540 -62.81752 785.87190
2990.0000 -65.78129 -63.22963 2.55166 2.14406 -62.82993 817.76538
2995.0000 -64.86196 -62.44521 2.41675 2.08336 -63.38959 735.20671
3000.0000 -64.47262 -61.83255 2.64007 2.21631 -62.16366 821.84119
FREEZING PROCESS: loop number 13 T-loop= 786.00000000000000
main_MD> interactions number 13 at Temperature= 786.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.77203 0.67770 0.96786
force_rgl> df(natom) 2.54845 -0.03844 -1.36323
3005.0000 -64.03961 -61.86413 2.17548 2.21235 -62.20016 822.68221
3010.0000 -65.15155 -62.04151 3.11004 2.25617 -61.79610 847.05162
3015.0000 -64.92715 -61.60945 3.31770 2.24385 -61.90975 822.53971
3020.0000 -64.47916 -60.96165 3.51751 2.34907 -60.93955 984.93341
3025.0000 -65.95991 -63.39320 2.56671 2.19718 -62.34010 799.75816
3030.0000 -66.09455 -63.36406 2.73049 2.08183 -63.40371 687.48686
3035.0000 -65.54120 -63.03584 2.50537 2.12004 -63.05137 792.26908
3040.0000 -65.44567 -62.87251 2.57316 2.07907 -63.42921 684.34834
3045.0000 -65.82141 -62.23116 3.59025 2.17991 -62.49934 835.06341
3050.0000 -65.12070 -62.44718 2.67352 2.18739 -62.43031 849.99759
3055.0000 -66.01707 -63.16412 2.85295 2.20093 -62.30555 859.72959
3060.0000 -65.68474 -62.80427 2.88047 2.15611 -62.71879 809.00143
3065.0000 -63.81204 -60.95437 2.85767 2.28179 -61.55990 877.39654
3070.0000 -65.30581 -62.62902 2.67679 2.22552 -62.07879 807.92091
3075.0000 -65.55625 -62.81618 2.74007 2.17451 -62.54913 839.55477
3080.0000 -66.29719 -63.32314 2.97405 2.12452 -63.01006 784.72810
3085.0000 -65.87406 -62.41437 3.45968 2.11614 -63.08737 754.00288
3090.0000 -65.59456 -63.20905 2.38551 2.14314 -62.83841 739.39903
3095.0000 -66.22054 -62.75743 3.46310 2.16240 -62.66077 751.52901
3100.0000 -65.74136 -62.74824 2.99311 2.19497 -62.36046 771.12139
3105.0000 -64.33248 -61.41540 2.91708 2.20940 -62.22744 774.68737
3110.0000 -65.75173 -62.24606 3.50567 2.25965 -61.76407 876.73100
3115.0000 -64.71823 -61.51083 3.20740 2.20995 -62.22232 787.86241
3120.0000 -65.19145 -61.78242 3.40904 2.25974 -61.76318 858.49571
3125.0000 -65.27069 -62.63356 2.63713 2.23159 -62.02276 845.52155
3130.0000 -66.34915 -63.50935 2.83980 2.14047 -62.86300 781.34914
3135.0000 -65.63086 -63.64499 1.98587 2.07792 -63.43973 696.74533
3140.0000 -65.88505 -63.08119 2.80385 2.12064 -63.04587 739.78680
3145.0000 -65.73410 -63.07658 2.65752 2.05893 -63.61483 671.82423
3150.0000 -65.45569 -62.88491 2.57079 2.15294 -62.74801 788.80894
3155.0000 -65.31449 -62.74449 2.57000 2.13716 -62.89350 755.67029
3160.0000 -64.75750 -62.38556 2.37194 2.19530 -62.35743 749.37753
3165.0000 -64.83792 -61.87793 2.96000 2.23951 -61.94972 795.34557
3170.0000 -65.05099 -62.08787 2.96312 2.23119 -62.02645 807.39761
3175.0000 -64.29345 -61.05435 3.23910 2.28906 -61.49289 878.25995
3180.0000 -65.78866 -63.09594 2.69272 2.19600 -62.35095 807.32595
3185.0000 -65.58821 -62.12322 3.46499 2.21518 -62.17408 814.32488
3190.0000 -64.77592 -61.50655 3.26937 2.25153 -61.83892 841.30771
3195.0000 -65.13057 -62.60054 2.53002 2.23031 -62.03463 871.37048
3200.0000 -65.20590 -62.05108 3.15481 2.17151 -62.57675 782.33687
3205.0000 -65.32832 -61.97146 3.35685 2.21457 -62.17972 858.33068
3210.0000 -65.28941 -61.99141 3.29799 2.20781 -62.24210 842.47447
3215.0000 -64.36412 -61.73222 2.63190 2.28474 -61.53271 900.69529
3220.0000 -64.90486 -61.98547 2.91938 2.23511 -61.99033 793.75124
3225.0000 -65.92840 -63.96464 1.96376 2.16950 -62.59529 812.60823
3230.0000 -65.90958 -62.62662 3.28296 2.09212 -63.30879 726.97532
3235.0000 -65.95910 -63.17538 2.78372 2.14508 -62.82052 792.55989
3240.0000 -65.54960 -63.48309 2.06651 2.06649 -63.54514 701.77060
3245.0000 -65.80211 -63.43985 2.36227 2.06868 -63.52497 684.11073
3250.0000 -64.94946 -62.10551 2.84396 2.13381 -62.92445 758.52514
FREEZING PROCESS: loop number 14 T-loop= 761.00000000000000
main_MD> interactions number 14 at Temperature= 761.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.57202 -2.63557 0.54920
force_rgl> df(natom) 12.56778 -3.95132 -5.99236
3255.0000 -65.36158 -62.06008 3.30150 2.20446 -62.27292 791.53538
3260.0000 -64.93265 -61.98484 2.94782 2.20937 -62.22769 823.89779
3265.0000 -65.97958 -63.26815 2.71143 2.11879 -63.06294 749.44896
3270.0000 -65.80487 -63.09392 2.71095 2.07296 -63.48550 675.18776
3275.0000 -65.87946 -62.84180 3.03767 2.11799 -63.07030 745.02416
3280.0000 -66.79544 -63.37303 3.42241 2.10616 -63.17939 724.83463
3285.0000 -66.06798 -63.19206 2.87592 2.07497 -63.46694 696.08238
3290.0000 -65.38370 -63.01774 2.36596 2.11350 -63.11169 737.01262
3295.0000 -64.69694 -61.79106 2.90588 2.17755 -62.52111 771.76820
3300.0000 -65.36582 -61.85560 3.51022 2.27854 -61.58989 906.79846
3305.0000 -64.90705 -61.71717 3.18989 2.27796 -61.59522 895.27710
3310.0000 -65.24711 -62.02906 3.21805 2.24518 -61.89750 892.25956
3315.0000 -66.06735 -62.44829 3.61906 2.21436 -62.18168 844.48452
3320.0000 -65.50778 -62.60501 2.90278 2.19588 -62.35204 810.93768
3325.0000 -64.48117 -61.51331 2.96786 2.22365 -62.09597 815.46653
3330.0000 -65.69229 -63.18835 2.50394 2.13344 -62.92780 702.76103
3335.0000 -66.17764 -63.43645 2.74119 2.06205 -63.58608 707.59926
3340.0000 -65.96113 -63.03358 2.92756 2.11339 -63.11266 774.37776
3345.0000 -64.52361 -61.68526 2.83835 2.18820 -62.42288 779.99563
3350.0000 -65.64525 -62.07714 3.56811 2.18824 -62.42248 846.00153
3355.0000 -65.46833 -61.75685 3.71148 2.20216 -62.29418 827.02116
3360.0000 -65.11136 -61.78714 3.32422 2.25028 -61.85042 903.97453
3365.0000 -65.58656 -63.03038 2.55618 2.14590 -62.81295 772.44831
3370.0000 -66.76766 -63.98646 2.78120 2.06295 -63.57776 705.67373
3375.0000 -65.70846 -63.16492 2.54354 2.08763 -63.35021 678.04090
3380.0000 -65.80916 -63.67851 2.13065 2.10252 -63.21289 748.34273
3385.0000 -66.57296 -64.06763 2.50533 2.02936 -63.88750 676.74511
3390.0000 -65.52732 -62.95263 2.57470 2.06976 -63.51502 711.39308
3395.0000 -64.93456 -61.66736 3.26720 2.20667 -62.25256 816.07331
3400.0000 -64.84827 -62.04363 2.80465 2.24371 -61.91104 857.09122
3405.0000 -65.23924 -62.29823 2.94101 2.23782 -61.96533 902.68539
3410.0000 -64.58677 -61.34831 3.23846 2.21173 -62.20588 848.11917
3415.0000 -65.26624 -62.41493 2.85131 2.22372 -62.09535 831.24563
3420.0000 -64.59336 -61.23424 3.35912 2.21604 -62.16620 804.42609
3425.0000 -65.42603 -62.56698 2.85904 2.22397 -62.09305 820.87078
3430.0000 -65.44071 -62.18872 3.25199 2.19747 -62.33742 828.23398
3435.0000 -65.59208 -62.82444 2.76764 2.17501 -62.54446 797.20538
3440.0000 -66.14342 -63.08301 3.06041 2.15448 -62.73381 776.23224
3445.0000 -66.85079 -64.39916 2.45163 2.09532 -63.27930 690.85602
3450.0000 -65.65263 -63.47903 2.17360 2.00420 -64.11953 631.58438
3455.0000 -66.06094 -63.84661 2.21433 2.05935 -63.61097 699.20934
3460.0000 -65.50042 -62.93281 2.56761 2.07418 -63.47430 728.03010
3465.0000 -64.35325 -61.54123 2.81202 2.19240 -62.38415 817.09970
3470.0000 -65.46157 -62.52961 2.93197 2.24998 -61.85323 874.38190
3475.0000 -65.38447 -63.07032 2.31414 2.17383 -62.55543 797.62840
3480.0000 -65.39021 -62.79656 2.59365 2.11117 -63.13315 755.25917
3485.0000 -65.59463 -62.84189 2.75275 2.20201 -62.29558 884.14802
3490.0000 -66.00175 -63.30245 2.69930 2.12693 -62.98784 779.24018
3495.0000 -65.56470 -63.20322 2.36149 2.09359 -63.29530 703.50643
3500.0000 -66.02947 -63.41424 2.61523 2.09604 -63.27268 701.43645
FREEZING PROCESS: loop number 15 T-loop= 736.00000000000000
main_MD> interactions number 15 at Temperature= 736.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.41204 -0.25924 0.67891
force_rgl> df(natom) 0.46964 1.07882 -1.05646
3505.0000 -66.32427 -63.75547 2.56880 2.07296 -63.48549 714.46767
3510.0000 -65.93627 -63.62426 2.31200 2.06084 -63.59725 718.75980
3515.0000 -66.15643 -63.57083 2.58561 2.06025 -63.60270 695.15547
3520.0000 -66.19539 -64.12407 2.07132 2.01725 -63.99920 642.28488
3525.0000 -65.81830 -63.33850 2.47980 2.02016 -63.97236 694.74043
3530.0000 -66.51707 -64.21107 2.30600 2.03903 -63.79834 689.65251
3535.0000 -66.03408 -63.21073 2.82335 2.02555 -63.92263 665.48837
3540.0000 -65.73035 -63.13503 2.59532 2.10529 -63.18737 718.40351
3545.0000 -66.04814 -62.52688 3.52126 2.10906 -63.15260 738.29045
3550.0000 -65.55098 -62.81864 2.73235 2.13234 -62.93797 742.73279
3555.0000 -65.61338 -63.06824 2.54515 2.14966 -62.77822 739.72001
3560.0000 -65.18296 -61.92697 3.25599 2.16715 -62.61696 735.37051
3565.0000 -65.38881 -62.33124 3.05757 2.15502 -62.72885 773.44080
3570.0000 -66.00067 -63.46564 2.53503 2.14315 -62.83830 750.25756
3575.0000 -65.61668 -62.22066 3.39602 2.11080 -63.13655 697.86804
3580.0000 -65.13568 -62.72091 2.41477 2.12948 -62.96433 729.07523
3585.0000 -65.93354 -63.68823 2.24531 2.11180 -63.12732 732.81841
3590.0000 -66.51917 -63.92935 2.58982 2.05247 -63.67448 695.27162
3595.0000 -65.73631 -63.31323 2.42307 2.08144 -63.40729 686.69266
3600.0000 -66.32179 -63.88347 2.43832 2.04612 -63.73302 675.59403
3605.0000 -66.02250 -63.55919 2.46330 1.97751 -64.36559 594.55232
3610.0000 -66.16855 -63.64322 2.52532 2.07892 -63.43055 673.44157
3615.0000 -66.24023 -63.48193 2.75830 2.09122 -63.31716 736.32251
3620.0000 -64.79858 -62.02517 2.77341 2.15052 -62.77034 771.84964
3625.0000 -65.95037 -62.98665 2.96372 2.20268 -62.28935 834.68970
3630.0000 -64.70669 -62.32273 2.38396 2.14200 -62.84886 751.30468
3635.0000 -64.94394 -62.21857 2.72537 2.17639 -62.53174 777.45028
3640.0000 -65.80979 -62.60028 3.20950 2.20649 -62.25428 813.37855
3645.0000 -64.94415 -61.65067 3.29348 2.17321 -62.56114 779.93392
3650.0000 -65.90599 -63.47494 2.43105 2.18008 -62.49777 778.21996
3655.0000 -66.10575 -63.56619 2.53956 2.07982 -63.42221 710.92841
3660.0000 -65.94245 -62.60142 3.34103 2.12916 -62.96726 783.43086
3665.0000 -65.61920 -62.72549 2.89371 2.14239 -62.84529 761.36964
3670.0000 -66.29266 -63.62092 2.67174 2.12102 -63.04238 788.31485
3675.0000 -66.12125 -63.78636 2.33489 2.02904 -63.89048 665.73050
3680.0000 -65.53457 -62.92270 2.61187 2.10756 -63.16648 738.72942
3685.0000 -66.65373 -64.11251 2.54122 2.05076 -63.69023 700.59247
3690.0000 -66.05728 -63.57202 2.48526 2.02358 -63.94083 698.51889
3695.0000 -65.89152 -63.15913 2.73239 2.08151 -63.40662 701.96160
3700.0000 -65.09517 -62.82549 2.26969 2.12833 -62.97490 721.38961
3705.0000 -65.60948 -62.49615 3.11333 2.18017 -62.49689 814.78431
3710.0000 -65.73224 -63.42217 2.31006 2.08707 -63.35537 695.58659
3715.0000 -65.41656 -61.96618 3.45039 2.13138 -62.94685 746.95813
3720.0000 -66.18926 -63.46461 2.72465 2.15157 -62.76066 804.43683
3725.0000 -66.19371 -64.23526 1.95844 2.08067 -63.41438 742.65422
3730.0000 -66.57932 -63.45853 3.12079 2.06446 -63.56388 696.21968
3735.0000 -65.29864 -62.91118 2.38746 2.06564 -63.55296 715.61774
3740.0000 -65.22235 -62.75039 2.47196 2.15412 -62.73715 744.33745
3745.0000 -65.11252 -62.33159 2.78093 2.17516 -62.54313 778.21523
3750.0000 -66.17184 -63.98555 2.18629 2.08888 -63.33874 731.89453
FREEZING PROCESS: loop number 16 T-loop= 711.00000000000000
main_MD> interactions number 16 at Temperature= 711.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.28727 -0.06422 3.79731
force_rgl> df(natom) 0.26173 -0.40513 0.22020
3755.0000 -65.87814 -62.83309 3.04505 2.11361 -63.11071 776.02750
3760.0000 -66.09049 -63.73895 2.35154 2.10738 -63.16810 776.00588
3765.0000 -66.03350 -63.70588 2.32762 2.04024 -63.78725 659.23097
3770.0000 -66.66985 -64.55256 2.11729 1.99919 -64.16570 649.18861
3775.0000 -65.92038 -63.77493 2.14545 1.99345 -64.21862 634.32142
3780.0000 -65.85849 -63.15442 2.70407 2.07894 -63.43032 725.46011
3785.0000 -66.37374 -63.74014 2.63360 2.06771 -63.53387 710.40096
3790.0000 -65.05952 -63.35962 1.69990 2.06865 -63.52527 604.99003
3795.0000 -66.76355 -63.70027 3.06328 2.10568 -63.18381 709.06846
3800.0000 -66.06357 -63.60554 2.45803 2.05666 -63.63584 704.55238
3805.0000 -66.61720 -63.91020 2.70701 2.04141 -63.77643 693.88819
3810.0000 -65.11412 -62.79768 2.31645 2.07581 -63.45920 720.83441
3815.0000 -65.48774 -63.01143 2.47631 2.14936 -62.78098 739.98011
3820.0000 -65.33629 -63.14231 2.19397 2.15084 -62.76741 759.15070
3825.0000 -65.83829 -63.41203 2.42626 2.10136 -63.22366 723.57403
3830.0000 -66.24504 -63.57840 2.66664 2.05459 -63.65484 711.85557
3835.0000 -65.59982 -63.06784 2.53197 2.08805 -63.34637 721.61843
3840.0000 -65.62451 -63.32858 2.29593 2.12500 -63.00563 771.01306
3845.0000 -65.80026 -62.40946 3.39080 2.07720 -63.44640 673.13281
3850.0000 -66.21971 -63.41977 2.79994 2.12136 -63.03923 709.04928
3855.0000 -66.28956 -62.92428 3.36528 2.07400 -63.47588 645.84240
3860.0000 -65.50487 -62.76420 2.74068 2.11001 -63.14388 724.71871
3865.0000 -65.68179 -63.17318 2.50861 2.13692 -62.89570 777.25800
3870.0000 -65.82921 -63.00780 2.82141 2.13308 -62.93116 762.43560
3875.0000 -66.89071 -63.98157 2.90915 2.07622 -63.45543 711.68256
3880.0000 -65.76707 -63.40411 2.36296 2.05778 -63.62546 678.75023
3885.0000 -66.85004 -64.53701 2.31303 2.01482 -64.02156 667.84187
3890.0000 -66.67101 -64.40320 2.26782 1.96373 -64.49273 618.01128
3895.0000 -66.33438 -64.07068 2.26370 1.96688 -64.46367 628.37285
3900.0000 -65.26367 -62.95121 2.31246 2.05356 -63.66434 642.32616
3905.0000 -65.48278 -63.60281 1.87997 2.13044 -62.95545 735.58071
3910.0000 -66.57310 -63.15035 3.42276 2.09881 -63.24710 756.80774
3915.0000 -65.89300 -62.80640 3.08659 2.10273 -63.21095 749.75327
3920.0000 -66.76649 -64.51694 2.24955 2.07563 -63.46084 710.58421
3925.0000 -66.15254 -64.05955 2.09299 2.00790 -64.08542 625.40096
3930.0000 -66.45465 -63.89590 2.55875 1.98588 -64.28844 594.98371
3935.0000 -66.79739 -64.14783 2.64955 2.03860 -63.80237 669.32302
3940.0000 -65.79785 -63.75025 2.04760 2.02303 -63.94586 668.37824
3945.0000 -66.38508 -64.11290 2.27218 2.01356 -64.03318 639.71985
3950.0000 -66.19189 -63.79726 2.39464 1.99194 -64.23258 630.34662
3955.0000 -66.22853 -63.74648 2.48205 2.05452 -63.65553 679.85616
3960.0000 -65.39834 -62.85412 2.54423 2.10357 -63.20325 751.65775
3965.0000 -66.12457 -63.04592 3.07865 2.11113 -63.13354 750.95679
3970.0000 -64.87688 -62.11827 2.75861 2.17993 -62.49914 793.79806
3975.0000 -65.45602 -63.04473 2.41128 2.12328 -63.02155 768.39838
3980.0000 -65.61221 -62.95192 2.66029 2.09746 -63.25957 691.15396
3985.0000 -65.47000 -62.75884 2.71116 2.11452 -63.10226 702.72189
3990.0000 -66.23895 -63.24288 2.99606 2.09525 -63.27996 689.83660
3995.0000 -66.38508 -63.71787 2.66720 2.07166 -63.49751 708.43675
4000.0000 -66.18164 -63.90095 2.28069 2.05894 -63.61474 712.10163
FREEZING PROCESS: loop number 17 T-loop= 686.00000000000000
main_MD> interactions number 17 at Temperature= 686.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.45128 0.12792 1.01785
force_rgl> df(natom) 2.92854 -0.98137 0.27030
4005.0000 -66.41901 -64.75304 1.66597 1.92139 -64.88311 527.87569
4010.0000 -66.14570 -64.13421 2.01149 1.97308 -64.40652 607.99532
4015.0000 -65.99934 -64.57493 1.42440 1.99012 -64.24932 623.16393
4020.0000 -66.53127 -64.03540 2.49586 1.94942 -64.62461 570.66206
4025.0000 -66.24650 -64.46688 1.77962 1.98223 -64.32215 625.67957
4030.0000 -66.34475 -63.70449 2.64026 2.02080 -63.96643 649.79473
4035.0000 -65.42769 -63.18826 2.23943 2.10417 -63.19768 725.54157
4040.0000 -66.40618 -63.38441 3.02177 2.05942 -63.61035 646.81493
4045.0000 -66.40186 -64.01194 2.38992 2.05186 -63.68008 688.89061
4050.0000 -66.49799 -64.34104 2.15695 2.00088 -64.15015 634.17070
4055.0000 -66.30626 -64.27678 2.02947 2.04954 -63.70150 681.79287
4060.0000 -66.64801 -63.66883 2.97918 2.05533 -63.64811 693.48896
4065.0000 -66.04516 -63.31326 2.73190 2.08451 -63.37904 728.69620
4070.0000 -66.59605 -63.97851 2.61754 2.04817 -63.71409 670.60836
4075.0000 -66.79573 -64.70493 2.09080 2.01148 -64.05239 629.24307
4080.0000 -64.86399 -62.94217 1.92182 2.07181 -63.49610 716.82800
4085.0000 -65.92375 -63.52749 2.39626 2.10493 -63.19067 746.70105
4090.0000 -66.19272 -64.01770 2.17502 2.08781 -63.34857 715.55319
4095.0000 -66.28336 -64.03633 2.24702 2.01694 -64.00208 637.45088
4100.0000 -66.25052 -64.00490 2.24563 2.03391 -63.84558 664.62389
4105.0000 -65.84629 -63.65838 2.18791 2.03790 -63.80881 673.73424
4110.0000 -65.48490 -62.75014 2.73475 2.08608 -63.36456 665.90454
4115.0000 -64.97506 -62.03047 2.94460 2.20983 -62.22343 746.73978
4120.0000 -64.71375 -61.22369 3.49007 2.28395 -61.54002 865.69382
4125.0000 -65.72791 -62.01772 3.71019 2.21865 -62.14209 831.28766
4130.0000 -65.12512 -62.36491 2.76022 2.17588 -62.53645 773.51233
4135.0000 -66.43395 -63.40411 3.02984 2.11884 -63.06243 688.56852
4140.0000 -65.89995 -63.40485 2.49510 2.08341 -63.38917 715.28257
4145.0000 -66.67781 -63.90215 2.77566 2.03136 -63.86910 682.87382
4150.0000 -67.00256 -63.76169 3.24087 2.01738 -63.99804 686.30568
4155.0000 -65.68076 -63.51326 2.16750 2.06381 -63.56985 699.50286
4160.0000 -66.69731 -63.95848 2.73884 2.02982 -63.88332 643.49457
4165.0000 -66.20434 -63.79437 2.40996 1.99913 -64.16629 676.48178
4170.0000 -65.64646 -63.28957 2.35689 2.04064 -63.78352 710.75879
4175.0000 -65.67817 -63.10303 2.57514 2.11747 -63.07511 740.86846
4180.0000 -66.27370 -63.12412 3.14958 2.15632 -62.71681 800.46039
4185.0000 -65.38435 -63.05761 2.32674 2.11503 -63.09761 760.25815
4190.0000 -65.63053 -62.67047 2.96007 2.15279 -62.74935 749.64108
4195.0000 -65.31422 -62.52164 2.79258 2.14833 -62.79053 777.95164
4200.0000 -66.22946 -63.73169 2.49777 2.08692 -63.35676 758.98865
4205.0000 -66.10411 -63.53795 2.56617 2.00298 -64.13075 638.96799
4210.0000 -65.87315 -64.01190 1.86126 2.05785 -63.62479 658.89693
4215.0000 -66.56758 -64.27903 2.28855 2.00042 -64.15436 628.32861
4220.0000 -65.48978 -62.65085 2.83892 2.11149 -63.13023 722.36226
4225.0000 -65.87478 -62.86171 3.01307 2.16268 -62.65824 753.68590
4230.0000 -65.93250 -63.18407 2.74843 2.11654 -63.08363 778.53797
4235.0000 -66.23992 -63.41269 2.82723 2.11910 -63.06001 757.96429
4240.0000 -65.85770 -63.60968 2.24802 2.05340 -63.66587 690.10366
4245.0000 -65.44547 -62.81907 2.62640 2.13652 -62.89946 788.50724
4250.0000 -64.96922 -62.62908 2.34014 2.12771 -62.98070 766.36240
FREEZING PROCESS: loop number 18 T-loop= 661.00000000000000
main_MD> interactions number 18 at Temperature= 661.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.99650 2.45692 -0.78292
force_rgl> df(natom) -1.15318 0.39486 1.01578
4255.0000 -65.67926 -62.33295 3.34631 2.19403 -62.36912 796.45937
4260.0000 -66.44085 -64.03729 2.40356 2.07628 -63.45488 706.66383
4265.0000 -66.35404 -64.23133 2.12272 1.97172 -64.41901 605.05783
4270.0000 -66.68012 -64.71906 1.96106 1.94502 -64.66520 553.07241
4275.0000 -66.81920 -64.82263 1.99657 1.96509 -64.48014 598.80797
4280.0000 -67.09454 -65.13423 1.96031 1.92560 -64.84425 565.03308
4285.0000 -66.44689 -63.67797 2.76891 1.96680 -64.46440 604.06430
4290.0000 -66.53735 -64.57943 1.95792 1.96920 -64.44225 590.63205
4295.0000 -66.23194 -64.05292 2.17903 1.97752 -64.36552 606.46494
4300.0000 -66.58057 -64.17288 2.40769 2.06548 -63.55448 702.31700
4305.0000 -66.58479 -64.60189 1.98290 1.98434 -64.30270 627.76897
4310.0000 -66.59541 -63.86474 2.73067 1.99233 -64.22901 629.81927
4315.0000 -66.09746 -64.01580 2.08166 2.00329 -64.12789 654.25674
4320.0000 -66.25887 -63.97232 2.28655 2.02894 -63.89138 645.55097
4325.0000 -66.66836 -63.81775 2.85061 2.03163 -63.86657 667.64891
4330.0000 -67.25066 -64.28783 2.96283 2.06130 -63.59299 718.47929
4335.0000 -66.33050 -63.58698 2.74352 2.06696 -63.54079 712.85066
4340.0000 -66.58898 -64.23950 2.34947 2.00924 -64.07306 642.70213
4345.0000 -66.27461 -63.42838 2.84623 2.03586 -63.82763 635.54876
4350.0000 -66.78583 -64.68312 2.10270 2.02551 -63.92299 607.99326
4355.0000 -66.31508 -63.76055 2.55453 2.04018 -63.78775 662.79282
4360.0000 -65.54819 -62.55345 2.99474 2.08664 -63.35933 669.74501
4365.0000 -66.30326 -64.37626 1.92700 2.05180 -63.68057 693.79626
4370.0000 -66.12117 -63.75922 2.36195 2.00259 -64.13439 631.36233
4375.0000 -66.03050 -63.33431 2.69619 2.06342 -63.57342 700.86651
4380.0000 -66.67619 -64.11642 2.55977 2.04314 -63.76047 708.85652
4385.0000 -66.40465 -63.48493 2.91972 2.02841 -63.89631 673.96395
4390.0000 -65.56754 -63.35918 2.20837 2.07747 -63.44395 706.93495
4395.0000 -65.32748 -62.46167 2.86581 2.12151 -63.03783 742.07935
4400.0000 -65.81169 -62.88179 2.92990 2.18825 -62.42245 789.63690
4405.0000 -65.91514 -62.89045 3.02469 2.13061 -62.95394 751.17255
4410.0000 -65.87008 -63.67872 2.19136 2.07856 -63.43388 699.05884
4415.0000 -66.17639 -63.46852 2.70786 2.04254 -63.76602 630.66475
4420.0000 -65.84996 -63.50521 2.34476 2.09260 -63.30444 727.35500
4425.0000 -66.09889 -63.42322 2.67567 2.04046 -63.78517 617.60944
4430.0000 -65.28445 -63.47705 1.80740 2.05473 -63.65357 699.14967
4435.0000 -66.02676 -63.92421 2.10255 2.03912 -63.79754 690.09877
4440.0000 -65.71494 -63.72808 1.98686 2.05759 -63.62722 689.51258
4445.0000 -65.85332 -62.97215 2.88118 2.02447 -63.93261 656.44108
4450.0000 -65.54880 -63.39630 2.15250 2.10221 -63.21574 710.66279
4455.0000 -65.78933 -63.37553 2.41380 2.08387 -63.38490 676.04412
4460.0000 -66.17742 -63.91755 2.25988 2.06432 -63.56520 658.51777
4465.0000 -66.03644 -63.67713 2.35931 2.02345 -63.94200 657.11426
4470.0000 -66.74224 -64.02417 2.71806 2.05141 -63.68422 680.40067
4475.0000 -66.32572 -64.26663 2.05909 2.03786 -63.80917 644.46087
4480.0000 -65.75777 -63.52002 2.23775 1.99837 -64.17328 637.80639
4485.0000 -66.72161 -64.65537 2.06623 1.99892 -64.16825 648.92980
4490.0000 -66.25482 -64.12001 2.13481 1.96084 -64.51930 582.63633
4495.0000 -65.94251 -63.70618 2.23633 2.03848 -63.80343 653.45302
4500.0000 -65.80625 -62.87667 2.92958 2.05559 -63.64567 669.80896
FREEZING PROCESS: loop number 19 T-loop= 636.00000000000000
main_MD> interactions number 19 at Temperature= 636.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.65692 -1.38599 0.14415
force_rgl> df(natom) -0.44372 0.64109 0.00704
4505.0000 -66.10305 -63.51431 2.58874 2.07243 -63.49037 723.06975
4510.0000 -66.08173 -63.48960 2.59214 2.09915 -63.24402 706.41210
4515.0000 -66.77035 -64.48770 2.28265 1.98293 -64.31564 606.10367
4520.0000 -66.04392 -64.12077 1.92315 1.97055 -64.42980 594.17680
4525.0000 -66.75933 -64.11862 2.64071 2.02160 -63.95909 615.71168
4530.0000 -67.08706 -64.04493 3.04212 2.00202 -64.13960 642.01733
4535.0000 -66.83355 -64.67396 2.15959 1.97622 -64.37756 617.87799
4540.0000 -66.41838 -64.80655 1.61183 1.94013 -64.71027 590.53142
4545.0000 -67.07558 -64.31176 2.76383 1.97595 -64.38000 614.29099
4550.0000 -66.78016 -64.34818 2.43197 2.02739 -63.90566 659.99321
4555.0000 -66.64196 -64.36875 2.27322 1.95551 -64.56851 603.10115
4560.0000 -66.46676 -64.59205 1.87472 1.95433 -64.57934 608.77602
4565.0000 -65.32527 -63.40528 1.91999 2.01125 -64.05452 633.58701
4570.0000 -65.07949 -62.72114 2.35835 2.16564 -62.63087 773.23770
4575.0000 -65.26886 -63.12133 2.14753 2.12817 -62.97645 736.52183
4580.0000 -65.46116 -62.97275 2.48841 2.09066 -63.32230 723.00379
4585.0000 -66.55111 -64.36699 2.18411 2.05303 -63.66927 669.20009
4590.0000 -67.36297 -65.11169 2.25129 1.94119 -64.70051 597.18819
4595.0000 -67.30914 -65.24560 2.06354 1.89835 -65.09559 555.36568
4600.0000 -66.92394 -64.94909 1.97485 1.89458 -65.13036 550.44143
4605.0000 -66.50604 -64.61014 1.89590 1.95549 -64.56871 584.11007
4610.0000 -66.28689 -64.61117 1.67573 1.97841 -64.35735 590.13844
4615.0000 -66.18861 -64.31274 1.87587 1.93740 -64.73552 541.70665
4620.0000 -67.11210 -64.63818 2.47392 1.95527 -64.57067 557.67917
4625.0000 -67.54694 -64.93797 2.60898 1.94188 -64.69417 603.89976
4630.0000 -67.12957 -64.68032 2.44925 1.92898 -64.81314 592.16338
4635.0000 -66.96445 -65.03353 1.93092 1.93356 -64.77087 555.72165
4640.0000 -66.85180 -64.56355 2.28825 1.92607 -64.83994 565.16637
4645.0000 -66.11988 -63.67252 2.44736 2.00862 -64.07875 640.96223
4650.0000 -65.60982 -63.40634 2.20348 2.10843 -63.15848 703.02871
4655.0000 -65.53996 -63.07663 2.46333 2.10171 -63.22036 697.70015
4660.0000 -66.89829 -64.95962 1.93867 1.98457 -64.30056 590.35507
4665.0000 -67.33976 -64.73381 2.60595 1.89068 -65.16630 539.60434
4670.0000 -66.85158 -65.03536 1.81622 1.90562 -65.02849 550.50396
4675.0000 -66.77876 -64.47608 2.30267 1.93901 -64.72064 578.34752
4680.0000 -66.69285 -64.04936 2.64348 1.96215 -64.50729 595.86931
4685.0000 -66.21873 -64.06298 2.15575 2.02573 -63.92098 681.33506
4690.0000 -65.31746 -63.45290 1.86456 2.03780 -63.80974 650.83148
4695.0000 -66.13906 -64.24312 1.89594 2.03371 -63.84738 670.08965
4700.0000 -66.85379 -64.60580 2.24799 2.00514 -64.11084 604.52194
4705.0000 -66.26982 -64.34087 1.92895 1.96962 -64.43843 593.46312
4710.0000 -67.13501 -64.80306 2.33195 1.96173 -64.51111 582.71284
4715.0000 -66.80460 -64.73392 2.07068 1.93760 -64.73360 538.90597
4720.0000 -66.83078 -64.38379 2.44699 1.96316 -64.49799 573.41976
4725.0000 -66.93082 -64.90816 2.02265 1.94411 -64.67364 586.96746
4730.0000 -67.10647 -65.31177 1.79470 1.91374 -64.95362 548.00889
4735.0000 -65.90138 -63.86541 2.03597 1.95263 -64.59501 583.08839
4740.0000 -66.33236 -64.17115 2.16122 1.98887 -64.26089 613.02276
4745.0000 -66.82628 -65.17868 1.64761 1.93644 -64.74437 565.19088
4750.0000 -66.81516 -64.12089 2.69427 1.91457 -64.94599 529.34190
FREEZING PROCESS: loop number 20 T-loop= 611.00000000000000
main_MD> interactions number 20 at Temperature= 611.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.10819 0.82526 5.27646
force_rgl> df(natom) -2.22548 -1.75027 -1.18379
4755.0000 -66.35758 -64.20568 2.15190 1.95806 -64.54497 590.67899
4760.0000 -66.92377 -64.49315 2.43062 1.99325 -64.22049 652.61680
4765.0000 -66.05164 -64.13630 1.91533 1.96525 -64.47870 612.25676
4770.0000 -66.41108 -64.07002 2.34106 1.99279 -64.22470 618.67178
4775.0000 -66.34947 -63.65447 2.69500 2.07010 -63.51190 706.63888
4780.0000 -66.88438 -64.90783 1.97655 1.96731 -64.45970 593.14655
4785.0000 -66.70478 -65.06147 1.64331 1.92614 -64.83928 549.51923
4790.0000 -66.54966 -64.82070 1.72896 1.88353 -65.23223 495.22513
4795.0000 -67.15603 -64.62246 2.53356 1.93431 -64.76395 562.49129
4800.0000 -66.75676 -64.09336 2.66340 1.98799 -64.26904 622.50638
4805.0000 -66.98883 -65.03513 1.95370 1.94936 -64.62523 558.74744
4810.0000 -67.10330 -65.02880 2.07450 1.89519 -65.12470 524.85508
4815.0000 -66.83925 -64.62030 2.21895 1.91772 -64.91694 537.93869
4820.0000 -66.69497 -64.96789 1.72708 1.93419 -64.76512 555.63020
4825.0000 -66.28031 -64.24028 2.04004 1.95981 -64.52880 592.53129
4830.0000 -66.67456 -64.26439 2.41017 2.01014 -64.06472 653.97603
4835.0000 -66.38393 -63.76957 2.61437 2.03798 -63.80805 658.92749
4840.0000 -65.56246 -63.44681 2.11565 2.03121 -63.87049 633.31499
4845.0000 -65.37672 -62.82386 2.55287 2.12625 -62.99409 779.20963
4850.0000 -65.99876 -64.01981 1.97895 2.09744 -63.25974 683.72885
4855.0000 -66.87296 -63.61275 3.26021 2.04436 -63.74918 630.19058
4860.0000 -66.56664 -64.00459 2.56205 2.03099 -63.87246 638.67581
4865.0000 -65.67420 -63.28406 2.39014 2.06079 -63.59774 682.96660
4870.0000 -65.41851 -62.83574 2.58278 2.11475 -63.10016 720.59284
4875.0000 -66.49201 -64.56267 1.92934 2.04753 -63.71998 688.14196
4880.0000 -66.73153 -64.29888 2.43265 1.98078 -64.33549 638.34209
4885.0000 -67.18187 -65.05968 2.12220 1.91650 -64.92821 559.17269
4890.0000 -65.92206 -63.60626 2.31580 1.92086 -64.88799 559.43966
4895.0000 -66.28193 -63.27950 3.00243 2.03944 -63.79455 673.42331
4900.0000 -66.20007 -63.94681 2.25326 2.06313 -63.57611 734.36330
4905.0000 -66.52654 -63.85916 2.66738 2.03674 -63.81952 706.58491
4910.0000 -66.01889 -63.99148 2.02741 1.99477 -64.20648 645.39392
4915.0000 -66.65599 -64.50323 2.15276 1.98961 -64.25410 589.84045
4920.0000 -65.76134 -63.67367 2.08767 2.01734 -63.99836 654.04767
4925.0000 -66.80213 -64.44551 2.35662 2.06792 -63.53195 701.01940
4930.0000 -66.72854 -64.25066 2.47788 1.99603 -64.19485 646.53906
4935.0000 -66.47676 -64.43550 2.04126 2.02823 -63.89799 652.46241
4940.0000 -66.07242 -64.21099 1.86143 1.92952 -64.80814 527.29980
4945.0000 -66.57763 -64.86821 1.70942 1.93202 -64.78513 545.59338
4950.0000 -65.48795 -63.89117 1.59679 1.97266 -64.41033 604.27737
4955.0000 -66.28209 -63.94990 2.33219 1.99301 -64.22274 634.13965
4960.0000 -66.42667 -64.53995 1.88672 1.96050 -64.52251 596.10413
4965.0000 -66.94262 -64.89826 2.04436 1.94674 -64.64933 574.29957
4970.0000 -67.13573 -64.52288 2.61285 1.91577 -64.93492 564.82738
4975.0000 -66.36637 -64.44084 1.92552 1.98828 -64.26634 612.44749
4980.0000 -65.50332 -63.58019 1.92312 2.02967 -63.88471 628.15220
4985.0000 -66.31864 -64.56677 1.75187 2.01571 -64.01338 631.45323
4990.0000 -66.68965 -64.82715 1.86250 1.93425 -64.76454 526.68806
4995.0000 -66.40705 -64.22782 2.17923 1.90970 -64.99089 503.42684
5000.0000 -66.19754 -63.61462 2.58293 2.01920 -63.98125 628.74854
FREEZING PROCESS: loop number 21 T-loop= 586.00000000000000
main_MD> interactions number 21 at Temperature= 586.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.38954 -0.47682 0.36577
force_rgl> df(natom) -0.61812 0.77574 -0.92186
5005.0000 -66.86703 -64.00136 2.86567 1.99106 -64.24071 579.94813
5010.0000 -65.76987 -63.94597 1.82390 2.01319 -64.03664 605.22353
5015.0000 -67.19550 -64.64558 2.54993 1.96153 -64.51299 543.64701
5020.0000 -67.24013 -64.72173 2.51839 1.94592 -64.65694 557.77035
5025.0000 -66.89600 -65.11094 1.78505 1.95325 -64.58935 564.76146
5030.0000 -65.93311 -64.15196 1.78114 1.95876 -64.53856 554.31232
5035.0000 -66.37599 -64.66254 1.71345 1.97712 -64.36926 557.21730
5040.0000 -66.18292 -63.86639 2.31653 2.00062 -64.15255 554.55826
5045.0000 -65.50511 -63.53140 1.97372 2.04693 -63.72553 617.57869
5050.0000 -66.48072 -63.45476 3.02596 2.04636 -63.73076 671.69481
5055.0000 -65.99070 -63.68444 2.30627 2.07028 -63.51023 665.50260
5060.0000 -66.57198 -64.45319 2.11879 2.00866 -64.07843 653.62544
5065.0000 -66.17938 -64.22034 1.95904 1.98020 -64.34087 634.11217
5070.0000 -67.01713 -64.89489 2.12224 1.95911 -64.53527 583.85299
5075.0000 -66.70350 -64.25248 2.45102 1.98967 -64.25348 619.77575
5080.0000 -66.18649 -64.05761 2.12888 1.99568 -64.19807 596.99971
5085.0000 -66.28046 -64.14474 2.13572 1.97962 -64.34619 602.94118
5090.0000 -66.37589 -64.08924 2.28665 2.01358 -64.03300 651.84011
5095.0000 -66.40854 -64.08331 2.32524 2.00311 -64.12962 640.11985
5100.0000 -66.76591 -64.44330 2.32261 2.00449 -64.11686 609.53296
5105.0000 -66.81514 -64.22817 2.58696 2.00548 -64.10775 606.05309
5110.0000 -67.66229 -65.74336 1.91893 1.90078 -65.07311 571.74919
5115.0000 -67.54924 -65.30638 2.24286 1.88753 -65.19534 531.28421
5120.0000 -67.34065 -65.23779 2.10286 1.85142 -65.52831 490.93236
5125.0000 -66.30406 -64.16141 2.14265 1.90737 -65.01238 545.66476
5130.0000 -66.44989 -64.12169 2.32820 2.00757 -64.08844 657.05472
5135.0000 -66.23353 -63.86409 2.36943 2.03946 -63.79440 661.83447
5140.0000 -66.60564 -64.51339 2.09225 1.99148 -64.23686 624.64120
5145.0000 -66.49628 -64.74430 1.75198 1.97064 -64.42901 601.41455
5150.0000 -67.56426 -65.75762 1.80665 1.88512 -65.21753 519.04714
5155.0000 -67.06972 -65.18496 1.88476 1.89557 -65.12123 552.53478
5160.0000 -66.69202 -64.92502 1.76700 1.89654 -65.11224 517.01347
5165.0000 -66.73575 -64.21209 2.52366 1.93786 -64.73129 593.50856
5170.0000 -66.37273 -64.49282 1.87991 1.94825 -64.63540 605.32286
5175.0000 -67.08296 -65.45957 1.62339 1.88990 -65.17343 529.44588
5180.0000 -66.52604 -64.44959 2.07645 1.92333 -64.86519 566.39122
5185.0000 -66.52508 -64.62374 1.90134 1.98252 -64.31946 623.05796
5190.0000 -66.77144 -64.43097 2.34048 1.91975 -64.89818 554.39481
5195.0000 -67.03274 -64.92149 2.11125 1.93264 -64.77935 574.26091
5200.0000 -67.20269 -65.51237 1.69031 1.91046 -64.98391 529.31207
5205.0000 -66.17100 -64.00076 2.17024 1.93899 -64.72079 574.01909
5210.0000 -65.92871 -63.54135 2.38736 2.04569 -63.73695 673.84585
5215.0000 -66.86139 -64.43197 2.42942 2.00618 -64.10130 623.72286
5220.0000 -66.84754 -65.05311 1.79443 1.92496 -64.85023 568.86155
5225.0000 -67.16331 -65.21270 1.95061 1.89612 -65.11612 508.75973
5230.0000 -67.11166 -65.17878 1.93288 1.89385 -65.13702 490.80416
5235.0000 -66.85489 -64.39930 2.45559 1.92325 -64.86599 530.90504
5240.0000 -66.86517 -64.37877 2.48640 1.98277 -64.31710 625.59261
5245.0000 -66.39669 -64.43431 1.96239 1.97885 -64.35327 625.58925
5250.0000 -66.38335 -64.36844 2.01490 1.95890 -64.53723 562.60457
FREEZING PROCESS: loop number 22 T-loop= 561.00000000000000
main_MD> interactions number 22 at Temperature= 561.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.41138 0.21264 -1.77330
force_rgl> df(natom) 1.12093 0.57668 -3.49076
5255.0000 -66.12922 -63.93301 2.19621 1.99411 -64.21254 641.33242
5260.0000 -66.99014 -64.81588 2.17426 1.98060 -64.33718 610.09072
5265.0000 -66.49297 -64.88429 1.60868 1.94685 -64.64834 579.33983
5270.0000 -66.81124 -64.71953 2.09171 1.89045 -65.16842 498.01379
5275.0000 -66.43229 -64.26754 2.16474 1.96586 -64.47306 581.73257
5280.0000 -66.49748 -64.77020 1.72728 1.95022 -64.61725 535.94072
5285.0000 -66.48383 -63.75899 2.72485 2.00401 -64.12131 572.06151
5290.0000 -66.52430 -64.28515 2.23915 2.00230 -64.13708 652.94367
5295.0000 -66.83286 -64.71653 2.11632 1.93803 -64.72969 549.36972
5300.0000 -67.07369 -65.23533 1.83837 1.89560 -65.12092 534.19809
5305.0000 -66.72967 -64.61883 2.11084 1.94675 -64.64927 581.57043
5310.0000 -66.70381 -65.28562 1.41819 1.89844 -65.09471 513.96642
5315.0000 -66.91080 -64.23885 2.67195 1.91650 -64.92818 553.76366
5320.0000 -67.06914 -64.69670 2.37245 1.94752 -64.64220 574.61569
5325.0000 -66.08109 -64.14678 1.93431 1.97600 -64.37953 578.35992
5330.0000 -66.57074 -64.56072 2.01002 1.99198 -64.23218 588.31656
5335.0000 -66.47904 -64.11608 2.36295 1.97638 -64.37608 621.87071
5340.0000 -66.79263 -64.78525 2.00738 1.95565 -64.56722 575.63789
5345.0000 -66.97864 -65.17994 1.79871 1.90772 -65.00917 549.25192
5350.0000 -67.31230 -64.91230 2.40000 1.92925 -64.81061 567.17634
5355.0000 -66.25494 -64.43837 1.81657 1.95507 -64.57255 609.55744
5360.0000 -67.35659 -65.57012 1.78647 1.90494 -65.03481 548.92182
5365.0000 -66.87202 -64.25613 2.61588 1.92777 -64.82432 574.61776
5370.0000 -66.62143 -64.55563 2.06581 1.97984 -64.34416 614.99192
5375.0000 -66.94791 -64.87102 2.07689 1.90618 -65.02339 541.82705
5380.0000 -67.07978 -65.34628 1.73349 1.90351 -65.04798 540.44911
5385.0000 -67.30318 -65.50036 1.80282 1.87008 -65.35625 501.08089
5390.0000 -66.98163 -65.05123 1.93040 1.84564 -65.58162 481.18840
5395.0000 -66.30615 -64.46500 1.84114 1.96435 -64.48693 610.31907
5400.0000 -66.77390 -64.69984 2.07406 2.00284 -64.13206 638.40538
5405.0000 -67.14009 -65.15621 1.98388 1.93250 -64.78066 554.98253
5410.0000 -66.78670 -65.22803 1.55867 1.86606 -65.39329 503.35301
5415.0000 -66.29991 -64.19578 2.10413 1.94458 -64.66927 568.95093
5420.0000 -66.61514 -64.36792 2.24722 1.93985 -64.71286 585.82571
5425.0000 -66.81698 -64.74189 2.07509 1.95473 -64.57572 596.75467
5430.0000 -66.45063 -64.36104 2.08959 1.95327 -64.58915 602.68479
5435.0000 -66.13273 -64.44308 1.68965 1.94600 -64.65619 522.38361
5440.0000 -66.82954 -64.94924 1.88030 1.92967 -64.80680 546.74540
5445.0000 -67.12074 -65.19418 1.92656 1.90322 -65.05067 518.33594
5450.0000 -67.57771 -65.46057 2.11714 1.88265 -65.24031 504.20408
5455.0000 -66.88888 -64.80012 2.08875 1.86921 -65.36422 493.50935
5460.0000 -67.17587 -64.37128 2.80459 1.94445 -64.67043 579.38224
5465.0000 -67.45293 -65.12207 2.33086 1.94364 -64.67791 588.19485
5470.0000 -67.08870 -64.94772 2.14098 1.90423 -65.04136 548.31403
5475.0000 -67.25204 -64.89049 2.36155 1.85568 -65.48902 496.87698
5480.0000 -66.52796 -64.43068 2.09728 1.93153 -64.78960 556.79499
5485.0000 -66.97534 -65.03493 1.94041 1.96935 -64.44086 609.78438
5490.0000 -66.27542 -64.33470 1.94072 1.92739 -64.82780 518.25178
5495.0000 -66.24984 -64.57124 1.67860 1.97061 -64.42921 593.48488
5500.0000 -67.73675 -65.98593 1.75082 1.89497 -65.12672 531.11848
FREEZING PROCESS: loop number 23 T-loop= 536.00000000000000
main_MD> interactions number 23 at Temperature= 536.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.62086 2.06740 0.03389
force_rgl> df(natom) 2.27514 0.05056 0.08210
5505.0000 -66.94106 -65.25862 1.68244 1.84760 -65.56348 469.69717
5510.0000 -66.82172 -64.92422 1.89749 1.91085 -64.98030 528.68221
5515.0000 -66.67460 -64.95559 1.71901 1.90813 -65.00541 497.62430
5520.0000 -66.92540 -64.89471 2.03070 1.89966 -65.08347 532.23755
5525.0000 -66.84412 -64.95231 1.89181 1.90506 -65.03371 566.08550
5530.0000 -67.03370 -65.16147 1.87222 1.90277 -65.05482 552.60461
5535.0000 -66.95628 -65.14030 1.81598 1.89797 -65.09909 530.88983
5540.0000 -67.55533 -65.25686 2.29847 1.87464 -65.31419 499.57571
5545.0000 -66.76112 -64.75493 2.00619 1.91384 -64.95275 555.08459
5550.0000 -67.19374 -65.51809 1.67565 1.90967 -64.99120 538.66817
5555.0000 -66.74135 -65.11740 1.62395 1.84624 -65.57603 457.80378
5560.0000 -66.67274 -64.60711 2.06563 1.87413 -65.31890 504.89710
5565.0000 -66.37146 -64.36100 2.01045 1.96795 -64.45374 573.64782
5570.0000 -66.57412 -64.47864 2.09548 1.98304 -64.31466 625.04709
5575.0000 -67.01249 -64.46847 2.54402 1.96734 -64.45939 599.70818
5580.0000 -67.37361 -65.43832 1.93530 1.91777 -64.91646 549.84312
5585.0000 -67.07349 -65.08755 1.98594 1.86350 -65.41693 502.84574
5590.0000 -67.16866 -65.43942 1.72924 1.87291 -65.33015 495.89186
5595.0000 -66.99799 -64.86322 2.13478 1.91464 -64.94533 570.38988
5600.0000 -66.67229 -64.67527 1.99702 1.90917 -64.99580 550.38533
5605.0000 -66.88322 -65.10965 1.77357 1.93248 -64.78085 550.97860
5610.0000 -67.44230 -65.18527 2.25703 1.88447 -65.22355 522.55985
5615.0000 -66.62667 -64.98551 1.64116 1.91119 -64.97720 554.64475
5620.0000 -67.77910 -65.78965 1.98944 1.88428 -65.22528 527.46218
5625.0000 -66.66129 -64.57034 2.09095 1.88994 -65.17314 559.67670
5630.0000 -66.89974 -64.84360 2.05613 1.95090 -64.61103 589.53375
5635.0000 -66.05422 -64.07903 1.97519 1.93329 -64.77341 584.37027
5640.0000 -66.29893 -64.14580 2.15314 2.01488 -64.02101 666.09324
5645.0000 -67.34221 -65.16429 2.17792 1.95597 -64.56429 587.10999
5650.0000 -67.38497 -65.67171 1.71325 1.86180 -65.43254 476.95149
5655.0000 -67.05004 -64.84489 2.20515 1.88924 -65.17958 506.11490
5660.0000 -67.18223 -65.43607 1.74616 1.92328 -64.86569 552.07509
5665.0000 -66.73058 -64.47143 2.25915 1.91953 -64.90025 526.33818
5670.0000 -66.83620 -65.18429 1.65191 1.94486 -64.66668 576.46172
5675.0000 -67.01797 -65.35493 1.66303 1.89804 -65.09841 541.56911
5680.0000 -67.18691 -65.27522 1.91169 1.86036 -65.44587 491.36245
5685.0000 -67.28373 -64.91774 2.36599 1.88266 -65.24028 526.24733
5690.0000 -66.84687 -64.55928 2.28759 1.95460 -64.57685 564.34241
5695.0000 -66.39787 -64.47208 1.92579 1.95740 -64.55110 533.34834
5700.0000 -66.95388 -64.78528 2.16859 1.96778 -64.45537 586.02517
5705.0000 -67.13916 -65.21432 1.92483 1.94716 -64.64552 604.95385
5710.0000 -67.66419 -65.58116 2.08303 1.86418 -65.41062 498.32496
5715.0000 -67.41981 -65.58515 1.83466 1.87017 -65.35536 516.28070
5720.0000 -66.88726 -64.96082 1.92645 1.87135 -65.34450 496.02477
5725.0000 -66.14643 -63.32670 2.81973 2.00422 -64.11933 620.71282
5730.0000 -66.61116 -64.71975 1.89140 2.01458 -64.02381 645.34759
5735.0000 -66.71762 -65.12169 1.59593 1.95389 -64.58346 597.31243
5740.0000 -67.24240 -65.29771 1.94469 1.91548 -64.93759 569.99594
5745.0000 -67.08349 -65.60797 1.47553 1.87822 -65.28113 515.71969
5750.0000 -67.33204 -65.52950 1.80254 1.86866 -65.36930 482.68848
FREEZING PROCESS: loop number 24 T-loop= 511.00000000000000
main_MD> interactions number 24 at Temperature= 511.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.00026 1.49994 -1.02964
force_rgl> df(natom) -0.14104 0.70667 1.24591
5755.0000 -67.04783 -65.73806 1.30977 1.82580 -65.76450 451.87214
5760.0000 -66.61641 -65.25747 1.35894 1.84217 -65.61356 484.67885
5765.0000 -67.51126 -65.65364 1.85762 1.84909 -65.54974 488.86922
5770.0000 -67.44866 -65.81872 1.62994 1.80861 -65.92302 457.94132
5775.0000 -66.77634 -64.91463 1.86172 1.86613 -65.39261 515.98869
5780.0000 -66.79775 -65.11809 1.67966 1.89165 -65.15731 526.18419
5785.0000 -67.31041 -65.29571 2.01469 1.86209 -65.42994 490.11150
5790.0000 -67.45728 -64.97318 2.48410 1.87667 -65.29544 516.60000
5795.0000 -67.04073 -65.21529 1.82544 1.89040 -65.16891 510.23528
5800.0000 -67.50574 -65.54789 1.95785 1.87563 -65.30505 485.65837
5805.0000 -67.14726 -65.53602 1.61124 1.82541 -65.76813 450.24419
5810.0000 -67.43496 -65.96497 1.46999 1.80306 -65.97420 439.70629
5815.0000 -67.11423 -65.18285 1.93138 1.85097 -65.53243 486.86833
5820.0000 -67.47795 -65.71461 1.76334 1.86505 -65.40266 504.48539
5825.0000 -66.96631 -65.40602 1.56028 1.85883 -65.45997 491.97747
5830.0000 -67.25426 -65.62305 1.63121 1.83214 -65.70610 464.09576
5835.0000 -66.71365 -65.29927 1.41438 1.85370 -65.50722 477.73490
5840.0000 -67.36995 -65.88049 1.48946 1.83199 -65.70744 453.83425
5845.0000 -67.70263 -65.53598 2.16666 1.82341 -65.78657 459.79958
5850.0000 -66.90447 -65.09334 1.81113 1.87090 -65.34864 481.67221
5855.0000 -66.61168 -64.70714 1.90454 1.90888 -64.99845 512.43007
5860.0000 -66.53304 -64.88713 1.64591 1.95330 -64.58885 570.84452
5865.0000 -66.56784 -64.14613 2.42172 1.94902 -64.62838 603.79514
5870.0000 -66.54926 -64.48634 2.06293 1.95238 -64.59737 598.79399
5875.0000 -67.11370 -64.47903 2.63467 1.92021 -64.89401 552.57647
5880.0000 -66.78227 -65.23269 1.54959 1.89682 -65.10967 548.72210
5885.0000 -67.51115 -65.78545 1.72570 1.85144 -65.52814 483.67377
5890.0000 -66.76569 -65.43345 1.33225 1.84968 -65.54435 471.85917
5895.0000 -67.64734 -65.82831 1.81903 1.85446 -65.50024 478.16827
5900.0000 -66.92132 -65.60543 1.31590 1.81926 -65.82485 449.95866
5905.0000 -67.07760 -65.78895 1.28865 1.85730 -65.47404 511.88875
5910.0000 -67.44925 -65.18326 2.26599 1.85270 -65.51648 511.06680
5915.0000 -67.17503 -65.44910 1.72593 1.86612 -65.39270 496.13768
5920.0000 -67.03574 -65.44106 1.59469 1.85250 -65.51834 466.73500
5925.0000 -66.50811 -64.46890 2.03921 1.88968 -65.17554 516.48936
5930.0000 -67.05385 -64.53024 2.52362 1.97026 -64.43246 574.54608
5935.0000 -67.31873 -65.34201 1.97672 1.92574 -64.84298 565.62656
5940.0000 -67.21594 -65.08699 2.12895 1.92095 -64.88719 566.00686
5945.0000 -67.26474 -65.80160 1.46314 1.83465 -65.68290 487.06539
5950.0000 -67.09263 -65.44807 1.64456 1.85890 -65.45932 475.32755
5955.0000 -66.82112 -65.22815 1.59297 1.87354 -65.32430 476.59157
5960.0000 -67.07297 -64.96729 2.10568 1.91053 -64.98322 525.62292
5965.0000 -67.28981 -65.74338 1.54642 1.84947 -65.54625 486.36017
5970.0000 -67.87115 -66.47767 1.39348 1.80159 -65.98774 446.65531
5975.0000 -67.93418 -66.12493 1.80926 1.76193 -66.35348 401.23360
5980.0000 -67.75296 -66.18949 1.56347 1.75006 -66.46288 381.72258
5985.0000 -67.82110 -66.12559 1.69550 1.76870 -66.29103 396.12885
5990.0000 -67.15125 -64.85766 2.29359 1.86765 -65.37868 491.09901
5995.0000 -67.26872 -65.26326 2.00546 1.91340 -64.95681 550.58390
6000.0000 -67.38891 -65.39293 1.99598 1.86999 -65.35707 505.52544
FREEZING PROCESS: loop number 25 T-loop= 486.00000000000000
main_MD> interactions number 25 at Temperature= 486.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.74162 -0.11507 1.54598
force_rgl> df(natom) -1.44825 2.71658 -2.10884
6005.0000 -67.19226 -65.95136 1.24090 1.84836 -65.55655 474.64492
6010.0000 -67.23282 -65.49574 1.73709 1.82999 -65.72594 436.69420
6015.0000 -67.45912 -65.94767 1.51145 1.81254 -65.88681 446.69208
6020.0000 -66.94096 -65.37916 1.56180 1.82999 -65.72586 455.78188
6025.0000 -67.49788 -65.54610 1.95179 1.84663 -65.57247 453.02160
6030.0000 -67.63460 -66.10749 1.52712 1.81495 -65.86456 435.39329
6035.0000 -67.21581 -65.62371 1.59210 1.83424 -65.68670 451.40562
6040.0000 -67.25212 -65.59152 1.66061 1.88356 -65.23189 509.20686
6045.0000 -67.30915 -65.60435 1.70481 1.83986 -65.63492 461.26409
6050.0000 -66.83191 -65.18078 1.65114 1.85376 -65.50668 484.92137
6055.0000 -67.28642 -64.86712 2.41930 1.91149 -64.97444 548.35669
6060.0000 -66.84003 -65.12049 1.71955 1.89623 -65.11506 526.77061
6065.0000 -66.99308 -64.94081 2.05227 1.87352 -65.32448 494.20122
6070.0000 -66.98597 -65.25302 1.73295 1.89788 -65.09988 552.54365
6075.0000 -67.80959 -66.32153 1.48806 1.84146 -65.62014 500.73053
6080.0000 -67.44825 -65.79889 1.64936 1.81382 -65.87500 465.51896
6085.0000 -67.03116 -65.49746 1.53370 1.88233 -65.24326 509.67272
6090.0000 -66.73334 -65.13079 1.60255 1.85224 -65.52073 479.37716
6095.0000 -67.49825 -65.60387 1.89438 1.88287 -65.23831 485.37731
6100.0000 -67.41401 -65.79937 1.61464 1.82532 -65.76895 445.77250
6105.0000 -67.06421 -64.90451 2.15970 1.88479 -65.22061 513.97631
6110.0000 -67.67965 -65.86254 1.81711 1.84516 -65.58602 465.69895
6115.0000 -67.81162 -66.40711 1.40451 1.77882 -66.19771 405.75575
6120.0000 -67.77737 -66.40300 1.37436 1.76912 -66.28717 412.06596
6125.0000 -67.21069 -65.83369 1.37700 1.79497 -66.04878 405.17610
6130.0000 -67.53430 -65.87407 1.66022 1.84653 -65.57338 465.50105
6135.0000 -67.42138 -66.08041 1.34098 1.80602 -65.94691 429.01988
6140.0000 -67.38848 -65.93371 1.45477 1.77324 -66.24922 417.17538
6145.0000 -67.01454 -65.18642 1.82811 1.83593 -65.67108 484.70152
6150.0000 -67.14151 -65.13594 2.00557 1.92006 -64.89534 561.80861
6155.0000 -67.03420 -65.09876 1.93544 1.89327 -65.14241 546.66621
6160.0000 -66.91958 -64.91912 2.00046 1.88511 -65.21768 519.76093
6165.0000 -66.76309 -64.78373 1.97936 1.92509 -64.84900 533.19004
6170.0000 -67.86998 -66.15828 1.71171 1.81040 -65.90654 462.15238
6175.0000 -67.19883 -65.66531 1.53352 1.78655 -66.12644 417.45047
6180.0000 -67.14080 -65.83673 1.30407 1.84123 -65.62228 491.31685
6185.0000 -67.31588 -65.78327 1.53261 1.82933 -65.73195 463.67156
6190.0000 -67.54346 -65.71925 1.82421 1.84191 -65.61601 484.17603
6195.0000 -66.47077 -64.74229 1.72848 1.86308 -65.42076 480.64160
6200.0000 -67.18468 -65.54111 1.64357 1.90579 -65.02693 526.29380
6205.0000 -67.26368 -65.21944 2.04425 1.85830 -65.46486 496.07240
6210.0000 -67.08763 -65.09512 1.99251 1.88889 -65.18283 526.18892
6215.0000 -67.54028 -65.32589 2.21439 1.89340 -65.14115 530.27671
6220.0000 -67.41545 -64.96597 2.44949 1.89121 -65.16144 539.07226
6225.0000 -66.70692 -64.15086 2.55606 1.94948 -64.62406 608.25616
6230.0000 -66.97010 -65.28693 1.68317 1.89770 -65.10154 503.12179
6235.0000 -67.20050 -65.29497 1.90553 1.87910 -65.27309 515.97572
6240.0000 -67.53256 -65.73316 1.79940 1.85094 -65.53275 477.22513
6245.0000 -66.50532 -64.65993 1.84539 1.87486 -65.31218 500.04064
6250.0000 -67.23198 -65.84204 1.38994 1.89427 -65.13315 527.72010
FREEZING PROCESS: loop number 26 T-loop= 461.00000000000000
main_MD> interactions number 26 at Temperature= 461.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.52964 0.41083 -5.63792
force_rgl> df(natom) -1.89796 1.75354 -1.12192
6255.0000 -67.18343 -65.12770 2.05573 1.86203 -65.43045 501.20517
6260.0000 -67.39465 -65.63946 1.75519 1.86061 -65.44354 498.83927
6265.0000 -67.75849 -66.38486 1.37363 1.79344 -66.06290 426.12663
6270.0000 -67.76523 -65.82397 1.94126 1.80359 -65.96929 440.69948
6275.0000 -67.49180 -65.92864 1.56317 1.81964 -65.82135 444.08916
6280.0000 -67.47079 -65.78858 1.68221 1.80582 -65.94878 435.13336
6285.0000 -67.70058 -66.02608 1.67451 1.82049 -65.81349 451.67465
6290.0000 -67.53660 -66.01721 1.51939 1.80633 -65.94407 426.07980
6295.0000 -67.63884 -66.37256 1.26627 1.80777 -65.93076 444.79565
6300.0000 -66.75592 -65.27549 1.48043 1.83773 -65.65454 485.05068
6305.0000 -67.46955 -65.79310 1.67645 1.85765 -65.47088 499.10938
6310.0000 -67.25028 -65.56780 1.68248 1.85126 -65.52974 500.95022
6315.0000 -66.80378 -65.23913 1.56465 1.89386 -65.13692 530.28014
6320.0000 -67.61006 -65.76237 1.84768 1.85941 -65.45461 494.52917
6325.0000 -67.64764 -65.83323 1.81441 1.81744 -65.84161 466.36820
6330.0000 -67.48182 -65.93178 1.55003 1.80768 -65.93163 429.96997
6335.0000 -67.16398 -65.62718 1.53680 1.81709 -65.84480 455.84794
6340.0000 -67.68768 -66.03598 1.65170 1.81882 -65.82885 469.46731
6345.0000 -67.32081 -65.86775 1.45306 1.80910 -65.91849 440.12766
6350.0000 -67.28284 -65.71380 1.56904 1.84202 -65.61495 466.14250
6355.0000 -67.55329 -65.72017 1.83312 1.82791 -65.74509 441.06979
6360.0000 -67.78957 -66.30250 1.48707 1.76853 -66.29263 391.10075
6365.0000 -67.64708 -65.68499 1.96209 1.78149 -66.17313 429.44352
6370.0000 -67.49935 -65.69094 1.80841 1.84404 -65.59637 491.79767
6375.0000 -67.53399 -65.71912 1.81487 1.84455 -65.59166 491.68560
6380.0000 -67.52061 -65.63891 1.88170 1.83693 -65.66193 492.66095
6385.0000 -67.66111 -65.87129 1.78982 1.80800 -65.92866 434.79174
6390.0000 -67.30982 -65.64485 1.66496 1.83558 -65.67432 477.08860
6395.0000 -66.95241 -64.73435 2.21806 1.89133 -65.16027 529.28401
6400.0000 -67.21120 -65.65797 1.55323 1.91404 -64.95090 556.57152
6405.0000 -67.08117 -65.85964 1.22153 1.85021 -65.53948 497.26029
6410.0000 -67.56158 -66.24906 1.31252 1.81239 -65.88814 445.12239
6415.0000 -67.68529 -66.04204 1.64325 1.77294 -66.25199 396.68078
6420.0000 -67.05537 -65.46297 1.59239 1.81636 -65.85154 442.57716
6425.0000 -67.28155 -65.98813 1.29342 1.84478 -65.58953 465.96670
6430.0000 -67.26907 -65.91977 1.34930 1.80315 -65.97336 416.66076
6435.0000 -67.74581 -66.03244 1.71337 1.82117 -65.80725 463.86685
6440.0000 -67.82241 -66.36924 1.45318 1.79997 -66.00268 447.22218
6445.0000 -67.79172 -66.44434 1.34738 1.77032 -66.27613 402.31782
6450.0000 -67.93648 -66.50035 1.43614 1.73563 -66.59595 368.53648
6455.0000 -67.16712 -65.65478 1.51234 1.81151 -65.89629 425.36395
6460.0000 -67.59094 -65.48629 2.10464 1.85705 -65.47640 491.75852
6465.0000 -67.26794 -65.83414 1.43380 1.85803 -65.46732 487.49929
6470.0000 -66.94418 -65.40880 1.53538 1.84255 -65.61004 473.19839
6475.0000 -67.67945 -65.33720 2.34226 1.87212 -65.33742 494.48250
6480.0000 -67.30905 -65.68458 1.62447 1.83713 -65.66006 455.89935
6485.0000 -67.52799 -66.05243 1.47556 1.82067 -65.81182 434.53770
6490.0000 -67.32216 -65.61760 1.70457 1.80104 -65.99285 424.79432
6495.0000 -67.22875 -65.67860 1.55015 1.85958 -65.45306 495.50680
6500.0000 -66.92227 -65.34071 1.58156 1.86571 -65.39652 493.21757
FREEZING PROCESS: loop number 27 T-loop= 436.00000000000000
main_MD> interactions number 27 at Temperature= 436.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.20352 0.69937 -0.02466
force_rgl> df(natom) 0.70500 -1.99230 1.85225
6505.0000 -67.22263 -65.24370 1.97893 1.86233 -65.42766 480.33621
6510.0000 -66.95169 -65.16652 1.78517 1.85787 -65.46879 498.36216
6515.0000 -67.72919 -66.20027 1.52892 1.85284 -65.51521 475.10329
6520.0000 -67.57128 -65.78588 1.78540 1.81449 -65.86879 425.17217
6525.0000 -66.96883 -65.38132 1.58752 1.82523 -65.76979 452.55572
6530.0000 -67.86334 -66.47532 1.38802 1.81258 -65.88639 440.41914
6535.0000 -67.73062 -66.18943 1.54119 1.76215 -66.35141 390.69834
6540.0000 -67.67829 -66.30763 1.37066 1.78634 -66.12842 422.14235
6545.0000 -67.39999 -65.09167 2.30832 1.85274 -65.51616 489.50329
6550.0000 -67.46136 -65.91817 1.54320 1.82294 -65.79087 455.86672
6555.0000 -67.71692 -66.29216 1.42476 1.79940 -66.00795 416.40916
6560.0000 -67.64459 -66.64720 0.99739 1.74561 -66.50399 355.49778
6565.0000 -67.66948 -66.44636 1.22313 1.74151 -66.54175 358.51810
6570.0000 -67.71504 -66.39247 1.32258 1.76591 -66.31675 387.39640
6575.0000 -67.65257 -66.20778 1.44479 1.76232 -66.34984 387.97917
6580.0000 -67.94503 -66.50508 1.43995 1.78470 -66.14349 402.71294
6585.0000 -67.77350 -66.24258 1.53092 1.73838 -66.57066 376.88684
6590.0000 -67.83243 -66.52760 1.30483 1.75423 -66.42447 399.33238
6595.0000 -67.92224 -66.63465 1.28759 1.72568 -66.68770 361.23895
6600.0000 -67.24937 -65.61291 1.63646 1.77478 -66.23502 391.88546
6605.0000 -66.89525 -65.48208 1.41317 1.83702 -65.66103 458.23992
6610.0000 -67.43308 -65.59298 1.84009 1.88408 -65.22718 505.08282
6615.0000 -67.26467 -66.05852 1.20616 1.82424 -65.77888 434.55466
6620.0000 -67.59003 -65.79305 1.79698 1.78424 -66.14771 401.72444
6625.0000 -67.41313 -65.81050 1.60263 1.82746 -65.74918 442.86122
6630.0000 -67.06882 -65.21072 1.85810 1.86390 -65.41319 455.25404
6635.0000 -67.74686 -66.15565 1.59121 1.85107 -65.53154 483.54732
6640.0000 -67.57942 -65.83664 1.74277 1.80165 -65.98721 455.64760
6645.0000 -67.24035 -65.76757 1.47278 1.82041 -65.81424 461.32764
6650.0000 -67.77844 -66.10067 1.67777 1.79393 -66.05841 428.79334
6655.0000 -67.43414 -66.05613 1.37801 1.82051 -65.81327 450.59042
6660.0000 -67.20051 -65.76385 1.43666 1.79970 -66.00516 418.93470
6665.0000 -67.52111 -66.11983 1.40128 1.79907 -66.01103 399.37654
6670.0000 -67.31394 -65.57744 1.73651 1.80230 -65.98121 440.05516
6675.0000 -67.81807 -66.34416 1.47391 1.83254 -65.70241 468.19014
6680.0000 -66.87210 -65.15559 1.71651 1.82663 -65.75690 456.26578
6685.0000 -66.76410 -65.22310 1.54101 1.87020 -65.35517 462.23720
6690.0000 -67.61845 -66.07792 1.54054 1.82654 -65.75773 466.39452
6695.0000 -67.82807 -65.76610 2.06198 1.80691 -65.93876 459.50024
6700.0000 -67.79929 -66.43634 1.36295 1.75613 -66.40699 388.09592
6705.0000 -67.43419 -66.18517 1.24902 1.76539 -66.32157 396.42855
6710.0000 -67.66870 -66.25139 1.41732 1.76473 -66.32767 405.57266
6715.0000 -67.85624 -66.46140 1.39484 1.80434 -65.96244 437.40507
6720.0000 -67.49540 -66.29827 1.19713 1.76599 -66.31606 398.20270
6725.0000 -66.72545 -65.20489 1.52056 1.81146 -65.89677 444.30269
6730.0000 -67.50548 -65.98761 1.51788 1.84883 -65.55219 475.26267
6735.0000 -67.64562 -66.06703 1.57859 1.80403 -65.96523 437.99697
6740.0000 -67.63340 -66.57390 1.05950 1.78405 -66.14954 420.96015
6745.0000 -67.64319 -65.86550 1.77768 1.77329 -66.24870 407.91645
6750.0000 -67.91409 -66.84713 1.06696 1.72823 -66.66419 365.65156
FREEZING PROCESS: loop number 28 T-loop= 411.00000000000000
main_MD> interactions number 28 at Temperature= 411.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.77922 -0.02358 -0.28138
force_rgl> df(natom) 0.82984 -0.73053 -0.69333
6755.0000 -67.77476 -66.47384 1.30092 1.73891 -66.56574 375.58334
6760.0000 -67.74985 -65.99321 1.75664 1.75225 -66.44270 384.55736
6765.0000 -67.63878 -65.94074 1.69803 1.77782 -66.20692 396.72326
6770.0000 -67.69345 -66.20953 1.48392 1.78978 -66.09668 432.65020
6775.0000 -67.74940 -66.01274 1.73666 1.78846 -66.10881 420.03934
6780.0000 -67.15078 -65.81411 1.33667 1.82108 -65.80804 452.27764
6785.0000 -67.69609 -66.20616 1.48993 1.82496 -65.77229 451.63534
6790.0000 -67.59471 -66.03671 1.55801 1.77499 -66.23300 392.23006
6795.0000 -67.67600 -66.05656 1.61944 1.77941 -66.19225 415.68747
6800.0000 -67.61005 -65.78228 1.82777 1.82427 -65.77859 467.57229
6805.0000 -67.74615 -66.21730 1.52885 1.78318 -66.15755 399.32573
6810.0000 -67.61646 -66.23305 1.38341 1.78881 -66.10559 413.11216
6815.0000 -67.70650 -66.55137 1.15513 1.79513 -66.04731 417.35429
6820.0000 -67.57612 -66.35555 1.22058 1.73518 -66.60016 357.01763
6825.0000 -67.85978 -66.72908 1.13070 1.72011 -66.73909 345.92892
6830.0000 -67.36923 -66.07043 1.29880 1.74830 -66.47913 367.94671
6835.0000 -68.08604 -66.13397 1.95207 1.77651 -66.21901 406.38456
6840.0000 -67.73399 -66.19010 1.54390 1.77534 -66.22985 410.58156
6845.0000 -67.86528 -66.39740 1.46788 1.77877 -66.19823 418.28724
6850.0000 -67.52595 -65.95967 1.56628 1.77721 -66.21255 413.17673
6855.0000 -67.76384 -66.14348 1.62037 1.76150 -66.35739 390.85768
6860.0000 -67.53130 -65.85464 1.67666 1.78272 -66.16176 420.23631
6865.0000 -67.46298 -66.03454 1.42844 1.80085 -65.99463 454.23952
6870.0000 -68.15452 -66.68018 1.47435 1.78056 -66.18166 412.10485
6875.0000 -67.55797 -65.90866 1.64931 1.77890 -66.19701 405.05486
6880.0000 -67.58152 -66.03226 1.54926 1.81522 -65.86211 461.36741
6885.0000 -67.81371 -66.40093 1.41278 1.78273 -66.16169 443.37428
6890.0000 -67.56788 -65.84331 1.72457 1.76857 -66.29227 414.54943
6895.0000 -68.01466 -66.43540 1.57926 1.77395 -66.24259 422.12672
6900.0000 -67.56004 -66.36420 1.19584 1.76400 -66.33439 396.38048
6905.0000 -67.92532 -66.63048 1.29484 1.75580 -66.40998 383.62016
6910.0000 -67.79653 -66.40376 1.39277 1.75246 -66.44081 370.75464
6915.0000 -67.86240 -66.62102 1.24138 1.73876 -66.56708 361.35122
6920.0000 -67.39539 -66.14232 1.25307 1.75629 -66.40545 380.97897
6925.0000 -68.01280 -66.35498 1.65782 1.75558 -66.41205 382.81263
6930.0000 -67.95113 -66.09978 1.85136 1.76131 -66.35915 378.01485
6935.0000 -67.57682 -66.30539 1.27142 1.78696 -66.12266 395.73251
6940.0000 -67.85568 -66.39923 1.45645 1.74496 -66.50995 378.45224
6945.0000 -67.44648 -66.19855 1.24793 1.75991 -66.37212 391.37831
6950.0000 -67.50262 -66.24837 1.25425 1.78703 -66.12205 421.07269
6955.0000 -67.92158 -66.40103 1.52055 1.75998 -66.37141 398.78376
6960.0000 -67.38814 -65.88099 1.50715 1.77004 -66.27871 411.14834
6965.0000 -67.98338 -66.60008 1.38331 1.77836 -66.20196 411.04294
6970.0000 -67.80080 -66.14169 1.65911 1.74742 -66.48729 372.38588
6975.0000 -68.07967 -66.49610 1.58357 1.78840 -66.10941 427.24583
6980.0000 -67.89193 -66.23409 1.65784 1.76154 -66.35707 390.00070
6985.0000 -67.54088 -65.89465 1.64623 1.78910 -66.10292 403.92840
6990.0000 -67.50860 -65.84686 1.66174 1.82668 -65.75644 447.51213
6995.0000 -67.76747 -66.41653 1.35094 1.78494 -66.14126 403.41190
7000.0000 -67.61194 -66.12518 1.48676 1.79766 -66.02403 445.36712
FREEZING PROCESS: loop number 29 T-loop= 386.00000000000000
main_MD> interactions number 29 at Temperature= 386.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.63295 -0.27948 0.10600
force_rgl> df(natom) -2.71956 0.66606 0.22707
7005.0000 -67.60993 -66.16845 1.44148 1.77197 -66.26090 403.63834
7010.0000 -67.26837 -65.68681 1.58156 1.79587 -66.04052 407.31291
7015.0000 -67.62348 -66.12554 1.49794 1.80755 -65.93284 416.79527
7020.0000 -67.65744 -66.17072 1.48672 1.77365 -66.24540 399.27523
7025.0000 -67.92964 -66.70664 1.22299 1.74973 -66.46599 397.27877
7030.0000 -67.53042 -66.18649 1.34392 1.74997 -66.46374 397.66596
7035.0000 -67.65707 -66.19764 1.45943 1.77620 -66.22189 406.37927
7040.0000 -68.17551 -66.53739 1.63812 1.75942 -66.37657 401.63691
7045.0000 -67.90762 -66.76052 1.14710 1.71461 -66.78984 353.96923
7050.0000 -67.66736 -66.30105 1.36631 1.73302 -66.62002 362.77567
7055.0000 -67.68210 -66.31346 1.36864 1.77136 -66.26650 390.66570
7060.0000 -67.83441 -66.36054 1.47387 1.78312 -66.15805 432.11149
7065.0000 -67.93690 -66.42894 1.50796 1.75547 -66.41302 395.58165
7070.0000 -67.90416 -65.83259 2.07156 1.79757 -66.02480 458.47036
7075.0000 -68.14455 -66.66864 1.47591 1.75704 -66.39852 408.46867
7080.0000 -67.97607 -66.36224 1.61383 1.75319 -66.43405 408.62690
7085.0000 -67.75299 -66.72666 1.02634 1.73523 -66.59966 376.64648
7090.0000 -68.07514 -66.91875 1.15639 1.71921 -66.74734 347.17219
7095.0000 -67.90815 -66.45626 1.45189 1.69450 -66.97522 304.99951
7100.0000 -67.97931 -66.54809 1.43122 1.77346 -66.24716 410.21414
7105.0000 -67.56283 -66.14967 1.41316 1.75470 -66.42011 389.19207
7110.0000 -67.56857 -66.17145 1.39711 1.74716 -66.48969 374.20653
7115.0000 -67.69135 -66.00262 1.68873 1.81203 -65.89149 424.47010
7120.0000 -67.46902 -66.10348 1.36554 1.76685 -66.30810 377.50012
7125.0000 -67.82150 -65.91930 1.90219 1.81559 -65.85863 438.25131
7130.0000 -67.27176 -66.10025 1.17152 1.80893 -65.92005 429.63359
7135.0000 -67.35349 -65.96793 1.38556 1.78516 -66.13923 399.59310
7140.0000 -67.55926 -66.17223 1.38703 1.80908 -65.91873 427.82108
7145.0000 -67.73315 -66.26916 1.46399 1.76635 -66.31269 381.11308
7150.0000 -67.64405 -66.30496 1.33909 1.77744 -66.21046 405.58853
7155.0000 -67.91185 -66.14799 1.76387 1.81703 -65.84541 444.58801
7160.0000 -68.08617 -66.55097 1.53520 1.76438 -66.33085 397.53084
7165.0000 -67.77414 -66.65014 1.12401 1.73613 -66.59133 360.24587
7170.0000 -67.47016 -65.81811 1.65205 1.76233 -66.34983 391.71670
7175.0000 -67.69149 -65.96711 1.72438 1.83679 -65.66322 481.15165
7180.0000 -67.67894 -66.38832 1.29061 1.78527 -66.13825 405.88565
7185.0000 -67.82064 -66.38591 1.43473 1.75830 -66.38691 365.91475
7190.0000 -68.12087 -66.54611 1.57476 1.73953 -66.56003 358.15023
7195.0000 -67.86458 -66.64023 1.22435 1.75287 -66.43699 384.20596
7200.0000 -67.58150 -66.50280 1.07870 1.72455 -66.69810 346.16727
7205.0000 -67.78062 -66.36249 1.41813 1.75501 -66.41724 375.79118
7210.0000 -68.02327 -66.34655 1.67672 1.74245 -66.53311 365.24680
7215.0000 -67.25227 -65.84867 1.40360 1.79466 -66.05166 422.45500
7220.0000 -67.81760 -66.32241 1.49519 1.79465 -66.05181 405.71323
7225.0000 -66.53763 -65.26649 1.27114 1.80015 -66.00101 422.99798
7230.0000 -67.21543 -65.26734 1.94809 1.87890 -65.27488 516.13788
7235.0000 -67.91400 -66.29836 1.61564 1.83359 -65.69268 476.60029
7240.0000 -67.45071 -65.23194 2.21877 1.82402 -65.78092 457.01224
7245.0000 -67.71207 -66.18782 1.52425 1.81936 -65.82390 448.01542
7250.0000 -67.51889 -65.99428 1.52462 1.76867 -66.29128 392.95013
FREEZING PROCESS: loop number 30 T-loop= 361.00000000000000
main_MD> interactions number 30 at Temperature= 361.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.13415 -0.66361 -1.50588
force_rgl> df(natom) -0.13978 0.50739 -0.04267
7255.0000 -67.66384 -66.05358 1.61026 1.79914 -66.01037 409.13196
7260.0000 -67.65971 -66.13461 1.52511 1.78682 -66.12401 413.26688
7265.0000 -67.87995 -66.53743 1.34252 1.75801 -66.38959 381.33828
7270.0000 -67.87806 -66.56933 1.30873 1.74762 -66.48546 366.46905
7275.0000 -68.10547 -66.61549 1.48998 1.72552 -66.68916 341.55986
7280.0000 -67.97504 -66.31689 1.65814 1.72366 -66.70636 352.90177
7285.0000 -67.86239 -66.65761 1.20478 1.74747 -66.48681 366.58787
7290.0000 -67.67243 -66.46597 1.20645 1.74589 -66.50133 372.08711
7295.0000 -67.74889 -66.74814 1.00075 1.73312 -66.61916 374.92732
7300.0000 -67.40730 -66.74045 0.66685 1.71544 -66.78214 339.38143
7305.0000 -67.70558 -66.50942 1.19616 1.75405 -66.42614 390.50324
7310.0000 -68.07497 -66.78134 1.29363 1.72298 -66.71261 357.57060
7315.0000 -68.21469 -66.99109 1.22360 1.70136 -66.91199 338.03700
7320.0000 -67.62753 -66.22601 1.40152 1.77852 -66.20046 413.75997
7325.0000 -67.90512 -66.66542 1.23970 1.76182 -66.35447 385.23219
7330.0000 -67.72781 -66.31801 1.40980 1.76461 -66.32871 391.29563
7335.0000 -67.49311 -65.93501 1.55810 1.77853 -66.20040 403.73274
7340.0000 -67.80155 -66.47436 1.32719 1.80277 -65.97691 410.86834
7345.0000 -67.95484 -66.54063 1.41421 1.72792 -66.66705 344.64515
7350.0000 -67.93074 -66.55999 1.37075 1.72073 -66.73334 332.72087
7355.0000 -67.43093 -66.09193 1.33899 1.75900 -66.38046 373.88248
7360.0000 -67.81502 -66.86454 0.95048 1.74797 -66.48218 365.79832
7365.0000 -67.93092 -66.71547 1.21545 1.71893 -66.74994 327.42637
7370.0000 -68.18104 -67.10318 1.07785 1.69628 -66.95886 294.80241
7375.0000 -67.70108 -66.41340 1.28768 1.72570 -66.68755 333.58493
7380.0000 -68.07208 -66.64271 1.42937 1.75970 -66.37399 389.68702
7385.0000 -67.95071 -66.63737 1.31334 1.72975 -66.65018 375.29327
7390.0000 -67.71750 -66.25256 1.46493 1.76951 -66.28359 389.63401
7395.0000 -67.25194 -65.79870 1.45325 1.75654 -66.40316 378.76764
7400.0000 -67.60916 -66.36490 1.24426 1.76950 -66.28365 395.67625
7405.0000 -67.98962 -66.34362 1.64600 1.76204 -66.35242 377.09305
7410.0000 -67.59255 -66.17501 1.41754 1.76599 -66.31601 385.73006
7415.0000 -67.68633 -66.22612 1.46021 1.77698 -66.21470 408.36344
7420.0000 -67.78874 -66.67700 1.11175 1.74498 -66.50974 362.21231
7425.0000 -67.82232 -66.47822 1.34410 1.70326 -66.89445 329.63208
7430.0000 -67.77496 -66.38145 1.39351 1.77213 -66.25944 414.99565
7435.0000 -68.29589 -67.26680 1.02909 1.73087 -66.63986 350.74765
7440.0000 -68.12277 -66.97557 1.14720 1.68110 -67.09876 283.68623
7445.0000 -68.20581 -67.20405 1.00176 1.68298 -67.08148 295.29761
7450.0000 -68.04606 -66.78756 1.25851 1.70230 -66.90327 314.57934
7455.0000 -68.26317 -66.88348 1.37969 1.70888 -66.84266 327.66701
7460.0000 -67.88875 -66.57267 1.31608 1.73437 -66.60761 378.99252
7465.0000 -67.99437 -66.85788 1.13649 1.71052 -66.82749 324.14690
7470.0000 -68.22627 -66.73524 1.49104 1.70529 -66.87574 357.88211
7475.0000 -68.29174 -67.24080 1.05094 1.69440 -66.97613 339.75178
7480.0000 -68.20911 -67.09291 1.11620 1.67205 -67.18226 300.26506
7485.0000 -68.09028 -66.93083 1.15945 1.69389 -66.98086 321.93749
7490.0000 -68.10926 -66.69992 1.40934 1.71455 -66.79032 348.71494
7495.0000 -68.17714 -66.83473 1.34241 1.71500 -66.78617 342.37653
7500.0000 -68.08051 -67.16731 0.91320 1.69936 -66.93039 332.73832
FREEZING PROCESS: loop number 31 T-loop= 336.00000000000000
main_MD> interactions number 31 at Temperature= 336.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.51226 -0.88733 -0.52543
force_rgl> df(natom) -0.93175 2.05141 1.90105
7505.0000 -68.17346 -66.92773 1.24573 1.66991 -67.20198 294.18254
7510.0000 -68.35962 -67.15041 1.20921 1.69402 -66.97967 328.47986
7515.0000 -68.24029 -67.12089 1.11940 1.66163 -67.27836 295.35282
7520.0000 -68.09107 -67.11883 0.97223 1.69312 -66.98792 327.06421
7525.0000 -68.17418 -66.77970 1.39448 1.71245 -66.80967 347.18147
7530.0000 -67.67990 -66.35980 1.32010 1.73217 -66.62786 359.51839
7535.0000 -67.91081 -66.72013 1.19068 1.73302 -66.62006 355.33025
7540.0000 -68.12018 -66.96466 1.15552 1.70064 -66.91859 324.84515
7545.0000 -67.91375 -67.00178 0.91197 1.71470 -66.78895 346.86039
7550.0000 -68.19784 -66.91961 1.27823 1.71739 -66.76416 344.56311
7555.0000 -68.01313 -67.03187 0.98126 1.70855 -66.84570 330.36025
7560.0000 -68.15370 -67.27592 0.87778 1.69026 -67.01434 319.11337
7565.0000 -68.25043 -66.99818 1.25225 1.67354 -67.16854 291.25976
7570.0000 -68.09314 -66.78252 1.31062 1.70385 -66.88906 329.65406
7575.0000 -68.22431 -67.00356 1.22075 1.69493 -66.97125 307.15925
7580.0000 -68.27803 -67.01005 1.26798 1.68607 -67.05300 303.09877
7585.0000 -68.29214 -66.71836 1.57378 1.69497 -66.97089 313.03902
7590.0000 -67.87581 -66.62906 1.24675 1.72613 -66.68356 352.08993
7595.0000 -67.89955 -66.65439 1.24516 1.69072 -67.01008 312.20141
7600.0000 -67.84210 -66.59938 1.24272 1.74700 -66.49112 368.50942
7605.0000 -68.14836 -66.70838 1.43998 1.71991 -66.74094 353.17703
7610.0000 -67.51846 -66.39498 1.12348 1.74306 -66.52746 376.93272
7615.0000 -67.87096 -66.41571 1.45525 1.74248 -66.53278 362.76857
7620.0000 -68.02952 -66.56279 1.46672 1.73063 -66.64206 359.29623
7625.0000 -67.91860 -66.72446 1.19413 1.72992 -66.64864 357.69489
7630.0000 -67.96173 -66.87041 1.09132 1.71777 -66.76070 338.62659
7635.0000 -67.90343 -66.62367 1.27976 1.72853 -66.66146 344.69753
7640.0000 -67.88309 -66.78436 1.09873 1.72901 -66.65701 339.39344
7645.0000 -67.51405 -66.29890 1.21515 1.72443 -66.69924 342.93818
7650.0000 -67.99446 -66.57258 1.42187 1.75763 -66.39313 371.00426
7655.0000 -67.81073 -66.28401 1.52672 1.75815 -66.38833 401.14842
7660.0000 -67.98707 -66.69994 1.28713 1.74477 -66.51169 365.22377
7665.0000 -67.95474 -66.64265 1.31209 1.69541 -66.96686 310.06978
7670.0000 -67.76394 -66.54822 1.21571 1.74330 -66.52528 357.62568
7675.0000 -67.96524 -66.70210 1.26314 1.72318 -66.71074 346.87729
7680.0000 -68.06592 -66.85528 1.21064 1.70589 -66.87018 318.99184
7685.0000 -67.90692 -66.68541 1.22151 1.71449 -66.79094 332.69406
7690.0000 -67.92529 -66.61312 1.31217 1.73561 -66.59619 350.85882
7695.0000 -67.96930 -66.66709 1.30222 1.73803 -66.57381 369.08172
7700.0000 -68.25095 -67.20811 1.04284 1.68658 -67.04823 311.79244
7705.0000 -68.26561 -67.01410 1.25151 1.69515 -66.96928 315.60586
7710.0000 -68.30817 -67.17084 1.13732 1.67851 -67.12271 300.65099
7715.0000 -68.12021 -66.87227 1.24794 1.68581 -67.05539 310.05795
7720.0000 -68.04349 -66.84679 1.19670 1.72147 -66.72651 340.32251
7725.0000 -67.89090 -66.82603 1.06487 1.71188 -66.81499 316.97199
7730.0000 -67.92702 -66.33997 1.58705 1.71968 -66.74304 334.89161
7735.0000 -68.31074 -66.91943 1.39131 1.73491 -66.60263 370.85506
7740.0000 -67.86917 -66.64826 1.22091 1.70832 -66.84776 323.88154
7745.0000 -67.93079 -66.95280 0.97799 1.70809 -66.84991 332.80801
7750.0000 -67.74113 -66.27188 1.46925 1.72607 -66.68417 348.90075
FREEZING PROCESS: loop number 32 T-loop= 311.00000000000000
main_MD> interactions number 32 at Temperature= 311.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.17139 -1.43392 -1.15914
force_rgl> df(natom) -1.63091 2.32005 -1.22451
7755.0000 -68.16981 -66.97737 1.19244 1.72547 -66.68970 352.70559
7760.0000 -68.09809 -67.19047 0.90762 1.68968 -67.01970 313.47086
7765.0000 -68.14704 -66.83509 1.31195 1.68537 -67.05943 313.37579
7770.0000 -68.36549 -66.99398 1.37151 1.71854 -66.75357 352.98318
7775.0000 -68.38684 -66.74095 1.64589 1.69314 -66.98776 333.85397
7780.0000 -68.16757 -67.04079 1.12679 1.68932 -67.02297 321.42215
7785.0000 -68.29581 -67.30913 0.98668 1.68460 -67.06652 308.25125
7790.0000 -68.33219 -66.93441 1.39777 1.65926 -67.30019 287.65501
7795.0000 -68.22108 -66.90386 1.31721 1.69520 -66.96876 356.26945
7800.0000 -67.95512 -66.64955 1.30557 1.69705 -66.95170 333.48081
7805.0000 -68.27698 -66.83911 1.43786 1.71160 -66.81751 349.45198
7810.0000 -68.44185 -67.26439 1.17746 1.66148 -67.27973 290.16768
7815.0000 -67.95858 -66.44703 1.51154 1.72408 -66.70247 361.27130
7820.0000 -68.02754 -66.79391 1.23363 1.73140 -66.63496 370.26633
7825.0000 -68.19638 -67.05037 1.14601 1.70946 -66.83733 352.19869
7830.0000 -68.19481 -67.14805 1.04675 1.68003 -67.10865 310.30006
7835.0000 -68.43187 -67.18285 1.24903 1.67069 -67.19477 301.72155
7840.0000 -68.43114 -67.20807 1.22307 1.67686 -67.13792 305.37950
7845.0000 -68.58767 -67.32990 1.25778 1.66537 -67.24380 294.90812
7850.0000 -68.40493 -67.27547 1.12946 1.66367 -67.25947 287.43835
7855.0000 -68.02290 -66.79682 1.22608 1.68382 -67.07374 313.04869
7860.0000 -68.17546 -67.14563 1.02983 1.70210 -66.90514 330.17331
7865.0000 -67.95927 -66.93618 1.02309 1.69126 -67.00507 322.43687
7870.0000 -68.35646 -67.21325 1.14321 1.69498 -66.97084 328.05537
7875.0000 -67.91514 -66.85429 1.06085 1.66802 -67.21940 285.51080
7880.0000 -68.35527 -67.11474 1.24053 1.70842 -66.84688 340.94946
7885.0000 -67.76458 -66.70005 1.06453 1.71601 -66.77694 351.36747
7890.0000 -67.99750 -66.95572 1.04178 1.69434 -66.97670 317.93637
7895.0000 -68.16536 -67.04526 1.12010 1.66349 -67.26118 277.37500
7900.0000 -68.10358 -67.25184 0.85174 1.67926 -67.11577 301.27474
7905.0000 -68.31224 -67.13765 1.17459 1.66599 -67.23815 283.35517
7910.0000 -68.30299 -67.17570 1.12729 1.68834 -67.03199 303.75385
7915.0000 -68.18381 -67.06262 1.12119 1.68334 -67.07813 303.21055
7920.0000 -68.38879 -67.55475 0.83405 1.65666 -67.32418 276.30376
7925.0000 -68.45131 -67.53796 0.91335 1.63471 -67.52653 252.75701
7930.0000 -68.37421 -67.25327 1.12095 1.65232 -67.36418 268.33459
7935.0000 -68.16744 -67.04389 1.12355 1.66404 -67.25610 281.39354
7940.0000 -68.39809 -67.31420 1.08389 1.67804 -67.12700 307.20070
7945.0000 -68.41545 -67.56729 0.84816 1.64448 -67.43650 259.39630
7950.0000 -68.23860 -66.90981 1.32879 1.67206 -67.18212 302.84436
7955.0000 -68.36070 -67.06836 1.29234 1.70776 -66.85293 337.79340
7960.0000 -68.45565 -66.99213 1.46351 1.71844 -66.75446 362.21853
7965.0000 -68.09504 -67.18104 0.91400 1.68650 -67.04902 318.52684
7970.0000 -68.40715 -67.28269 1.12446 1.67524 -67.15284 313.77915
7975.0000 -68.20388 -67.31133 0.89255 1.66577 -67.24016 295.59315
7980.0000 -68.28793 -67.35634 0.93159 1.65191 -67.36799 275.85664
7985.0000 -68.49639 -67.66665 0.82973 1.64554 -67.42670 273.22224
7990.0000 -68.64480 -67.89064 0.75416 1.62609 -67.60606 251.85588
7995.0000 -68.64561 -67.68577 0.95984 1.61179 -67.73790 230.68453
8000.0000 -68.42665 -67.40155 1.02510 1.65100 -67.37634 278.97316
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 4 [min], 18.1573667 [s].
main_MD> Deallocating global variables
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