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nanoparticlesims/growth_Melting_Silver_ICO_3269/freezeSims/run_51/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_51.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 = 51 ntipo2 = 0
read_input> Finish reading input
main_MD> Allocating global variables
main_MD> Number of outputs that will be created: 1800
main_MD> Size of nv and nvoiz: 51 5100
main_MD> Size of nv and nvoiz: 51 5100
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 = 51
main_MD> Consider changing parameter nsiz in module_parameters.f90 for performance
main_MD> collvar_wanted = F
main_MD> INPUT AND POTENTIAL FILE READING IS DONE
main_MD> THERMALIZATION IS STARTING
init> -5.1592772156972303E-003 -1.8086431602181052E-002 -4.2972518141967654E-002 initial drift of cluster / NP1 for coalescence
init> 0.29514942717749582 0.30436800518324736 0.29384333567155924 scaling for velocity /for coalescence NP1
init.f90 > facguy = 3.7285181987076221E-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) -0.65359 1.25362 -1.79336
force_rgl> df(natom) 1.77419 1.30994 1.38546
preparo> THERMALIZATION PROCESS AT 1205.7488660675485
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -110.97928958291563 8.1677929731923964 -119.14708255610802 6.1627734945715845E-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 36
FREEZING PROCESS: loop number 1 T-loop= 1181.0000000000000
main_MD> interactions number 1 at Temperature= 1181.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.68482 -0.48256 -2.35541
force_rgl> df(natom) -1.32729 0.19263 -1.02498
5.0000 -118.11491 -110.37572 7.73919 2.90402 -110.51261 1169.02213
10.0000 -118.48323 -109.16208 9.32115 2.97494 -109.53728 1234.23775
15.0000 -119.44393 -112.24217 7.20176 2.89381 -110.65304 1151.36384
20.0000 -116.69392 -108.71715 7.97677 2.91519 -110.35902 1190.07550
25.0000 -117.19847 -108.96396 8.23451 3.01757 -108.95097 1235.41319
30.0000 -117.93185 -109.99138 7.94047 2.95082 -109.86897 1154.19921
35.0000 -119.27757 -111.90088 7.37670 2.85226 -111.22437 1140.63999
40.0000 -119.44818 -109.91867 9.52951 2.87486 -110.91358 1175.88320
45.0000 -116.71761 -109.02974 7.68787 3.01887 -108.93313 1234.04141
50.0000 -118.46946 -110.43866 8.03080 2.98306 -109.42567 1227.29043
55.0000 -119.14413 -110.04849 9.09564 2.93181 -110.13040 1168.33198
60.0000 -119.48825 -111.60052 7.88773 2.89788 -110.59703 1195.05307
65.0000 -118.88268 -110.53157 8.35111 2.88230 -110.81137 1197.53646
70.0000 -118.84021 -111.37819 7.46203 2.87803 -110.87005 1200.25209
75.0000 -117.50362 -110.42689 7.07674 2.86490 -111.05062 1175.60994
80.0000 -117.72450 -108.33759 9.38691 2.93782 -110.04773 1240.59400
85.0000 -117.71773 -110.15964 7.55809 2.95250 -109.84585 1215.61095
90.0000 -118.89144 -110.45014 8.44130 2.92100 -110.27914 1207.08151
95.0000 -119.67419 -112.23974 7.43445 2.82493 -111.60026 1106.45488
100.0000 -118.84623 -112.34992 6.49631 2.79138 -112.06174 1118.80478
105.0000 -118.20599 -110.07852 8.12747 2.90775 -110.46130 1165.41296
110.0000 -118.56910 -111.68163 6.88747 2.87083 -110.96906 1176.85456
115.0000 -117.68001 -110.52410 7.15591 2.90416 -110.51075 1171.43222
120.0000 -118.87931 -111.37010 7.50921 2.92797 -110.18329 1167.09607
125.0000 -118.31856 -110.63677 7.68179 2.90884 -110.44625 1184.04212
130.0000 -118.66348 -111.81807 6.84541 2.88149 -110.82238 1172.55679
135.0000 -119.43446 -110.25612 9.17833 2.84658 -111.30250 1141.52063
140.0000 -119.18591 -111.72857 7.45734 2.86474 -111.05275 1141.94137
145.0000 -117.20330 -106.97952 10.22378 2.94859 -109.89963 1201.87694
150.0000 -115.45732 -108.02201 7.43532 3.11426 -107.62123 1374.72105
155.0000 -115.47871 -109.03006 6.44864 3.06462 -108.30402 1305.12672
160.0000 -118.90384 -110.93836 7.96548 2.86308 -111.07559 1199.93306
165.0000 -118.14453 -110.88855 7.25598 2.87422 -110.92248 1194.71352
170.0000 -116.13231 -108.10898 8.02333 2.96445 -109.68148 1223.06571
175.0000 -117.78060 -108.97779 8.80282 3.00901 -109.06874 1238.35130
180.0000 -118.01626 -111.12090 6.89536 2.89972 -110.57173 1175.04288
185.0000 -118.01014 -110.25462 7.75552 2.88037 -110.83784 1196.31179
190.0000 -118.66981 -109.52210 9.14770 2.96546 -109.66765 1248.67844
195.0000 -119.54111 -108.12849 11.41262 2.97115 -109.58946 1252.87941
200.0000 -116.99346 -109.92295 7.07051 2.96354 -109.69401 1196.60151
205.0000 -117.79994 -109.82685 7.97309 2.87278 -110.94230 1069.66566
210.0000 -118.16596 -108.76979 9.39618 3.00838 -109.07747 1233.25043
215.0000 -117.75111 -109.56045 8.19066 2.98123 -109.45085 1252.45123
220.0000 -119.28146 -112.44008 6.84137 2.88492 -110.77532 1197.43406
225.0000 -118.88244 -111.13951 7.74293 2.80299 -111.90207 1158.83950
230.0000 -118.96333 -111.78966 7.17367 2.82563 -111.59070 1133.28060
235.0000 -118.26852 -110.60716 7.66135 2.88124 -110.82583 1175.89733
240.0000 -117.91791 -110.17086 7.74705 2.91834 -110.31571 1204.79744
245.0000 -119.46462 -111.89523 7.56939 2.85654 -111.16562 1121.04296
250.0000 -117.92247 -109.67689 8.24558 2.93821 -110.04238 1199.22000
FREEZING PROCESS: loop number 2 T-loop= 1156.0000000000000
main_MD> interactions number 2 at Temperature= 1156.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.12701 -3.37105 -2.08846
force_rgl> df(natom) 4.01840 6.44978 -0.31573
255.0000 -119.06813 -111.19711 7.87101 2.88073 -110.83296 1168.37202
260.0000 -117.71135 -109.47136 8.24000 2.88331 -110.79743 1169.29742
265.0000 -118.04933 -111.15452 6.89480 2.91076 -110.41985 1171.08210
270.0000 -117.92405 -110.19754 7.72651 2.84254 -111.35810 1124.51298
275.0000 -119.51568 -111.16639 8.34929 2.89518 -110.63417 1196.98207
280.0000 -118.42036 -111.75460 6.66576 2.80139 -111.92403 1078.50255
285.0000 -119.33080 -111.92642 7.40438 2.86029 -111.11394 1141.18016
290.0000 -117.22522 -109.87396 7.35126 2.91330 -110.38501 1147.95080
295.0000 -118.36835 -109.58308 8.78527 3.01679 -108.96173 1273.94211
300.0000 -117.84836 -108.76983 9.07853 3.08992 -107.95608 1342.69188
305.0000 -118.23880 -111.22084 7.01796 2.95217 -109.85044 1195.04574
310.0000 -119.40169 -112.76351 6.63818 2.78423 -112.16002 1118.49714
315.0000 -118.79309 -112.15848 6.63461 2.80092 -111.93054 1124.43546
320.0000 -119.32498 -110.79236 8.53262 2.83387 -111.47729 1091.00980
325.0000 -118.82524 -111.43713 7.38810 2.80874 -111.82301 1128.94427
330.0000 -118.95319 -112.69710 6.25609 2.83685 -111.43639 1142.42086
335.0000 -119.95370 -111.64533 8.30837 2.88087 -110.83093 1168.70863
340.0000 -121.78869 -113.41089 8.37780 2.73165 -112.88310 1054.26712
345.0000 -118.34828 -111.59019 6.75809 2.77935 -112.22714 1134.57009
350.0000 -117.74430 -109.98283 7.76147 2.88951 -110.71215 1142.26347
355.0000 -118.53372 -110.54327 7.99046 2.87738 -110.87894 1159.71247
360.0000 -119.08006 -111.60303 7.47703 2.84307 -111.35079 1148.22218
365.0000 -116.26501 -108.55377 7.71124 2.90634 -110.48067 1183.80547
370.0000 -118.28515 -110.36750 7.91766 2.95452 -109.81810 1245.66087
375.0000 -117.06162 -108.84278 8.21884 3.03019 -108.77746 1273.01644
380.0000 -117.67096 -109.51852 8.15244 3.03814 -108.66810 1283.45299
385.0000 -117.74348 -110.31422 7.42926 2.95491 -109.81276 1211.14764
390.0000 -117.96444 -110.06874 7.89570 2.93055 -110.14778 1193.02625
395.0000 -118.80632 -110.11816 8.68816 2.95472 -109.81529 1183.11827
400.0000 -118.50433 -111.61655 6.88778 2.88329 -110.79771 1153.57400
405.0000 -119.65713 -111.92522 7.73191 2.79693 -111.98530 1108.41565
410.0000 -117.74373 -110.05812 7.68562 2.83619 -111.44541 1139.25957
415.0000 -119.18000 -112.44525 6.73475 2.81744 -111.70332 1121.75974
420.0000 -119.39201 -112.23479 7.15723 2.79225 -112.04966 1081.75696
425.0000 -117.18677 -109.61888 7.56789 2.86796 -111.00851 1136.26590
430.0000 -116.83466 -109.30661 7.52806 2.82120 -111.65165 1104.07289
435.0000 -117.19571 -110.08557 7.11014 2.92206 -110.26450 1204.60776
440.0000 -116.21538 -108.58214 7.63324 2.97652 -109.51560 1263.85453
445.0000 -119.31976 -112.41591 6.90385 2.92198 -110.26563 1133.74122
450.0000 -118.74900 -111.04244 7.70656 2.81325 -111.76087 1082.57854
455.0000 -119.41040 -113.76594 5.64445 2.73907 -112.78108 1050.50839
460.0000 -117.65524 -110.77968 6.87556 2.76698 -112.39730 1071.40099
465.0000 -119.03134 -112.05177 6.97957 2.91456 -110.36765 1187.15174
470.0000 -121.72695 -113.46596 8.26099 2.72366 -112.99303 1042.57174
475.0000 -117.57014 -111.40833 6.16181 2.77963 -112.22332 1100.60295
480.0000 -119.44292 -111.92735 7.51557 2.82724 -111.56845 1115.04057
485.0000 -119.88279 -111.55532 8.32747 2.80341 -111.89620 1112.51825
490.0000 -118.97363 -109.95307 9.02057 2.94164 -109.99527 1215.54282
495.0000 -118.92542 -110.73213 8.19329 2.89823 -110.59220 1212.38452
500.0000 -119.27221 -112.70739 6.56482 2.89134 -110.68693 1147.30284
FREEZING PROCESS: loop number 3 T-loop= 1131.0000000000000
main_MD> interactions number 3 at Temperature= 1131.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.09936 -1.49361 0.50129
force_rgl> df(natom) -1.28610 1.32013 1.67658
505.0000 -117.23386 -110.63711 6.59675 2.80180 -111.91838 1113.00817
510.0000 -115.73975 -107.62618 8.11357 3.00836 -109.07761 1253.69156
515.0000 -118.80004 -111.94724 6.85280 2.97139 -109.58616 1228.30423
520.0000 -119.44587 -113.32711 6.11876 2.83511 -111.46026 1107.59108
525.0000 -118.81813 -111.95891 6.85922 2.77828 -112.24187 1088.49305
530.0000 -121.06850 -112.62642 8.44207 2.71178 -113.15637 1066.72519
535.0000 -120.81400 -114.88049 5.93352 2.65751 -113.90270 1002.52899
540.0000 -118.77396 -112.63249 6.14147 2.63812 -114.16933 989.56632
545.0000 -119.88145 -111.63525 8.24620 2.81226 -111.77447 1130.22169
550.0000 -119.54732 -112.18927 7.35805 2.74329 -112.72298 1053.82125
555.0000 -120.05684 -112.74146 7.31538 2.73092 -112.89321 1034.74826
560.0000 -120.17581 -111.07130 9.10451 2.77343 -112.30857 1132.00119
565.0000 -119.21020 -111.77535 7.43485 2.89513 -110.63487 1181.83524
570.0000 -119.96087 -112.37312 7.58775 2.79578 -112.00115 1121.52968
575.0000 -119.00342 -112.48763 6.51579 2.72679 -112.94999 1081.92594
580.0000 -117.88610 -110.98142 6.90468 2.78261 -112.18235 1122.23069
585.0000 -118.49052 -110.87239 7.61813 2.85309 -111.21302 1155.73561
590.0000 -119.81049 -112.20275 7.60774 2.82318 -111.62434 1125.05835
595.0000 -118.97319 -113.32018 5.65301 2.75268 -112.59384 1064.16372
600.0000 -119.83124 -111.80412 8.02712 2.77353 -112.30718 1105.06701
605.0000 -120.08898 -112.29456 7.79442 2.77386 -112.30264 1079.13476
610.0000 -119.46277 -111.76028 7.70249 2.80428 -111.88422 1130.01769
615.0000 -119.63587 -110.77261 8.86326 2.83063 -111.52191 1169.36680
620.0000 -118.30763 -109.54051 8.76711 2.89181 -110.68051 1184.40084
625.0000 -117.13831 -109.52144 7.61687 3.01950 -108.92446 1301.08220
630.0000 -118.28058 -110.38471 7.89587 2.92509 -110.22288 1158.98416
635.0000 -119.24087 -109.61948 9.62139 2.91498 -110.36185 1175.13725
640.0000 -117.96323 -109.31644 8.64679 2.94979 -109.88317 1158.38084
645.0000 -119.40573 -112.60949 6.79624 2.91976 -110.29612 1179.28352
650.0000 -117.87557 -110.47795 7.39762 2.85657 -111.16514 1154.67102
655.0000 -119.76326 -113.22808 6.53518 2.78789 -112.10967 1102.93643
660.0000 -118.74324 -112.27142 6.47182 2.75258 -112.59534 1055.75215
665.0000 -119.16315 -111.12139 8.04176 2.80543 -111.86846 1112.93788
670.0000 -118.78804 -111.05897 7.72906 2.81624 -111.71975 1097.01699
675.0000 -118.27237 -110.34109 7.93128 2.93140 -110.13602 1266.29977
680.0000 -118.65453 -109.97149 8.68304 2.91664 -110.33910 1181.96239
685.0000 -118.80009 -110.28891 8.51118 2.96857 -109.62490 1236.28285
690.0000 -118.95029 -111.32752 7.62277 2.92136 -110.27415 1223.57228
695.0000 -119.04270 -110.89318 8.14952 2.84088 -111.38098 1104.21808
700.0000 -118.94219 -110.30289 8.63929 2.88341 -110.79598 1179.79467
705.0000 -118.33262 -110.36711 7.96551 2.85281 -111.21693 1136.43133
710.0000 -120.79069 -114.61627 6.17442 2.75404 -112.57519 1094.44917
715.0000 -120.69762 -114.75043 5.94719 2.63461 -114.21771 1025.99857
720.0000 -118.92764 -111.82234 7.10530 2.71666 -113.08932 1047.74860
725.0000 -120.06564 -112.77797 7.28767 2.80332 -111.89751 1096.82388
730.0000 -117.98695 -110.98842 6.99853 2.84717 -111.29439 1147.30527
735.0000 -119.38268 -112.18214 7.20054 2.84472 -111.32810 1122.75577
740.0000 -118.18831 -111.25763 6.93068 2.87284 -110.94139 1179.12385
745.0000 -118.56994 -110.88560 7.68434 2.87828 -110.86662 1165.10275
750.0000 -119.83556 -111.75336 8.08220 2.87075 -110.97017 1176.16235
FREEZING PROCESS: loop number 4 T-loop= 1106.0000000000000
main_MD> interactions number 4 at Temperature= 1106.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.62859 2.43082 -2.56567
force_rgl> df(natom) -0.14626 0.29788 -1.68827
755.0000 -119.00831 -111.38212 7.62619 2.84736 -111.29187 1151.89278
760.0000 -122.75219 -114.12299 8.62921 2.77431 -112.29642 1112.23852
765.0000 -118.40317 -112.06817 6.33500 2.80462 -111.87956 1072.76230
770.0000 -119.70917 -113.43509 6.27408 2.79928 -111.95298 1069.02497
775.0000 -118.71091 -111.86475 6.84616 2.72288 -113.00372 1049.52459
780.0000 -119.24887 -111.94180 7.30707 2.85657 -111.16522 1164.26582
785.0000 -120.92381 -113.92034 7.00347 2.75838 -112.51549 1098.07497
790.0000 -121.15571 -114.51900 6.63672 2.63729 -114.18085 1002.70465
795.0000 -120.11157 -112.69177 7.41980 2.62778 -114.31165 992.54762
800.0000 -119.18462 -111.59435 7.59027 2.78412 -112.16148 1082.29840
805.0000 -119.32960 -111.90315 7.42645 2.77362 -112.30592 1076.41592
810.0000 -119.28062 -111.10637 8.17424 2.91066 -110.42136 1169.53012
815.0000 -116.69154 -109.17082 7.52072 2.95364 -109.83015 1172.02019
820.0000 -119.63892 -112.70487 6.93405 2.88962 -110.71060 1139.71854
825.0000 -119.05614 -111.97790 7.07824 2.81968 -111.67243 1148.69093
830.0000 -118.43605 -112.05188 6.38417 2.79455 -112.01811 1064.80044
835.0000 -118.93933 -111.60800 7.33133 2.80256 -111.90793 1111.51011
840.0000 -118.45527 -109.59329 8.86197 2.81371 -111.75455 1145.92705
845.0000 -117.85026 -110.39075 7.45951 2.94949 -109.88724 1222.05571
850.0000 -117.61102 -109.73496 7.87606 2.90567 -110.48986 1143.15446
855.0000 -117.51124 -109.50169 8.00954 2.92850 -110.17600 1195.40725
860.0000 -117.46630 -110.52369 6.94261 2.94805 -109.90707 1220.75941
865.0000 -120.40548 -112.43095 7.97454 2.89877 -110.58486 1179.69101
870.0000 -119.21995 -112.70195 6.51801 2.72372 -112.99215 1035.59220
875.0000 -119.02426 -112.99204 6.03222 2.75765 -112.52553 1033.21496
880.0000 -121.45235 -112.89456 8.55779 2.72599 -112.96099 1073.88881
885.0000 -121.42540 -114.40426 7.02114 2.70166 -113.29561 1082.22477
890.0000 -121.45423 -116.08678 5.36745 2.61854 -114.43866 1003.16691
895.0000 -121.37850 -115.58294 5.79556 2.53145 -115.63632 894.31243
900.0000 -118.50047 -111.63955 6.86092 2.70393 -113.26429 1057.10095
905.0000 -119.54098 -113.44912 6.09185 2.75138 -112.61181 1053.69816
910.0000 -120.06328 -112.96855 7.09474 2.69642 -113.36759 1016.03475
915.0000 -116.51139 -107.96522 8.54617 2.85538 -111.18153 1174.54434
920.0000 -119.17271 -111.52768 7.64503 3.00617 -109.10785 1245.40332
925.0000 -117.87996 -110.66110 7.21887 2.90865 -110.44893 1195.75169
930.0000 -117.87800 -112.01369 5.86431 2.88756 -110.73891 1137.50529
935.0000 -119.52813 -112.26510 7.26302 2.78469 -112.15374 1099.33191
940.0000 -119.90372 -112.54668 7.35704 2.75149 -112.61029 1054.87924
945.0000 -120.16415 -113.04464 7.11951 2.76684 -112.39919 1088.62050
950.0000 -116.95165 -110.89760 6.05405 2.84131 -111.37507 1103.43155
955.0000 -117.90602 -111.72896 6.17707 2.91540 -110.35606 1150.20486
960.0000 -120.56420 -113.11768 7.44652 2.81087 -111.79358 1076.98625
965.0000 -120.49168 -112.30129 8.19039 2.70315 -113.27500 1003.51648
970.0000 -119.06953 -110.96158 8.10795 2.80859 -111.82501 1080.45024
975.0000 -118.85167 -110.48180 8.36987 2.92992 -110.15638 1175.27782
980.0000 -118.74054 -111.35725 7.38329 2.86640 -111.02999 1124.14527
985.0000 -117.97083 -110.02282 7.94801 2.83903 -111.40644 1150.39881
990.0000 -118.53721 -110.14122 8.39599 2.88599 -110.76061 1212.78055
995.0000 -117.98017 -109.51806 8.46211 2.91776 -110.32360 1187.96352
1000.0000 -118.90560 -110.63899 8.26661 2.94939 -109.88868 1185.82473
FREEZING PROCESS: loop number 5 T-loop= 1081.0000000000000
main_MD> interactions number 5 at Temperature= 1081.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.00621 -0.23226 -1.59219
force_rgl> df(natom) -1.59043 1.00673 -1.08272
1005.0000 -120.24914 -113.03669 7.21245 2.80635 -111.85577 1097.64772
1010.0000 -121.42675 -113.20796 8.21879 2.70469 -113.25384 1021.69892
1015.0000 -118.54496 -110.19424 8.35072 2.75002 -112.63048 1058.64085
1020.0000 -119.72707 -111.45592 8.27115 2.89623 -110.61968 1189.86397
1025.0000 -119.30453 -111.88481 7.41971 2.81722 -111.70629 1102.61993
1030.0000 -117.35037 -109.96805 7.38232 2.80584 -111.86285 1118.04432
1035.0000 -120.19386 -112.55207 7.64179 2.82270 -111.63096 1122.07280
1040.0000 -119.76754 -113.96734 5.80020 2.71198 -113.15360 1025.13144
1045.0000 -117.80936 -109.86283 7.94654 2.84403 -111.33767 1158.36529
1050.0000 -118.96621 -112.12136 6.84485 2.82424 -111.60980 1091.84619
1055.0000 -120.71413 -114.17726 6.53687 2.73328 -112.86074 1048.18430
1060.0000 -119.86505 -111.68553 8.17952 2.78940 -112.08886 1072.73086
1065.0000 -120.19255 -111.88401 8.30854 2.81414 -111.74871 1106.99291
1070.0000 -119.35133 -112.32421 7.02713 2.75453 -112.56848 1093.56235
1075.0000 -118.99289 -112.17676 6.81613 2.79536 -112.00694 1123.54157
1080.0000 -119.17700 -112.06163 7.11537 2.76434 -112.43357 1073.91438
1085.0000 -120.15388 -113.96177 6.19211 2.71712 -113.08289 1026.76180
1090.0000 -120.12598 -113.08206 7.04392 2.75877 -112.51012 1123.94714
1095.0000 -117.96346 -111.15472 6.80874 2.79100 -112.06691 1140.87268
1100.0000 -118.93376 -111.12968 7.80408 2.83594 -111.44884 1066.86664
1105.0000 -117.76867 -110.29363 7.47504 2.89302 -110.66395 1137.47579
1110.0000 -117.49738 -110.83489 6.66248 2.86018 -111.11553 1149.94794
1115.0000 -118.86641 -112.15055 6.71586 2.81562 -111.72834 1059.46601
1120.0000 -120.22963 -110.87285 9.35678 2.78397 -112.16353 1096.09036
1125.0000 -119.57103 -113.16112 6.40991 2.81805 -111.69495 1106.07543
1130.0000 -118.46062 -111.15768 7.30294 2.69377 -113.40411 1028.28411
1135.0000 -118.83704 -112.11457 6.72247 2.79032 -112.07628 1118.98489
1140.0000 -119.77396 -113.15576 6.61820 2.74746 -112.66570 1076.95385
1145.0000 -120.23791 -114.21412 6.02378 2.67374 -113.67951 1018.00231
1150.0000 -118.85937 -112.43449 6.42487 2.71517 -113.10977 1056.86324
1155.0000 -118.54106 -109.83605 8.70501 2.89664 -110.61404 1158.22034
1160.0000 -118.02153 -111.67895 6.34258 2.86465 -111.05408 1130.94693
1165.0000 -119.92856 -113.43733 6.49123 2.71418 -113.12335 1051.36663
1170.0000 -120.29954 -113.95067 6.34887 2.71171 -113.15730 1025.99611
1175.0000 -119.91252 -112.89475 7.01777 2.69652 -113.36618 1005.51586
1180.0000 -120.84279 -113.91942 6.92337 2.73759 -112.80139 1054.20448
1185.0000 -119.46876 -112.17497 7.29379 2.74158 -112.74657 1021.70759
1190.0000 -120.82439 -113.08932 7.73508 2.82471 -111.60328 1128.86063
1195.0000 -120.06544 -114.18382 5.88162 2.65955 -113.87471 1024.59500
1200.0000 -120.30308 -113.31411 6.98897 2.69210 -113.42706 1029.12267
1205.0000 -121.55851 -114.20399 7.35452 2.69920 -113.32940 1055.79730
1210.0000 -118.62216 -111.61723 7.00493 2.68780 -113.48616 1021.55741
1215.0000 -118.39609 -110.08558 8.31051 2.86488 -111.05092 1162.08141
1220.0000 -118.05873 -109.90662 8.15211 2.89031 -110.70120 1168.44032
1225.0000 -119.68599 -111.56112 8.12487 2.94011 -110.01634 1197.47855
1230.0000 -119.64961 -111.54673 8.10287 2.78807 -112.10714 1108.09646
1235.0000 -119.55752 -113.56994 5.98758 2.68789 -113.48488 997.82681
1240.0000 -120.99408 -113.89047 7.10362 2.66364 -113.81840 983.40481
1245.0000 -119.48995 -113.03057 6.45938 2.62152 -114.39769 929.03589
1250.0000 -119.03071 -111.52790 7.50281 2.82004 -111.66753 1067.24673
FREEZING PROCESS: loop number 6 T-loop= 1056.0000000000000
main_MD> interactions number 6 at Temperature= 1056.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 4.86572 -2.63833 -5.91162
force_rgl> df(natom) -0.24020 0.27305 -2.57183
1255.0000 -120.60770 -113.46151 7.14619 2.73659 -112.81512 1062.37448
1260.0000 -119.05283 -112.11491 6.93792 2.75481 -112.56462 1041.14388
1265.0000 -119.33848 -110.48320 8.85528 2.80006 -111.94226 1082.18322
1270.0000 -119.61511 -111.25050 8.36462 2.82693 -111.57278 1155.06760
1275.0000 -116.63087 -110.57475 6.05613 2.87910 -110.85532 1157.61872
1280.0000 -120.42474 -111.72111 8.70363 2.89046 -110.69905 1131.94195
1285.0000 -118.52928 -110.95548 7.57381 2.84080 -111.38210 1144.11173
1290.0000 -118.07854 -109.86276 8.21577 2.87134 -110.96206 1161.19403
1295.0000 -120.08097 -113.52781 6.55316 2.79843 -111.96471 1083.48721
1300.0000 -119.40661 -112.87961 6.52700 2.71676 -113.08784 1042.80372
1305.0000 -119.22903 -110.80672 8.42232 2.74756 -112.66437 1091.51618
1310.0000 -118.62709 -111.24155 7.38554 2.75484 -112.56421 1081.08720
1315.0000 -119.08299 -111.19148 7.89151 2.85602 -111.17273 1148.04035
1320.0000 -120.03927 -113.27939 6.75988 2.84268 -111.35613 1104.22454
1325.0000 -118.09609 -111.28936 6.80673 2.79113 -112.06510 1106.43933
1330.0000 -120.44339 -113.87689 6.56649 2.76918 -112.36699 1088.05708
1335.0000 -119.70037 -112.13728 7.56309 2.77513 -112.28520 1079.97594
1340.0000 -119.21800 -111.37408 7.84392 2.80358 -111.89393 1093.99110
1345.0000 -118.86385 -111.37209 7.49176 2.87441 -110.91988 1143.44062
1350.0000 -118.39593 -113.13159 5.26435 2.80348 -111.89532 1075.75079
1355.0000 -119.12495 -112.12941 6.99554 2.80091 -111.93067 1080.01547
1360.0000 -120.05029 -113.22582 6.82447 2.74880 -112.64724 1067.02469
1365.0000 -118.47357 -111.33655 7.13702 2.75229 -112.59930 1075.45960
1370.0000 -120.13672 -112.51287 7.62385 2.81081 -111.79442 1123.28444
1375.0000 -119.44878 -112.58407 6.86471 2.73738 -112.80437 1072.52417
1380.0000 -120.37844 -112.87880 7.49964 2.72708 -112.94600 1040.40453
1385.0000 -119.54173 -112.24580 7.29593 2.80341 -111.89629 1096.49310
1390.0000 -119.46041 -112.56136 6.89905 2.75875 -112.51045 1052.15104
1395.0000 -118.41025 -111.31837 7.09188 2.76634 -112.40602 1092.97558
1400.0000 -119.30274 -112.19027 7.11247 2.84592 -111.31159 1172.24532
1405.0000 -119.70821 -113.50121 6.20699 2.72888 -112.92115 1023.85046
1410.0000 -120.07721 -112.00316 8.07405 2.79171 -112.05720 1125.37002
1415.0000 -118.01524 -109.76073 8.25452 2.84290 -111.35321 1164.44924
1420.0000 -117.41558 -110.93597 6.47962 2.87392 -110.92661 1155.61106
1425.0000 -119.31992 -112.35705 6.96287 2.85032 -111.25115 1122.58849
1430.0000 -118.11086 -112.52153 5.58933 2.79012 -112.07899 1074.41008
1435.0000 -119.81381 -112.43230 7.38151 2.83860 -111.41227 1078.79602
1440.0000 -121.09968 -114.50635 6.59334 2.75526 -112.55835 1074.28058
1445.0000 -121.77775 -116.94974 4.82801 2.57078 -115.09551 928.70831
1450.0000 -121.97212 -115.48638 6.48575 2.46944 -116.48920 840.37608
1455.0000 -120.87913 -113.50386 7.37528 2.61475 -114.49084 973.81120
1460.0000 -118.65663 -111.35991 7.29671 2.72985 -112.90785 1010.57571
1465.0000 -119.52276 -112.29268 7.23008 2.79022 -112.07766 1081.96574
1470.0000 -119.93618 -112.65637 7.27981 2.78439 -112.15778 1119.69359
1475.0000 -118.24274 -111.36610 6.87664 2.81231 -111.77384 1106.83355
1480.0000 -120.95140 -112.61168 8.33972 2.84240 -111.36000 1128.22006
1485.0000 -118.88607 -110.66094 8.22512 2.80226 -111.91207 1116.47277
1490.0000 -119.42913 -112.79003 6.63909 2.79192 -112.05420 1123.54143
1495.0000 -119.49498 -113.03566 6.45932 2.75629 -112.54427 1065.91066
1500.0000 -119.44010 -112.64955 6.79054 2.74769 -112.66250 1083.89680
FREEZING PROCESS: loop number 7 T-loop= 1031.0000000000000
main_MD> interactions number 7 at Temperature= 1031.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.72159 -1.10657 -2.40765
force_rgl> df(natom) 0.76957 -1.06995 0.48212
1505.0000 -119.95227 -112.44351 7.50876 2.76093 -112.48045 1078.12947
1510.0000 -120.90019 -113.70482 7.19537 2.64059 -114.13544 959.63234
1515.0000 -120.93955 -114.76838 6.17117 2.63309 -114.23861 962.70035
1520.0000 -121.30895 -115.42123 5.88772 2.59188 -114.80531 945.18896
1525.0000 -121.42146 -115.00017 6.42129 2.54956 -115.38736 906.90482
1530.0000 -119.68675 -113.61907 6.06768 2.60185 -114.66819 957.91712
1535.0000 -120.39879 -112.65603 7.74276 2.69377 -113.40399 1050.25919
1540.0000 -120.88851 -113.74365 7.14486 2.68615 -113.50891 1013.85406
1545.0000 -120.07811 -113.90043 6.17768 2.59831 -114.71688 954.68087
1550.0000 -120.49575 -113.81807 6.67768 2.65719 -113.90715 989.38816
1555.0000 -120.75716 -114.29488 6.46229 2.61828 -114.44220 984.03236
1560.0000 -120.39794 -114.10854 6.28941 2.58313 -114.92559 928.20002
1565.0000 -120.76870 -114.46338 6.30532 2.61916 -114.43007 982.16468
1570.0000 -118.83614 -112.18993 6.64621 2.70043 -113.31253 1031.82841
1575.0000 -119.22353 -112.64286 6.58067 2.75257 -112.59542 1057.04873
1580.0000 -119.98642 -112.33161 7.65481 2.75919 -112.50442 1070.08536
1585.0000 -119.74217 -111.10018 8.64200 2.86060 -111.10970 1167.18027
1590.0000 -117.74848 -110.85316 6.89532 2.89891 -110.58285 1164.78033
1595.0000 -119.57309 -111.73034 7.84275 2.83822 -111.41749 1137.67082
1600.0000 -120.50207 -112.65767 7.84441 2.75193 -112.60425 1063.80271
1605.0000 -120.40282 -113.70004 6.70277 2.67556 -113.65453 990.47062
1610.0000 -119.78496 -112.49104 7.29392 2.67827 -113.61716 994.74355
1615.0000 -121.00551 -114.05253 6.95298 2.68518 -113.52220 1034.97100
1620.0000 -120.43433 -115.64117 4.79316 2.54731 -115.41819 845.80179
1625.0000 -122.04337 -116.34050 5.70287 2.56591 -115.16249 908.50656
1630.0000 -121.42414 -114.33691 7.08723 2.55663 -115.29009 909.23416
1635.0000 -121.66657 -115.58044 6.08613 2.58081 -114.95755 947.07981
1640.0000 -121.82446 -115.62693 6.19753 2.56690 -115.14881 912.05015
1645.0000 -121.84832 -114.82741 7.02091 2.52352 -115.74544 919.12245
1650.0000 -118.83387 -111.99855 6.83531 2.76247 -112.45929 1068.33121
1655.0000 -118.21446 -111.12178 7.09268 2.87512 -110.91003 1176.90331
1660.0000 -119.04891 -112.77141 6.27749 2.85735 -111.15448 1113.30097
1665.0000 -121.00834 -114.65763 6.35071 2.65602 -113.92326 1016.79210
1670.0000 -120.43977 -113.45828 6.98150 2.68855 -113.47579 993.08100
1675.0000 -119.92082 -113.54197 6.37884 2.65348 -113.95814 981.46877
1680.0000 -119.16358 -111.69617 7.46741 2.74945 -112.63839 1090.42564
1685.0000 -119.43316 -113.25030 6.18285 2.76502 -112.42426 1056.49812
1690.0000 -120.12213 -114.52334 5.59879 2.72837 -112.92824 1083.30172
1695.0000 -121.83893 -113.47780 8.36114 2.65135 -113.98744 954.06200
1700.0000 -119.29480 -113.20998 6.08482 2.72080 -113.03231 1047.73228
1705.0000 -119.62818 -113.44066 6.18752 2.74492 -112.70060 1062.65796
1710.0000 -118.08726 -110.62761 7.45965 2.79475 -112.01539 1102.77153
1715.0000 -119.61395 -112.18431 7.42964 2.85046 -111.24916 1125.14772
1720.0000 -118.75043 -110.97612 7.77432 2.78785 -112.11027 1112.32900
1725.0000 -119.48306 -113.07526 6.40780 2.82896 -111.54486 1136.79571
1730.0000 -119.94700 -113.21020 6.73680 2.70787 -113.21019 1001.35397
1735.0000 -120.21200 -113.88174 6.33026 2.71895 -113.05780 1029.95674
1740.0000 -120.05613 -113.53557 6.52056 2.66834 -113.75382 990.15303
1745.0000 -121.09408 -114.30990 6.78418 2.68703 -113.49677 998.34671
1750.0000 -119.55425 -113.65641 5.89784 2.61466 -114.49203 928.69342
FREEZING PROCESS: loop number 8 T-loop= 1006.0000000000000
main_MD> interactions number 8 at Temperature= 1006.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.76732 2.51600 -3.09978
force_rgl> df(natom) 2.76984 -0.80976 -0.55829
1755.0000 -118.32231 -113.19682 5.12549 2.71559 -113.10395 1027.05387
1760.0000 -120.15086 -114.31944 5.83142 2.68141 -113.57411 1032.79232
1765.0000 -121.06907 -113.66873 7.40034 2.67445 -113.66971 1003.09510
1770.0000 -120.58298 -114.24398 6.33900 2.59503 -114.76196 930.38823
1775.0000 -120.85514 -114.56851 6.28663 2.66679 -113.77507 1002.40876
1780.0000 -121.91774 -115.18299 6.73475 2.55169 -115.35800 876.18408
1785.0000 -120.06863 -113.71877 6.34986 2.61860 -114.43779 947.43083
1790.0000 -121.07780 -114.65708 6.42072 2.60602 -114.61085 950.78248
1795.0000 -119.83299 -113.89270 5.94029 2.63884 -114.15942 984.21201
1800.0000 -120.25375 -114.76601 5.48774 2.65323 -113.96165 994.41360
1805.0000 -121.08032 -114.65346 6.42685 2.57490 -115.03882 914.86138
1810.0000 -120.85090 -114.51440 6.33650 2.67789 -113.62243 1017.64063
1815.0000 -120.39733 -114.13064 6.26669 2.63257 -114.24568 975.06644
1820.0000 -121.68870 -114.42379 7.26491 2.63944 -114.15117 980.12355
1825.0000 -120.98773 -112.40414 8.58359 2.70254 -113.28347 1029.44523
1830.0000 -118.97625 -113.31899 5.65726 2.75128 -112.61314 1095.40817
1835.0000 -121.57002 -114.25006 7.31996 2.61993 -114.41960 993.10496
1840.0000 -120.08475 -112.90387 7.18088 2.67697 -113.63511 1020.91041
1845.0000 -119.70012 -112.08411 7.61600 2.77151 -112.33500 1096.60161
1850.0000 -119.29132 -111.57193 7.71939 2.78335 -112.17209 1111.46802
1855.0000 -120.05357 -111.94282 8.11075 2.73160 -112.88375 1062.71464
1860.0000 -118.94046 -111.71879 7.22168 2.78765 -112.11301 1112.52592
1865.0000 -119.72045 -112.32866 7.39179 2.76729 -112.39295 1073.48246
1870.0000 -118.33541 -111.47041 6.86500 2.78525 -112.14592 1069.44820
1875.0000 -120.94089 -115.40284 5.53805 2.65896 -113.88272 1016.99215
1880.0000 -121.95722 -115.94791 6.00931 2.53539 -115.58216 929.61191
1885.0000 -119.60083 -112.78973 6.81110 2.59586 -114.75063 948.31759
1890.0000 -120.90426 -114.85117 6.05309 2.67886 -113.60917 1020.30294
1895.0000 -121.98995 -115.88660 6.10336 2.54516 -115.44787 903.28014
1900.0000 -120.99947 -113.93270 7.06677 2.61685 -114.46193 964.56076
1905.0000 -120.05322 -114.26262 5.79060 2.66769 -113.76275 988.68507
1910.0000 -120.45221 -113.99649 6.45572 2.60773 -114.58736 963.94676
1915.0000 -121.45248 -114.73853 6.71396 2.65553 -113.92997 987.34888
1920.0000 -119.94764 -113.03054 6.91710 2.63776 -114.17437 1007.16187
1925.0000 -118.05915 -111.25864 6.80051 2.73537 -112.83195 1048.41219
1930.0000 -121.05438 -115.54908 5.50530 2.70002 -113.31811 1030.73242
1935.0000 -121.51701 -115.45484 6.06217 2.55131 -115.36318 925.82600
1940.0000 -120.36786 -113.48392 6.88394 2.60869 -114.57417 952.70358
1945.0000 -119.27905 -113.61348 5.66557 2.71733 -113.08009 1034.45183
1950.0000 -119.42796 -113.17406 6.25389 2.70620 -113.23307 1013.03790
1955.0000 -119.49627 -113.56960 5.92667 2.74264 -112.73201 1063.46388
1960.0000 -119.46556 -112.90941 6.55614 2.63202 -114.25327 980.72710
1965.0000 -120.67263 -114.66053 6.01209 2.68476 -113.52797 1000.37759
1970.0000 -121.34600 -115.01831 6.32769 2.63635 -114.19367 961.17849
1975.0000 -121.17160 -114.32662 6.84498 2.59572 -114.75255 979.03308
1980.0000 -122.09776 -116.40221 5.69555 2.51179 -115.90673 895.78669
1985.0000 -121.60101 -116.18787 5.41314 2.44648 -116.80486 856.27007
1990.0000 -120.32324 -113.38815 6.93509 2.56168 -115.22060 913.91728
1995.0000 -119.42220 -111.74595 7.67626 2.74801 -112.65810 1060.60136
2000.0000 -118.65424 -110.88709 7.76715 2.86036 -111.11307 1162.04094
FREEZING PROCESS: loop number 9 T-loop= 981.00000000000000
main_MD> interactions number 9 at Temperature= 981.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.82896 2.63605 1.35611
force_rgl> df(natom) 0.83855 -2.71104 1.73673
2005.0000 -118.81072 -111.42690 7.38382 2.87327 -110.93556 1141.81868
2010.0000 -121.33119 -114.21166 7.11953 2.72672 -112.95091 1022.64299
2015.0000 -119.72875 -112.39453 7.33422 2.63976 -114.14676 989.74963
2020.0000 -120.17020 -113.87716 6.29304 2.71843 -113.06497 1018.04099
2025.0000 -121.47001 -114.68424 6.78577 2.61244 -114.52251 974.93156
2030.0000 -121.57992 -114.81915 6.76077 2.64639 -114.05567 991.40336
2035.0000 -119.90670 -114.81011 5.09659 2.54690 -115.42384 923.39048
2040.0000 -120.48670 -115.14925 5.33745 2.51517 -115.86019 919.80782
2045.0000 -119.95600 -114.57097 5.38503 2.56273 -115.20624 957.23068
2050.0000 -120.68094 -116.29571 4.38523 2.49101 -116.19252 863.73792
2055.0000 -121.72100 -116.34511 5.37589 2.46381 -116.56662 879.50221
2060.0000 -122.34566 -115.77180 6.57385 2.50478 -116.00312 908.82873
2065.0000 -120.95165 -114.52514 6.42651 2.59649 -114.74190 957.45092
2070.0000 -121.93188 -115.82338 6.10851 2.59941 -114.70177 968.48891
2075.0000 -120.38325 -113.45755 6.92570 2.63181 -114.25622 957.92896
2080.0000 -121.74496 -115.23560 6.50937 2.62712 -114.32070 971.93359
2085.0000 -120.11242 -114.53388 5.57854 2.59772 -114.72498 983.06074
2090.0000 -119.95414 -113.76548 6.18866 2.68748 -113.49051 1004.63693
2095.0000 -121.98140 -115.88581 6.09559 2.57954 -114.97506 927.19935
2100.0000 -121.91084 -115.43258 6.47826 2.47218 -116.45140 866.59849
2105.0000 -121.68251 -115.78464 5.89787 2.52510 -115.72367 891.11557
2110.0000 -120.05480 -114.39275 5.66205 2.58994 -114.83203 968.37663
2115.0000 -121.03110 -114.29197 6.73913 2.65466 -113.94198 994.02957
2120.0000 -122.18687 -116.65411 5.53275 2.56753 -115.14017 923.15767
2125.0000 -121.99276 -116.88285 5.10991 2.43828 -116.91763 845.17696
2130.0000 -121.75938 -115.18650 6.57287 2.55170 -115.35787 893.44257
2135.0000 -123.06319 -117.74473 5.31845 2.49725 -116.10672 915.53281
2140.0000 -120.66273 -115.86192 4.80081 2.46583 -116.53886 795.89323
2145.0000 -121.64834 -115.40587 6.24248 2.52733 -115.69302 874.19804
2150.0000 -120.49430 -114.91073 5.58357 2.57617 -115.02130 895.83079
2155.0000 -118.96827 -111.80576 7.16251 2.71972 -113.04713 1068.84441
2160.0000 -119.63445 -112.10314 7.53131 2.75680 -112.53729 1045.34746
2165.0000 -121.30492 -115.89456 5.41036 2.62917 -114.29252 973.82118
2170.0000 -121.93421 -116.05564 5.87857 2.49386 -116.15336 855.22532
2175.0000 -120.32675 -114.05249 6.27426 2.61008 -114.55505 935.29815
2180.0000 -120.61203 -114.62000 5.99203 2.61064 -114.54725 971.93741
2185.0000 -121.03456 -114.34532 6.68924 2.57753 -115.00263 912.09169
2190.0000 -119.76280 -114.04976 5.71305 2.63928 -114.15350 994.84998
2195.0000 -121.09463 -113.76384 7.33079 2.72761 -112.93863 1064.25272
2200.0000 -119.99903 -114.18919 5.80983 2.64021 -114.14063 967.53462
2205.0000 -120.43351 -114.13026 6.30325 2.61263 -114.51990 966.01082
2210.0000 -120.60514 -113.66457 6.94057 2.61862 -114.43755 949.52456
2215.0000 -120.82462 -114.15053 6.67409 2.64246 -114.10964 1011.02657
2220.0000 -120.61540 -113.69584 6.91956 2.60906 -114.56897 955.72169
2225.0000 -120.19078 -112.72916 7.46162 2.73002 -112.90556 1036.18680
2230.0000 -120.83275 -114.23009 6.60266 2.66976 -113.73432 1034.53352
2235.0000 -120.53485 -113.41910 7.11575 2.68122 -113.57668 1057.30768
2240.0000 -119.64392 -113.55091 6.09301 2.67101 -113.71711 991.19575
2245.0000 -119.82974 -112.47128 7.35847 2.79648 -111.99151 1096.79690
2250.0000 -118.81633 -112.26531 6.55102 2.76977 -112.35886 1098.89015
FREEZING PROCESS: loop number 10 T-loop= 956.00000000000000
main_MD> interactions number 10 at Temperature= 956.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.07459 -1.48784 -0.92461
force_rgl> df(natom) -1.57286 1.54591 1.02940
2255.0000 -120.94657 -114.75211 6.19446 2.67651 -113.64142 1022.04668
2260.0000 -122.08540 -116.15887 5.92653 2.55332 -115.33559 884.23653
2265.0000 -122.06640 -115.75374 6.31265 2.49158 -116.18462 870.70803
2270.0000 -120.09173 -113.09955 6.99218 2.58993 -114.83216 927.06180
2275.0000 -120.73128 -112.80308 7.92821 2.73384 -112.85297 1051.05799
2280.0000 -117.85353 -111.57797 6.27556 2.76037 -112.48813 1043.20386
2285.0000 -120.97268 -114.31969 6.65300 2.69829 -113.34190 989.43008
2290.0000 -121.39659 -114.96454 6.43205 2.61233 -114.52404 915.48338
2295.0000 -120.97706 -114.22356 6.75349 2.60681 -114.60000 984.23667
2300.0000 -120.15792 -113.37887 6.77905 2.65441 -113.94535 974.48797
2305.0000 -121.27554 -114.37324 6.90230 2.60445 -114.63238 939.37562
2310.0000 -122.91823 -116.00362 6.91461 2.56638 -115.15594 971.40697
2315.0000 -121.30917 -115.07530 6.23386 2.58414 -114.91170 928.91290
2320.0000 -120.53428 -113.21635 7.31793 2.55390 -115.32762 928.37930
2325.0000 -119.61297 -114.16391 5.44906 2.65165 -113.98336 1006.00235
2330.0000 -121.20933 -115.12100 6.08834 2.64073 -114.13352 996.05856
2335.0000 -122.30391 -115.28061 7.02331 2.56212 -115.21456 937.58026
2340.0000 -120.99492 -115.06164 5.93328 2.60463 -114.62993 956.58765
2345.0000 -121.27757 -114.20548 7.07209 2.60689 -114.59892 958.23398
2350.0000 -120.66655 -112.92789 7.73866 2.69633 -113.36884 1031.62400
2355.0000 -120.77211 -115.31842 5.45369 2.61564 -114.47855 917.52364
2360.0000 -122.86491 -116.97099 5.89392 2.55844 -115.26523 945.83463
2365.0000 -122.51985 -116.09726 6.42259 2.44158 -116.87231 832.81512
2370.0000 -120.40983 -113.53751 6.87232 2.56282 -115.20488 938.44345
2375.0000 -119.80311 -113.19384 6.60927 2.73982 -112.77074 1048.68822
2380.0000 -119.68826 -111.94404 7.74421 2.72404 -112.98784 1032.67059
2385.0000 -118.69279 -111.07998 7.61281 2.79961 -111.94850 1085.31070
2390.0000 -120.33697 -113.55226 6.78470 2.77949 -112.22517 1064.40187
2395.0000 -120.86487 -113.75387 7.11100 2.62423 -114.36038 975.67901
2400.0000 -121.74107 -116.28687 5.45420 2.59605 -114.74798 933.17809
2405.0000 -120.60768 -114.96636 5.64132 2.49271 -116.16909 867.59694
2410.0000 -119.85874 -114.41200 5.44674 2.55711 -115.28351 905.59093
2415.0000 -121.45004 -116.18379 5.26624 2.56357 -115.19463 964.87529
2420.0000 -119.35295 -113.58735 5.76560 2.55003 -115.38079 897.90366
2425.0000 -121.73342 -116.67623 5.05719 2.56258 -115.20819 894.46131
2430.0000 -121.21795 -116.13978 5.07817 2.49879 -116.08555 866.34700
2435.0000 -120.92049 -113.67799 7.24250 2.58788 -114.86037 957.83923
2440.0000 -120.90487 -113.89142 7.01345 2.64804 -114.03302 990.56300
2445.0000 -120.33619 -112.50454 7.83166 2.70874 -113.19823 1040.52914
2450.0000 -121.77009 -117.01469 4.75540 2.58620 -114.88345 938.35584
2455.0000 -122.03865 -115.95510 6.08354 2.45370 -116.70564 847.41109
2460.0000 -121.88360 -116.53039 5.35321 2.49805 -116.09574 883.06019
2465.0000 -120.40536 -113.41665 6.98872 2.57039 -115.10081 926.22344
2470.0000 -118.69601 -112.72452 5.97149 2.71171 -113.15727 1015.67098
2475.0000 -118.51809 -112.91237 5.60572 2.74132 -112.75013 1054.02401
2480.0000 -120.21558 -113.27603 6.93955 2.71461 -113.11744 1045.18512
2485.0000 -119.23357 -112.53139 6.70218 2.71148 -113.16053 1016.61399
2490.0000 -119.22408 -112.86303 6.36105 2.79121 -112.06399 1102.55309
2495.0000 -118.41786 -111.69954 6.71832 2.72375 -112.99182 1042.07641
2500.0000 -120.82057 -114.45435 6.36622 2.71044 -113.17478 1026.14557
FREEZING PROCESS: loop number 11 T-loop= 931.00000000000000
main_MD> interactions number 11 at Temperature= 931.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.36277 2.18492 1.77420
force_rgl> df(natom) -0.76654 -1.49527 -2.53932
2505.0000 -120.82185 -114.41780 6.40405 2.60509 -114.62363 954.83897
2510.0000 -121.06422 -115.93297 5.13125 2.61324 -114.51154 928.42475
2515.0000 -120.49967 -114.61745 5.88221 2.53272 -115.61895 874.47878
2520.0000 -121.07553 -114.82560 6.24993 2.65002 -114.00577 1019.61503
2525.0000 -121.93338 -116.97259 4.96080 2.50281 -116.03022 864.67478
2530.0000 -121.04965 -115.71640 5.33325 2.47178 -116.45691 854.70409
2535.0000 -122.79196 -116.31898 6.47298 2.46597 -116.53692 890.12166
2540.0000 -122.10462 -115.29969 6.80493 2.56599 -115.16130 937.80998
2545.0000 -121.01290 -114.09460 6.91830 2.56884 -115.12213 911.35665
2550.0000 -120.16847 -113.89952 6.26894 2.62818 -114.30606 973.17944
2555.0000 -121.54166 -115.24217 6.29950 2.55749 -115.27830 930.47941
2560.0000 -121.02137 -115.96740 5.05397 2.57231 -115.07446 923.64192
2565.0000 -119.11985 -113.16755 5.95230 2.61925 -114.42893 977.44857
2570.0000 -122.07381 -115.08522 6.98859 2.60313 -114.65065 1003.27315
2575.0000 -121.34998 -115.16750 6.18248 2.59137 -114.81235 966.56173
2580.0000 -119.69862 -114.47229 5.22633 2.69775 -113.34939 1013.48264
2585.0000 -121.78168 -114.87501 6.90668 2.57062 -115.09761 929.83251
2590.0000 -120.41336 -115.62979 4.78357 2.57495 -115.03806 907.12890
2595.0000 -121.03445 -115.83578 5.19867 2.51926 -115.80403 907.84551
2600.0000 -121.57573 -115.11122 6.46452 2.55452 -115.31913 920.16879
2605.0000 -121.23809 -114.71920 6.51889 2.54344 -115.47143 902.77453
2610.0000 -120.69511 -114.25982 6.43529 2.63504 -114.21178 967.94767
2615.0000 -119.08582 -112.01430 7.07152 2.66942 -113.73894 993.29239
2620.0000 -121.19692 -114.80729 6.38963 2.71032 -113.17649 1050.31905
2625.0000 -120.55468 -114.64665 5.90803 2.60421 -114.63572 964.92172
2630.0000 -121.67198 -115.27291 6.39907 2.54081 -115.50764 915.60387
2635.0000 -120.66707 -113.48112 7.18595 2.58295 -114.92804 939.61159
2640.0000 -120.85470 -115.73399 5.12072 2.60806 -114.58273 908.03151
2645.0000 -122.65652 -114.51986 8.13666 2.60496 -114.62547 962.63945
2650.0000 -120.04832 -113.86750 6.18082 2.57151 -115.08537 903.75146
2655.0000 -121.56573 -114.29503 7.27071 2.67532 -113.65776 1032.79517
2660.0000 -120.97492 -114.04844 6.92648 2.59339 -114.78457 954.13430
2665.0000 -121.81590 -115.23967 6.57623 2.57993 -114.96969 963.28617
2670.0000 -119.73455 -114.16472 5.56983 2.60764 -114.58854 957.39804
2675.0000 -120.33690 -114.20353 6.13337 2.65224 -113.97527 985.64017
2680.0000 -120.15175 -113.62061 6.53114 2.62811 -114.30711 982.72301
2685.0000 -120.95723 -114.66070 6.29653 2.62629 -114.33207 964.63124
2690.0000 -119.89991 -113.60022 6.29969 2.64213 -114.11429 981.30369
2695.0000 -121.08656 -115.01573 6.07083 2.60965 -114.56096 956.57225
2700.0000 -120.05187 -114.20492 5.84695 2.60566 -114.61584 985.20146
2705.0000 -120.84333 -114.33066 6.51267 2.59386 -114.77807 947.95554
2710.0000 -121.61429 -115.18920 6.42509 2.61594 -114.47440 918.90214
2715.0000 -121.55284 -115.83650 5.71633 2.59510 -114.76102 942.44407
2720.0000 -121.15216 -115.00032 6.15184 2.57114 -115.09058 946.90683
2725.0000 -121.51043 -116.09098 5.41945 2.54314 -115.47557 905.49229
2730.0000 -120.01177 -115.72815 4.28362 2.55046 -115.37494 896.42510
2735.0000 -121.50541 -115.86105 5.64436 2.50076 -116.05839 866.44677
2740.0000 -120.84001 -114.70374 6.13627 2.49357 -116.15735 858.54204
2745.0000 -121.55620 -114.96726 6.58894 2.59488 -114.76399 933.38610
2750.0000 -121.17401 -113.94941 7.22460 2.62471 -114.35384 996.56915
FREEZING PROCESS: loop number 12 T-loop= 906.00000000000000
main_MD> interactions number 12 at Temperature= 906.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.27784 -2.64840 1.17764
force_rgl> df(natom) 0.03497 3.27401 7.84257
2755.0000 -120.35232 -113.91963 6.43269 2.66477 -113.80295 1021.51177
2760.0000 -121.32126 -114.80418 6.51708 2.59682 -114.73730 961.16303
2765.0000 -122.90910 -116.40253 6.50657 2.56610 -115.15985 943.85898
2770.0000 -122.63504 -115.08615 7.54889 2.51657 -115.84097 896.51225
2775.0000 -121.90021 -116.40839 5.49182 2.50460 -116.00565 868.75746
2780.0000 -122.75223 -116.09358 6.65865 2.43353 -116.98301 821.22454
2785.0000 -122.19496 -116.29350 5.90146 2.49146 -116.18636 883.65564
2790.0000 -122.64353 -117.65913 4.98440 2.39046 -117.57538 829.91193
2795.0000 -120.85059 -115.75424 5.09635 2.43187 -117.00577 842.13197
2800.0000 -121.04813 -114.44039 6.60774 2.57513 -115.03564 921.00511
2805.0000 -122.65861 -116.48791 6.17070 2.56345 -115.19623 930.06664
2810.0000 -122.05387 -114.56862 7.48525 2.55184 -115.35591 921.46549
2815.0000 -120.40745 -115.32775 5.07970 2.53944 -115.52644 905.57126
2820.0000 -121.44018 -115.22760 6.21258 2.53498 -115.58777 907.29241
2825.0000 -122.31500 -115.59167 6.72333 2.47728 -116.38126 869.53593
2830.0000 -121.68220 -116.59283 5.08938 2.47026 -116.47787 874.82483
2835.0000 -121.36694 -114.85750 6.50944 2.53400 -115.60135 909.92232
2840.0000 -122.72799 -116.50566 6.22233 2.58246 -114.93480 943.00121
2845.0000 -121.87897 -115.55284 6.32612 2.52498 -115.72530 895.56641
2850.0000 -122.16202 -115.40126 6.76076 2.54081 -115.50762 937.65699
2855.0000 -119.94309 -114.01454 5.92855 2.55213 -115.35197 918.08786
2860.0000 -121.93656 -117.22638 4.71019 2.51099 -115.91775 869.87553
2865.0000 -121.40448 -115.99535 5.40914 2.44124 -116.87697 858.99484
2870.0000 -121.59389 -115.30051 6.29338 2.60030 -114.68947 984.59925
2875.0000 -121.17432 -115.42011 5.75421 2.56089 -115.23155 908.53625
2880.0000 -121.19270 -114.99474 6.19795 2.58616 -114.88391 942.60821
2885.0000 -122.21917 -116.07795 6.14122 2.58089 -114.95649 937.16030
2890.0000 -122.97121 -115.93322 7.03799 2.52402 -115.73858 903.54988
2895.0000 -121.49320 -114.57379 6.91941 2.52172 -115.77010 899.80038
2900.0000 -121.59409 -116.39581 5.19828 2.56145 -115.22385 950.95154
2905.0000 -121.62581 -116.55614 5.06966 2.49776 -116.09972 862.56772
2910.0000 -121.69292 -116.08321 5.60971 2.45610 -116.67267 842.42780
2915.0000 -122.08289 -115.86303 6.21986 2.52107 -115.77912 899.19683
2920.0000 -121.45028 -115.55303 5.89725 2.50655 -115.97873 895.57301
2925.0000 -120.89875 -114.56613 6.33262 2.60650 -114.60425 987.30716
2930.0000 -120.14878 -113.12676 7.02201 2.65863 -113.88730 992.63091
2935.0000 -119.29020 -111.59528 7.69492 2.74199 -112.74092 1058.71644
2940.0000 -118.41123 -112.52209 5.88914 2.71901 -113.05698 1006.90993
2945.0000 -119.29868 -111.92075 7.37793 2.72880 -112.92236 1015.03499
2950.0000 -122.62946 -115.63208 6.99738 2.64055 -114.13594 994.05315
2955.0000 -122.97726 -118.43250 4.54476 2.45796 -116.64707 852.27262
2960.0000 -123.22947 -116.93803 6.29143 2.42770 -117.06319 841.76619
2965.0000 -121.61538 -116.09829 5.51708 2.43717 -116.93296 852.31248
2970.0000 -120.34463 -115.00911 5.33551 2.55834 -115.26651 934.10222
2975.0000 -120.86517 -115.52666 5.33851 2.54941 -115.38937 914.63805
2980.0000 -122.85746 -116.68025 6.17721 2.51095 -115.91830 851.27970
2985.0000 -121.71111 -115.47498 6.23613 2.48222 -116.31344 879.70817
2990.0000 -120.82690 -115.81991 5.00699 2.61030 -114.55195 974.23637
2995.0000 -121.10252 -114.96027 6.14225 2.54574 -115.43990 890.45111
3000.0000 -121.17662 -115.48466 5.69195 2.55172 -115.35759 914.12888
FREEZING PROCESS: loop number 13 T-loop= 881.00000000000000
main_MD> interactions number 13 at Temperature= 881.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.40754 -2.94073 -0.90168
force_rgl> df(natom) 0.24075 0.48504 1.83740
3005.0000 -122.35322 -116.83879 5.51442 2.46569 -116.54071 858.44212
3010.0000 -121.28466 -114.84196 6.44270 2.46515 -116.54818 830.64175
3015.0000 -120.99145 -115.13222 5.85923 2.60757 -114.58949 931.50651
3020.0000 -122.04342 -115.79887 6.24455 2.56191 -115.21752 941.55826
3025.0000 -122.35346 -117.16701 5.18645 2.46595 -116.53711 872.71787
3030.0000 -121.77482 -117.13718 4.63764 2.43853 -116.91417 846.00455
3035.0000 -121.89860 -116.49587 5.40273 2.43081 -117.02046 777.18851
3040.0000 -120.26848 -115.20328 5.06519 2.44078 -116.88328 863.34013
3045.0000 -121.99766 -116.34197 5.65569 2.51342 -115.88426 880.95478
3050.0000 -121.97862 -115.09003 6.88859 2.51668 -115.83949 892.28593
3055.0000 -120.61985 -114.29699 6.32286 2.56198 -115.21649 928.45461
3060.0000 -120.51174 -113.54869 6.96305 2.61000 -114.55604 974.39780
3065.0000 -122.07882 -117.78688 4.29194 2.51764 -115.82632 919.53008
3070.0000 -122.43521 -117.05842 5.37678 2.36733 -117.89347 773.76990
3075.0000 -120.70916 -115.56179 5.14737 2.44184 -116.86875 827.40528
3080.0000 -122.37050 -115.80045 6.57005 2.56047 -115.23726 929.91545
3085.0000 -120.45647 -114.63927 5.81720 2.57507 -115.03641 925.75542
3090.0000 -120.48010 -114.78160 5.69849 2.64132 -114.12540 956.12598
3095.0000 -122.88047 -116.90390 5.97657 2.50662 -115.97783 866.11599
3100.0000 -122.23957 -116.25282 5.98675 2.47047 -116.47493 827.49686
3105.0000 -122.02394 -116.45724 5.56671 2.45897 -116.63308 841.48226
3110.0000 -122.22857 -117.60472 4.62385 2.42612 -117.08492 821.00567
3115.0000 -121.29253 -115.35496 5.93757 2.42403 -117.11362 814.83451
3120.0000 -121.79046 -116.23947 5.55099 2.54247 -115.48475 884.89747
3125.0000 -122.57750 -117.28051 5.29699 2.38927 -117.59167 801.38381
3130.0000 -121.48506 -115.79483 5.69024 2.38455 -117.65661 809.30186
3135.0000 -119.71281 -114.40385 5.30896 2.57786 -114.99817 936.15591
3140.0000 -122.41667 -116.88904 5.52762 2.53080 -115.64534 879.56358
3145.0000 -122.50340 -116.62936 5.87403 2.49960 -116.07432 884.62844
3150.0000 -121.91405 -116.94945 4.96460 2.46854 -116.50148 862.49247
3155.0000 -122.87108 -117.87278 4.99830 2.35302 -118.09017 763.53038
3160.0000 -121.57739 -115.93948 5.63791 2.44450 -116.83210 810.59678
3165.0000 -122.38760 -117.16623 5.22138 2.41715 -117.20826 827.20009
3170.0000 -120.73418 -113.77622 6.95797 2.54037 -115.51372 925.06582
3175.0000 -118.81064 -113.19148 5.61916 2.69681 -113.36228 1014.95221
3180.0000 -120.22220 -113.14647 7.07572 2.70288 -113.27876 999.53126
3185.0000 -120.87653 -115.12245 5.75407 2.62749 -114.31562 965.09434
3190.0000 -121.09302 -115.01665 6.07637 2.55958 -115.24943 926.64645
3195.0000 -122.23556 -116.29563 5.93994 2.53403 -115.60094 912.99599
3200.0000 -121.32818 -116.25213 5.07605 2.48241 -116.31078 840.86863
3205.0000 -120.24168 -115.65819 4.58349 2.46783 -116.51135 838.58939
3210.0000 -121.64369 -117.05548 4.58821 2.50256 -116.03362 873.12798
3215.0000 -122.19190 -115.97324 6.21865 2.50110 -116.05374 854.10490
3220.0000 -121.92963 -116.08052 5.84911 2.52431 -115.73457 859.15909
3225.0000 -123.90597 -117.53050 6.37547 2.45646 -116.66764 859.94517
3230.0000 -121.96675 -115.86678 6.09997 2.43269 -116.99452 846.57501
3235.0000 -123.02173 -117.39443 5.62729 2.49973 -116.07255 878.06236
3240.0000 -122.78979 -116.93628 5.85351 2.43080 -117.02051 836.66001
3245.0000 -121.41018 -116.12402 5.28615 2.51163 -115.90895 931.13979
3250.0000 -121.93050 -116.15237 5.77814 2.50011 -116.06740 895.70709
FREEZING PROCESS: loop number 14 T-loop= 856.00000000000000
main_MD> interactions number 14 at Temperature= 856.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.18005 -2.42411 0.69760
force_rgl> df(natom) -2.32551 0.22365 2.81655
3255.0000 -123.36022 -117.68993 5.67028 2.42256 -117.13380 823.57676
3260.0000 -121.62696 -115.48120 6.14575 2.44845 -116.77782 868.02925
3265.0000 -122.04464 -116.60107 5.44357 2.53852 -115.53912 914.94858
3270.0000 -122.31799 -115.46737 6.85062 2.50305 -116.02694 907.87030
3275.0000 -121.36706 -116.89384 4.47323 2.49381 -116.15400 885.83867
3280.0000 -122.44629 -115.23466 7.21163 2.49799 -116.09645 857.91450
3285.0000 -122.67342 -116.59910 6.07431 2.49901 -116.08248 904.71795
3290.0000 -122.82530 -116.64977 6.17553 2.47838 -116.36621 871.98613
3295.0000 -123.15985 -117.75695 5.40290 2.41813 -117.19480 819.01157
3300.0000 -121.61138 -116.54156 5.06982 2.43225 -117.00056 829.64757
3305.0000 -122.66101 -118.00504 4.65597 2.43501 -116.96265 815.68338
3310.0000 -122.65508 -117.03774 5.61734 2.41295 -117.26602 822.01956
3315.0000 -123.60989 -118.15238 5.45750 2.36348 -117.94637 790.26555
3320.0000 -122.95589 -118.17979 4.77610 2.33858 -118.28874 764.92497
3325.0000 -122.75925 -116.61231 6.14693 2.40836 -117.32909 827.65987
3330.0000 -122.41208 -116.63536 5.77672 2.44296 -116.85331 889.33903
3335.0000 -122.44754 -116.72137 5.72617 2.47339 -116.43489 856.02079
3340.0000 -122.76020 -117.65240 5.10780 2.38612 -117.63497 784.70619
3345.0000 -120.75602 -116.11658 4.63944 2.47347 -116.43377 849.24655
3350.0000 -122.48382 -115.39693 7.08688 2.50678 -115.97558 868.11092
3355.0000 -122.17942 -116.31417 5.86525 2.51122 -115.91456 882.72410
3360.0000 -121.88596 -114.67757 7.20839 2.45795 -116.64712 833.67899
3365.0000 -120.93710 -114.42856 6.50854 2.53623 -115.57058 895.71110
3370.0000 -121.17691 -114.90801 6.26890 2.58952 -114.83780 937.77008
3375.0000 -121.54435 -116.30474 5.23961 2.53834 -115.54159 911.13610
3380.0000 -123.18258 -117.88048 5.30210 2.43174 -117.00767 847.38385
3385.0000 -121.72041 -115.70998 6.01043 2.43511 -116.96122 849.33527
3390.0000 -122.77198 -116.66203 6.10994 2.53033 -115.65174 904.45542
3395.0000 -123.53471 -118.29988 5.23483 2.38306 -117.67710 787.16753
3400.0000 -122.63220 -117.10937 5.52283 2.36894 -117.87132 772.49009
3405.0000 -122.83990 -117.61357 5.22633 2.41876 -117.18616 808.76644
3410.0000 -122.32780 -117.61075 4.71705 2.39272 -117.54426 788.79058
3415.0000 -122.12579 -116.15963 5.96616 2.45408 -116.70045 853.62344
3420.0000 -121.03905 -114.90533 6.13373 2.53552 -115.58042 916.49780
3425.0000 -121.34118 -115.57831 5.76287 2.52617 -115.70894 876.00333
3430.0000 -122.34853 -116.56524 5.78329 2.50178 -116.04435 862.46508
3435.0000 -122.90426 -117.19407 5.71020 2.44136 -116.87528 832.74120
3440.0000 -121.17908 -115.62408 5.55501 2.50287 -116.02940 890.20800
3445.0000 -120.57659 -113.70653 6.87006 2.60172 -114.66993 964.90315
3450.0000 -121.27243 -113.62343 7.64899 2.66016 -113.86633 1033.59047
3455.0000 -119.78436 -114.35576 5.42860 2.66012 -113.86687 1015.83552
3460.0000 -121.52066 -115.90389 5.61677 2.55268 -115.34438 918.56940
3465.0000 -122.40202 -117.13189 5.27013 2.44721 -116.79486 841.69632
3470.0000 -122.25281 -116.58976 5.66305 2.47630 -116.39477 861.77136
3475.0000 -122.82174 -117.02926 5.79248 2.44969 -116.76075 826.52371
3480.0000 -122.00153 -116.40267 5.59886 2.44057 -116.88611 776.80419
3485.0000 -121.34604 -115.12211 6.22393 2.53104 -115.64201 916.98687
3490.0000 -122.82109 -116.56918 6.25191 2.52708 -115.69647 884.79690
3495.0000 -120.63757 -114.62833 6.00924 2.48910 -116.21883 861.46263
3500.0000 -121.76206 -115.78670 5.97536 2.56093 -115.23091 950.01469
FREEZING PROCESS: loop number 15 T-loop= 831.00000000000000
main_MD> interactions number 15 at Temperature= 831.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.34476 0.01452 -4.35684
force_rgl> df(natom) -0.55585 -2.73118 -1.81992
3505.0000 -122.80588 -116.69392 6.11196 2.48535 -116.27031 880.06243
3510.0000 -121.91998 -117.20473 4.71525 2.39915 -117.45582 803.34440
3515.0000 -121.81132 -116.04206 5.76927 2.42788 -117.06073 839.07677
3520.0000 -123.44076 -115.97515 7.46561 2.45746 -116.65385 865.37758
3525.0000 -122.20042 -117.12478 5.07564 2.46191 -116.59274 854.14560
3530.0000 -122.15039 -116.12392 6.02647 2.44356 -116.84500 845.75807
3535.0000 -122.04122 -116.53335 5.50787 2.51552 -115.85546 885.52983
3540.0000 -122.56014 -117.06853 5.49161 2.42766 -117.06366 831.29698
3545.0000 -122.13560 -118.02631 4.10928 2.39024 -117.57832 789.46557
3550.0000 -122.73351 -116.60692 6.12659 2.41233 -117.27457 798.45205
3555.0000 -122.78962 -118.14880 4.64082 2.46689 -116.52417 899.93522
3560.0000 -122.51518 -116.43346 6.08172 2.41351 -117.25835 778.93040
3565.0000 -121.88495 -115.95354 5.93140 2.49771 -116.10033 861.97811
3570.0000 -120.22256 -113.96186 6.26071 2.58585 -114.88816 958.81958
3575.0000 -120.53245 -114.31352 6.21892 2.62278 -114.38037 989.61607
3580.0000 -122.16032 -115.68639 6.47393 2.58418 -114.91119 958.17175
3585.0000 -122.16400 -116.81941 5.34459 2.47187 -116.45576 861.90546
3590.0000 -121.53217 -116.85065 4.68152 2.41868 -117.18723 813.97142
3595.0000 -122.27034 -117.11001 5.16033 2.44001 -116.89388 822.32360
3600.0000 -124.06822 -118.42632 5.64190 2.40184 -117.41880 799.23054
3605.0000 -121.98652 -116.55333 5.43319 2.37821 -117.74384 793.56031
3610.0000 -122.95358 -117.66694 5.28664 2.41886 -117.18481 812.91750
3615.0000 -122.72979 -116.95882 5.77096 2.45478 -116.69076 877.18832
3620.0000 -123.00052 -117.60407 5.39645 2.39082 -117.57037 808.74475
3625.0000 -122.86135 -118.09761 4.76374 2.37125 -117.83949 766.80709
3630.0000 -122.16751 -115.86006 6.30744 2.43417 -116.97414 817.18805
3635.0000 -121.17177 -116.00386 5.16791 2.50629 -115.98241 901.18841
3640.0000 -123.12310 -118.20648 4.91662 2.42986 -117.03345 797.68866
3645.0000 -122.78957 -117.77566 5.01392 2.37230 -117.82508 763.51214
3650.0000 -121.70421 -116.40913 5.29507 2.44074 -116.88379 801.52261
3655.0000 -120.56652 -115.23474 5.33178 2.50242 -116.03562 857.65518
3660.0000 -121.40390 -115.90635 5.49756 2.52057 -115.78602 885.97731
3665.0000 -122.54490 -115.87713 6.66776 2.53482 -115.59006 910.81903
3670.0000 -122.08993 -116.58450 5.50543 2.48372 -116.29280 839.02063
3675.0000 -121.91112 -116.91463 4.99649 2.46233 -116.58696 856.01571
3680.0000 -123.53602 -119.01898 4.51704 2.32879 -118.42338 764.50346
3685.0000 -121.98341 -117.49882 4.48459 2.33259 -118.37120 766.61418
3690.0000 -122.57972 -116.87766 5.70206 2.37023 -117.85352 794.73307
3695.0000 -122.44838 -117.01581 5.43257 2.45070 -116.74692 832.18750
3700.0000 -123.37631 -119.00430 4.37201 2.37254 -117.82176 782.82865
3705.0000 -122.83000 -116.73786 6.09214 2.38326 -117.67435 815.52731
3710.0000 -120.94046 -115.90756 5.03289 2.47361 -116.43187 844.59200
3715.0000 -122.05310 -117.27548 4.77762 2.46596 -116.53705 858.27782
3720.0000 -123.41320 -116.94615 6.46705 2.42722 -117.06972 826.50428
3725.0000 -123.51172 -117.84728 5.66443 2.36505 -117.92474 779.56043
3730.0000 -121.94977 -115.69687 6.25291 2.46336 -116.57271 865.52413
3735.0000 -121.81543 -115.90385 5.91157 2.51703 -115.83460 882.77291
3740.0000 -122.31074 -116.46772 5.84302 2.45500 -116.68777 852.88051
3745.0000 -120.92012 -115.61131 5.30882 2.51056 -115.92371 882.68050
3750.0000 -121.04440 -114.80468 6.23972 2.57979 -114.97159 923.45532
FREEZING PROCESS: loop number 16 T-loop= 806.00000000000000
main_MD> interactions number 16 at Temperature= 806.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.28589 2.82569 -1.17375
force_rgl> df(natom) -0.30895 1.11320 -0.83305
3755.0000 -122.87260 -117.38415 5.48846 2.46888 -116.49692 866.71725
3760.0000 -121.10875 -117.16969 3.93906 2.36481 -117.92800 783.67357
3765.0000 -123.31846 -118.84841 4.47006 2.33818 -118.29427 762.04171
3770.0000 -123.43381 -118.39342 5.04039 2.30402 -118.76404 752.45135
3775.0000 -122.55740 -117.01801 5.53938 2.38677 -117.62606 805.68444
3780.0000 -123.25717 -118.38156 4.87561 2.41851 -117.18961 835.34637
3785.0000 -123.35430 -117.60804 5.74627 2.35783 -118.02410 761.96810
3790.0000 -121.92605 -116.85345 5.07259 2.38074 -117.70905 789.22274
3795.0000 -122.16779 -116.62858 5.53921 2.49383 -116.15376 894.00660
3800.0000 -122.53259 -116.41515 6.11745 2.51454 -115.86890 908.76839
3805.0000 -120.89425 -115.24974 5.64451 2.51298 -115.89037 896.82503
3810.0000 -122.00029 -116.34668 5.65361 2.46476 -116.55349 854.40776
3815.0000 -123.11513 -117.02752 6.08760 2.46378 -116.56698 869.64329
3820.0000 -123.02578 -116.32196 6.70382 2.48415 -116.28678 855.83539
3825.0000 -123.90776 -117.60328 6.30447 2.47370 -116.43052 881.62670
3830.0000 -122.95174 -117.89283 5.05891 2.34099 -118.25559 759.34299
3835.0000 -122.26026 -117.73474 4.52552 2.40901 -117.32025 825.74930
3840.0000 -122.59409 -118.18009 4.41400 2.38514 -117.64847 768.83278
3845.0000 -123.34891 -118.20742 5.14149 2.32160 -118.52228 738.00193
3850.0000 -122.43191 -117.79437 4.63754 2.31820 -118.56912 734.00703
3855.0000 -121.45815 -115.26450 6.19365 2.41209 -117.27789 854.29636
3860.0000 -124.21019 -117.05982 7.15037 2.49033 -116.20188 882.99254
3865.0000 -123.20547 -117.11700 6.08847 2.44987 -116.75825 842.97319
3870.0000 -122.21206 -116.17048 6.04158 2.43967 -116.89851 861.88417
3875.0000 -122.59123 -117.70200 4.88923 2.45569 -116.67827 837.02324
3880.0000 -122.58087 -117.96242 4.61845 2.38199 -117.69180 803.03346
3885.0000 -122.64320 -117.41254 5.23066 2.36499 -117.92565 804.30620
3890.0000 -122.03347 -117.28511 4.74837 2.41017 -117.30425 793.81136
3895.0000 -123.17376 -117.85358 5.32018 2.35588 -118.05093 767.53537
3900.0000 -122.10309 -116.83962 5.26347 2.37432 -117.79730 759.68943
3905.0000 -123.06545 -116.44825 6.61719 2.48288 -116.30433 878.10336
3910.0000 -122.87459 -116.53439 6.34020 2.48262 -116.30795 857.92396
3915.0000 -122.17608 -116.96901 5.20707 2.42943 -117.03943 830.82685
3920.0000 -123.67899 -118.50104 5.17796 2.32800 -118.43431 758.13533
3925.0000 -122.91741 -118.79410 4.12331 2.32670 -118.45220 773.31231
3930.0000 -123.87505 -118.96585 4.90920 2.32055 -118.53680 738.28722
3935.0000 -122.89116 -118.81960 4.07157 2.34881 -118.14817 748.40886
3940.0000 -123.82882 -117.66595 6.16287 2.37361 -117.80701 768.30871
3945.0000 -122.79517 -117.63319 5.16198 2.40815 -117.33207 793.44154
3950.0000 -123.10988 -118.78472 4.32516 2.34892 -118.14656 730.60411
3955.0000 -123.50211 -118.86757 4.63454 2.28463 -119.03077 724.79991
3960.0000 -123.48938 -117.85301 5.63637 2.33567 -118.32880 757.35709
3965.0000 -122.73746 -117.62216 5.11530 2.39643 -117.49318 807.36584
3970.0000 -122.39128 -117.45663 4.93465 2.42202 -117.14133 831.07157
3975.0000 -123.38482 -117.96434 5.42048 2.36674 -117.90158 808.19522
3980.0000 -123.16904 -117.64294 5.52610 2.39906 -117.45701 828.74265
3985.0000 -123.32095 -117.57891 5.74204 2.40519 -117.37275 818.06931
3990.0000 -123.68512 -118.79862 4.88650 2.37699 -117.76056 814.55570
3995.0000 -122.99847 -117.11387 5.88460 2.36176 -117.97004 811.46646
4000.0000 -122.50387 -116.92177 5.58210 2.43664 -116.94020 836.96503
FREEZING PROCESS: loop number 17 T-loop= 781.00000000000000
main_MD> interactions number 17 at Temperature= 781.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.27091 -1.80540 3.05097
force_rgl> df(natom) 4.44539 -2.79526 0.33764
4005.0000 -123.14285 -118.08744 5.05540 2.40600 -117.36156 817.13664
4010.0000 -123.32646 -118.60761 4.71885 2.32701 -118.44785 726.26724
4015.0000 -124.27657 -119.85941 4.41716 2.22974 -119.78568 656.72401
4020.0000 -123.58367 -119.29976 4.28391 2.23991 -119.64577 699.62764
4025.0000 -123.38730 -119.05208 4.33522 2.33201 -118.37920 762.54564
4030.0000 -124.63070 -119.07880 5.55190 2.28643 -119.00595 763.52565
4035.0000 -124.59640 -119.09420 5.50220 2.30535 -118.74579 743.73469
4040.0000 -123.38654 -118.90994 4.47660 2.27599 -119.14962 745.07552
4045.0000 -122.68294 -118.58893 4.09400 2.25698 -119.41102 692.37108
4050.0000 -123.10150 -117.10086 6.00064 2.36804 -117.88363 765.92485
4055.0000 -123.27788 -116.95654 6.32134 2.40953 -117.31311 852.10364
4060.0000 -122.98873 -117.85575 5.13298 2.39207 -117.55317 801.91196
4065.0000 -123.45205 -119.11829 4.33376 2.35279 -118.09337 777.07255
4070.0000 -122.01674 -117.88594 4.13080 2.31304 -118.64002 740.98821
4075.0000 -122.21759 -115.97692 6.24067 2.37566 -117.77884 783.83217
4080.0000 -123.44146 -118.51613 4.92532 2.44263 -116.85780 828.05381
4085.0000 -122.89404 -117.80031 5.09373 2.36360 -117.94465 776.23335
4090.0000 -122.20138 -116.83669 5.36469 2.37605 -117.77347 797.79279
4095.0000 -122.94489 -117.95068 4.99421 2.41606 -117.22319 809.21153
4100.0000 -123.11378 -118.43979 4.67399 2.30703 -118.72263 718.46301
4105.0000 -122.89327 -117.68980 5.20348 2.39749 -117.47867 762.54996
4110.0000 -123.00812 -117.57239 5.43572 2.36498 -117.92579 753.84806
4115.0000 -124.36865 -119.38009 4.98857 2.31475 -118.61648 750.73366
4120.0000 -123.94645 -118.93798 5.00848 2.23730 -119.68161 686.61359
4125.0000 -124.32782 -119.53498 4.79284 2.29775 -118.85035 702.25020
4130.0000 -123.05509 -118.09197 4.96312 2.29393 -118.90278 728.34873
4135.0000 -122.51913 -117.79421 4.72492 2.36761 -117.88959 791.52686
4140.0000 -122.38573 -117.34678 5.03894 2.35539 -118.05767 755.19555
4145.0000 -122.12338 -117.97445 4.14893 2.37812 -117.74500 790.80591
4150.0000 -123.45400 -118.75440 4.69960 2.34922 -118.14243 776.32216
4155.0000 -122.66030 -117.05730 5.60301 2.37398 -117.80201 801.89427
4160.0000 -122.82703 -118.03635 4.79068 2.39266 -117.54499 801.23444
4165.0000 -122.54731 -116.93760 5.60971 2.34996 -118.13236 762.09276
4170.0000 -122.38190 -117.51950 4.86240 2.45461 -116.69312 837.07290
4175.0000 -123.40767 -118.65255 4.75512 2.38342 -117.67213 795.57876
4180.0000 -123.07189 -118.26265 4.80923 2.31202 -118.65412 741.15075
4185.0000 -124.44195 -119.29467 5.14728 2.31199 -118.65452 729.99024
4190.0000 -122.44574 -117.94673 4.49901 2.33906 -118.28215 761.39354
4195.0000 -123.13152 -117.42304 5.70848 2.35012 -118.13013 744.57633
4200.0000 -122.83348 -118.16078 4.67270 2.34456 -118.20650 753.57239
4205.0000 -123.27408 -118.00418 5.26990 2.32766 -118.43895 711.45218
4210.0000 -123.47972 -118.90523 4.57449 2.30614 -118.73497 743.96160
4215.0000 -123.30411 -117.99120 5.31291 2.30242 -118.78608 751.22649
4220.0000 -122.60995 -117.67919 4.93075 2.36785 -117.88632 796.97409
4225.0000 -123.13414 -117.52535 5.60879 2.35507 -118.06206 775.65180
4230.0000 -122.32608 -117.29573 5.03036 2.39404 -117.52608 787.32167
4235.0000 -121.72223 -116.72474 4.99749 2.37674 -117.76402 796.28265
4240.0000 -122.99905 -116.91582 6.08322 2.46841 -116.50328 860.30579
4245.0000 -122.75934 -116.70786 6.05148 2.45731 -116.65597 866.45132
4250.0000 -122.22589 -115.85465 6.37124 2.49124 -116.18937 850.19756
FREEZING PROCESS: loop number 18 T-loop= 756.00000000000000
main_MD> interactions number 18 at Temperature= 756.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.38314 1.29986 -0.39552
force_rgl> df(natom) 1.91217 1.02876 -3.72128
4255.0000 -124.07551 -120.03345 4.04206 2.35400 -118.07673 780.86026
4260.0000 -123.81623 -118.65846 5.15777 2.27028 -119.22802 703.89824
4265.0000 -123.38777 -119.20093 4.18685 2.31383 -118.62913 763.24727
4270.0000 -122.45711 -118.12473 4.33238 2.34805 -118.15859 724.69311
4275.0000 -123.44639 -117.95062 5.49576 2.34633 -118.18216 766.79268
4280.0000 -123.99441 -118.16593 5.82847 2.36782 -117.88661 768.09110
4285.0000 -123.38321 -118.92954 4.45366 2.31254 -118.64697 740.46247
4290.0000 -122.45616 -118.57361 3.88255 2.25539 -119.43282 690.45160
4295.0000 -123.95740 -119.47626 4.48114 2.28208 -119.06583 697.06025
4300.0000 -122.48064 -117.81403 4.66661 2.28971 -118.96086 708.50581
4305.0000 -122.71961 -117.87297 4.84665 2.39611 -117.49758 795.43916
4310.0000 -123.72334 -118.04001 5.68333 2.30008 -118.81829 693.99816
4315.0000 -123.67702 -118.15951 5.51751 2.37967 -117.72365 802.02203
4320.0000 -122.54408 -117.39789 5.14619 2.36066 -117.98509 773.34434
4325.0000 -123.03988 -117.93815 5.10173 2.36504 -117.92494 736.92541
4330.0000 -123.85945 -118.71544 5.14402 2.33380 -118.35459 739.97615
4335.0000 -122.22304 -117.80572 4.41731 2.31652 -118.59223 725.78511
4340.0000 -122.92717 -117.65188 5.27529 2.42070 -117.15946 817.76929
4345.0000 -121.47745 -116.31826 5.15918 2.42807 -117.05815 794.89854
4350.0000 -121.15546 -115.85785 5.29761 2.47820 -116.36864 841.75132
4355.0000 -122.73029 -117.92542 4.80487 2.45310 -116.71382 817.66154
4360.0000 -124.06304 -119.18683 4.87621 2.35471 -118.06692 760.84490
4365.0000 -123.64680 -118.76938 4.87742 2.24868 -119.52509 706.22294
4370.0000 -123.72253 -118.07193 5.65059 2.31055 -118.67433 760.04354
4375.0000 -123.88313 -119.88378 3.99935 2.28666 -119.00287 749.72750
4380.0000 -122.33234 -117.29975 5.03259 2.27348 -119.18410 720.11619
4385.0000 -122.94883 -117.94251 5.00632 2.38896 -117.59596 769.74402
4390.0000 -124.14914 -120.01730 4.13184 2.25772 -119.40076 710.24623
4395.0000 -123.36673 -119.83275 3.53398 2.27827 -119.11817 720.02562
4400.0000 -123.26256 -118.74554 4.51702 2.28273 -119.05681 718.57327
4405.0000 -123.43119 -119.49700 3.93420 2.24567 -119.56647 703.51524
4410.0000 -122.20847 -118.28119 3.92728 2.31633 -118.59475 757.06969
4415.0000 -123.57636 -117.54651 6.02985 2.38128 -117.70157 768.94005
4420.0000 -123.69701 -118.65480 5.04221 2.36347 -117.94644 793.39203
4425.0000 -122.45301 -117.59442 4.85859 2.35888 -118.00962 743.58013
4430.0000 -123.54998 -118.47824 5.07173 2.33707 -118.30959 736.59713
4435.0000 -124.33062 -119.10557 5.22505 2.33097 -118.39343 736.41913
4440.0000 -122.99016 -118.12542 4.86473 2.33745 -118.30439 765.33854
4445.0000 -124.56232 -119.92159 4.64074 2.28352 -119.04602 738.84400
4450.0000 -123.78857 -119.09784 4.69073 2.27390 -119.17835 720.21819
4455.0000 -123.17579 -118.75552 4.42027 2.29461 -118.89354 727.71186
4460.0000 -123.51989 -118.64043 4.87946 2.28814 -118.98253 727.51094
4465.0000 -122.98605 -118.37439 4.61166 2.31510 -118.61168 769.59886
4470.0000 -123.13123 -118.54721 4.58402 2.34923 -118.14228 763.56635
4475.0000 -124.69589 -120.63983 4.05606 2.18721 -120.37057 636.02235
4480.0000 -124.48989 -120.11223 4.37765 2.15153 -120.86118 608.33920
4485.0000 -123.45609 -118.86720 4.58889 2.28840 -118.97885 704.65672
4490.0000 -123.37968 -118.61062 4.76905 2.30455 -118.75672 764.18266
4495.0000 -124.11765 -119.49484 4.62280 2.29347 -118.90918 731.68862
4500.0000 -122.07486 -117.38061 4.69425 2.31283 -118.64286 743.39030
FREEZING PROCESS: loop number 19 T-loop= 731.00000000000000
main_MD> interactions number 19 at Temperature= 731.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.34606 1.18777 -1.65761
force_rgl> df(natom) 2.80814 -2.42938 -0.11590
4505.0000 -124.08678 -119.18056 4.90621 2.28537 -119.02061 705.17527
4510.0000 -123.04742 -117.81642 5.23100 2.33084 -118.39528 752.63128
4515.0000 -122.37863 -116.82500 5.55362 2.36970 -117.86080 797.62070
4520.0000 -122.58196 -117.39882 5.18314 2.39218 -117.55168 776.30333
4525.0000 -124.26291 -118.85087 5.41204 2.31682 -118.58806 746.79636
4530.0000 -123.98367 -119.75207 4.23160 2.27734 -119.13102 737.21164
4535.0000 -123.85326 -118.81346 5.03980 2.31075 -118.67150 742.73704
4540.0000 -123.99731 -119.21857 4.77874 2.29160 -118.93482 742.50327
4545.0000 -124.15524 -118.94351 5.21173 2.27193 -119.20541 734.11675
4550.0000 -124.28445 -119.89602 4.38843 2.28389 -119.04098 719.68338
4555.0000 -123.22958 -117.93154 5.29804 2.32896 -118.42107 747.71912
4560.0000 -122.76267 -117.61425 5.14842 2.41695 -117.21100 794.14143
4565.0000 -123.91539 -119.40203 4.51336 2.32874 -118.42418 750.63914
4570.0000 -123.46941 -118.48522 4.98419 2.28292 -119.05428 695.01444
4575.0000 -124.38476 -119.58953 4.79523 2.24581 -119.56454 700.09004
4580.0000 -123.78613 -118.48967 5.29646 2.26462 -119.30597 706.87509
4585.0000 -124.87621 -121.17637 3.69984 2.18706 -120.37261 640.84902
4590.0000 -124.60055 -120.85999 3.74056 2.14555 -120.94340 625.64638
4595.0000 -124.00930 -120.41997 3.58934 2.16565 -120.66695 636.56776
4600.0000 -124.24469 -119.82051 4.42418 2.18110 -120.45449 636.10191
4605.0000 -123.67503 -119.13156 4.54347 2.27416 -119.17470 718.11791
4610.0000 -123.78468 -118.65555 5.12912 2.29866 -118.83777 711.95796
4615.0000 -123.02815 -117.73999 5.28817 2.31821 -118.56898 736.37937
4620.0000 -124.15586 -119.15264 5.00323 2.35142 -118.11227 750.75450
4625.0000 -124.10328 -119.36906 4.73422 2.27051 -119.22486 712.52010
4630.0000 -123.98834 -120.25212 3.73622 2.22869 -119.80003 684.66568
4635.0000 -123.09846 -119.23741 3.86105 2.21557 -119.98044 685.95138
4640.0000 -123.85839 -119.48027 4.37812 2.24693 -119.54922 710.75566
4645.0000 -123.73918 -119.13286 4.60632 2.25988 -119.37108 711.30769
4650.0000 -124.51886 -120.46615 4.05271 2.24966 -119.51167 701.42595
4655.0000 -123.54861 -119.01821 4.53040 2.26654 -119.27946 714.53621
4660.0000 -123.53728 -119.06890 4.46838 2.26032 -119.36510 705.83872
4665.0000 -123.10184 -118.71793 4.38391 2.32635 -118.45705 735.33143
4670.0000 -123.57859 -117.41568 6.16291 2.36860 -117.87598 763.86354
4675.0000 -122.49819 -116.88777 5.61042 2.44145 -116.87408 858.76500
4680.0000 -123.39228 -118.09216 5.30012 2.42597 -117.08691 809.34831
4685.0000 -123.14646 -117.87735 5.26912 2.32477 -118.47877 741.61113
4690.0000 -124.01877 -119.72055 4.29822 2.28500 -119.02570 715.94749
4695.0000 -124.59261 -118.68858 5.90403 2.28833 -118.97981 736.41018
4700.0000 -123.24156 -118.80188 4.43968 2.27389 -119.17844 713.67094
4705.0000 -124.55288 -120.40177 4.15111 2.22387 -119.86635 664.14462
4710.0000 -124.02903 -119.76975 4.25928 2.22612 -119.83533 668.44107
4715.0000 -123.47288 -118.04027 5.43260 2.36816 -117.88194 764.40071
4720.0000 -123.51500 -118.52766 4.98734 2.30890 -118.69697 711.64100
4725.0000 -124.34943 -119.65560 4.69383 2.27475 -119.16666 719.54198
4730.0000 -123.92339 -118.83647 5.08692 2.27203 -119.20407 712.58207
4735.0000 -124.12374 -119.85877 4.26496 2.26425 -119.31095 712.27868
4740.0000 -124.73074 -120.03547 4.69527 2.23659 -119.69134 696.05468
4745.0000 -123.82640 -118.82596 5.00044 2.23465 -119.71815 688.80207
4750.0000 -123.94792 -120.13221 3.81571 2.26069 -119.36003 708.81368
FREEZING PROCESS: loop number 20 T-loop= 706.00000000000000
main_MD> interactions number 20 at Temperature= 706.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.02263 0.09090 -1.59201
force_rgl> df(natom) -3.37312 -0.30046 -2.33136
4755.0000 -123.71377 -119.83859 3.87518 2.20639 -120.10666 676.40040
4760.0000 -123.69958 -118.30247 5.39711 2.25853 -119.38966 688.87674
4765.0000 -124.05455 -118.98230 5.07225 2.28972 -118.96073 703.57862
4770.0000 -124.25426 -119.35924 4.89503 2.25300 -119.46567 682.59431
4775.0000 -123.81467 -118.60045 5.21422 2.28483 -119.02800 719.63927
4780.0000 -124.60529 -119.80553 4.79976 2.23407 -119.72613 694.07128
4785.0000 -124.65269 -118.65966 5.99303 2.22983 -119.78444 691.54653
4790.0000 -125.26206 -119.95774 5.30431 2.25263 -119.47085 687.77308
4795.0000 -124.64259 -120.18910 4.45349 2.28235 -119.06204 738.96855
4800.0000 -124.21499 -119.64629 4.56871 2.20198 -120.16744 652.17229
4805.0000 -125.04664 -120.80892 4.23773 2.20376 -120.14294 683.54768
4810.0000 -124.99706 -120.93851 4.05856 2.14432 -120.96029 624.12370
4815.0000 -124.10292 -119.65242 4.45050 2.19590 -120.25096 629.85655
4820.0000 -124.26330 -118.67672 5.58658 2.27262 -119.19589 710.25226
4825.0000 -123.11584 -118.27136 4.84448 2.33192 -118.38044 729.74470
4830.0000 -123.63670 -119.04662 4.59008 2.27686 -119.13762 703.80172
4835.0000 -123.67247 -119.44793 4.22454 2.26251 -119.33494 709.90591
4840.0000 -124.81702 -119.76633 5.05069 2.24102 -119.63049 688.34000
4845.0000 -124.24393 -120.15712 4.08680 2.21726 -119.95717 668.51329
4850.0000 -122.30808 -117.36347 4.94462 2.30782 -118.71176 728.76298
4855.0000 -122.85349 -117.89164 4.96185 2.37476 -117.79127 761.61461
4860.0000 -122.57889 -117.51777 5.06112 2.37318 -117.81296 819.61587
4865.0000 -123.86191 -119.73284 4.12906 2.30655 -118.72922 736.79049
4870.0000 -124.23817 -120.02903 4.20914 2.18168 -120.44656 640.13246
4875.0000 -124.26012 -119.19346 5.06665 2.26199 -119.34209 724.19963
4880.0000 -122.95910 -119.27958 3.67951 2.25245 -119.47326 717.38225
4885.0000 -123.01664 -119.08075 3.93589 2.30514 -118.74863 718.66313
4890.0000 -124.34338 -119.46761 4.87577 2.25958 -119.37524 660.44437
4895.0000 -124.19885 -120.20612 3.99273 2.24540 -119.57030 654.29895
4900.0000 -124.21350 -119.94145 4.27205 2.24950 -119.51382 633.43913
4905.0000 -124.32341 -119.70718 4.61623 2.21343 -120.00992 660.68017
4910.0000 -124.35588 -119.58219 4.77369 2.27182 -119.20695 714.63583
4915.0000 -123.80558 -119.47181 4.33377 2.27159 -119.21010 714.72433
4920.0000 -123.01695 -117.91803 5.09892 2.28016 -119.09223 724.82530
4925.0000 -124.23148 -118.33465 5.89683 2.34805 -118.15856 750.86766
4930.0000 -123.35185 -118.31054 5.04131 2.35279 -118.09336 770.85665
4935.0000 -124.05818 -118.42272 5.63547 2.31637 -118.59424 758.69918
4940.0000 -124.34264 -119.01214 5.33050 2.35884 -118.01017 785.45139
4945.0000 -124.66757 -120.53655 4.13102 2.19554 -120.25588 658.34096
4950.0000 -123.83078 -118.71612 5.11467 2.25899 -119.38329 687.05033
4955.0000 -123.07895 -118.49577 4.58318 2.28115 -119.07854 702.51439
4960.0000 -124.26320 -119.99492 4.26827 2.25455 -119.44439 718.13740
4965.0000 -123.71803 -119.02634 4.69168 2.23777 -119.67516 665.98989
4970.0000 -124.57790 -119.40308 5.17482 2.25328 -119.46188 712.67416
4975.0000 -124.35585 -119.75995 4.59591 2.22104 -119.90523 658.60786
4980.0000 -123.38566 -117.75096 5.63470 2.31777 -118.57502 761.00775
4985.0000 -122.51807 -117.81483 4.70323 2.37819 -117.74410 763.92134
4990.0000 -123.90224 -117.99369 5.90855 2.35819 -118.01906 771.44771
4995.0000 -122.74191 -118.09995 4.64196 2.34233 -118.23728 733.41258
5000.0000 -123.94791 -119.38813 4.55977 2.28829 -118.98037 716.23887
FREEZING PROCESS: loop number 21 T-loop= 681.00000000000000
main_MD> interactions number 21 at Temperature= 681.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.32255 0.22661 -3.51533
force_rgl> df(natom) -1.75449 -0.74831 -0.17276
5005.0000 -124.05531 -119.90158 4.15373 2.20370 -120.14376 647.40791
5010.0000 -123.39217 -119.33442 4.05775 2.24729 -119.54421 691.23514
5015.0000 -123.14513 -118.06593 5.07919 2.27452 -119.16982 719.07070
5020.0000 -124.88676 -121.11716 3.76960 2.24253 -119.60972 697.43208
5025.0000 -125.19603 -121.14786 4.04817 2.18679 -120.37633 652.32917
5030.0000 -124.37020 -119.89010 4.48010 2.16722 -120.64536 632.35447
5035.0000 -124.84133 -120.46081 4.38052 2.23613 -119.69769 696.88032
5040.0000 -124.82326 -119.81906 5.00420 2.22079 -119.90875 669.11261
5045.0000 -123.53894 -118.98708 4.55186 2.27211 -119.20287 708.02247
5050.0000 -123.48976 -119.64926 3.84050 2.25148 -119.48668 660.80721
5055.0000 -124.63475 -120.03901 4.59574 2.21944 -119.92725 656.66938
5060.0000 -125.30520 -120.45458 4.85062 2.22457 -119.85678 662.65634
5065.0000 -125.66896 -121.62012 4.04884 2.15037 -120.87709 612.77791
5070.0000 -124.67606 -120.53873 4.13733 2.14334 -120.97381 621.34566
5075.0000 -124.56851 -120.43395 4.13456 2.16060 -120.73649 634.24874
5080.0000 -125.91025 -121.18785 4.72240 2.15192 -120.85586 618.32818
5085.0000 -124.69406 -120.08864 4.60542 2.19388 -120.27884 653.67106
5090.0000 -124.06895 -119.76984 4.29911 2.25360 -119.45741 681.96594
5095.0000 -123.71625 -119.41207 4.30418 2.24856 -119.52681 692.59116
5100.0000 -124.27599 -119.44376 4.83223 2.22821 -119.80659 666.61674
5105.0000 -124.52949 -119.82667 4.70282 2.20953 -120.06354 669.84127
5110.0000 -124.44492 -119.92260 4.52232 2.19764 -120.22712 644.46885
5115.0000 -124.19161 -119.96796 4.22365 2.20566 -120.11682 667.76264
5120.0000 -125.63539 -121.47661 4.15878 2.14949 -120.88924 627.25148
5125.0000 -123.76674 -120.08088 3.68585 2.19801 -120.22201 658.27073
5130.0000 -124.36732 -119.53916 4.82816 2.25825 -119.39357 712.92756
5135.0000 -123.53299 -118.44709 5.08591 2.30663 -118.72825 744.59979
5140.0000 -123.14531 -119.61750 3.52781 2.26193 -119.34290 726.43059
5145.0000 -124.99976 -120.21218 4.78758 2.22126 -119.90220 678.52508
5150.0000 -123.84916 -119.42366 4.42550 2.23843 -119.66605 681.79962
5155.0000 -124.98446 -120.80864 4.17582 2.20498 -120.12610 645.19010
5160.0000 -124.14070 -119.84507 4.29563 2.18881 -120.34856 639.98540
5165.0000 -122.91517 -118.92502 3.99015 2.25500 -119.43826 682.78247
5170.0000 -123.35907 -119.57127 3.78780 2.26673 -119.27687 716.64766
5175.0000 -124.49856 -120.57928 3.91928 2.23365 -119.73185 663.12065
5180.0000 -124.49515 -120.19302 4.30213 2.18581 -120.38976 651.93955
5185.0000 -124.02757 -119.09349 4.93408 2.24085 -119.63283 707.00377
5190.0000 -123.16659 -119.42309 3.74351 2.24974 -119.51056 679.66327
5195.0000 -124.35272 -119.34048 5.01224 2.28958 -118.96271 729.03564
5200.0000 -123.83121 -119.53961 4.29160 2.25082 -119.49566 709.83084
5205.0000 -123.67539 -120.11798 3.55741 2.23987 -119.64627 673.38249
5210.0000 -124.07356 -120.10750 3.96605 2.20612 -120.11048 629.07478
5215.0000 -125.54806 -120.66483 4.88323 2.17583 -120.52697 606.35520
5220.0000 -125.23829 -121.00588 4.23241 2.13867 -121.03803 629.98133
5225.0000 -125.65089 -121.51764 4.13325 2.15164 -120.85961 631.81802
5230.0000 -125.37696 -120.67348 4.70348 2.17126 -120.58978 661.78873
5235.0000 -124.31447 -119.62327 4.69120 2.21331 -120.01155 646.33759
5240.0000 -124.94476 -121.18662 3.75814 2.15759 -120.77780 600.46090
5245.0000 -124.36549 -120.58257 3.78292 2.18160 -120.44767 626.80112
5250.0000 -124.68707 -121.63515 3.05192 2.12321 -121.25068 603.76601
FREEZING PROCESS: loop number 22 T-loop= 656.00000000000000
main_MD> interactions number 22 at Temperature= 656.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.33045 0.18211 -0.52846
force_rgl> df(natom) 1.08231 -0.57605 -1.30017
5255.0000 -125.35977 -121.90571 3.45406 2.08900 -121.72113 578.95648
5260.0000 -125.37045 -121.14305 4.22740 2.10880 -121.44887 572.49803
5265.0000 -124.47665 -120.40451 4.07215 2.17227 -120.57600 647.81181
5270.0000 -124.10831 -120.42043 3.68788 2.16165 -120.72208 608.69944
5275.0000 -124.92352 -120.56911 4.35441 2.19408 -120.27602 614.43055
5280.0000 -124.65850 -119.95509 4.70341 2.19045 -120.32592 612.27362
5285.0000 -124.28397 -120.14791 4.13606 2.22662 -119.82854 659.42159
5290.0000 -124.67763 -120.31283 4.36481 2.22645 -119.83086 682.40460
5295.0000 -124.98742 -120.09222 4.89521 2.21636 -119.96961 700.55484
5300.0000 -124.07038 -119.08994 4.98044 2.21496 -119.98886 674.34004
5305.0000 -124.44542 -120.19485 4.25057 2.23465 -119.71802 691.98289
5310.0000 -124.10779 -120.15551 3.95228 2.18843 -120.35376 639.83771
5315.0000 -124.48763 -120.38945 4.09818 2.21137 -120.03818 671.93124
5320.0000 -124.37277 -119.47650 4.89627 2.25678 -119.41377 688.80914
5325.0000 -123.86869 -119.53170 4.33699 2.24412 -119.58785 686.08220
5330.0000 -124.26556 -120.10699 4.15857 2.23385 -119.72906 669.60442
5335.0000 -124.91647 -120.37135 4.54512 2.16737 -120.64330 611.12786
5340.0000 -124.24100 -119.70396 4.53703 2.20107 -120.17992 673.19347
5345.0000 -124.43513 -119.95918 4.47595 2.24351 -119.59620 707.88482
5350.0000 -124.02342 -120.23450 3.78892 2.23136 -119.76329 681.09091
5355.0000 -124.39014 -119.14660 5.24354 2.22565 -119.84186 649.69820
5360.0000 -125.19017 -120.17936 5.01081 2.26187 -119.34381 731.11199
5365.0000 -123.98177 -119.82289 4.15888 2.21709 -119.95952 684.77206
5370.0000 -123.20309 -118.90639 4.29670 2.28315 -119.05116 741.47697
5375.0000 -124.60829 -121.00219 3.60610 2.21798 -119.94739 652.84965
5380.0000 -125.84081 -121.50019 4.34063 2.11468 -121.36797 604.57451
5385.0000 -124.17558 -120.33700 3.83858 2.14314 -120.97655 616.99701
5390.0000 -123.74571 -119.73252 4.01318 2.22657 -119.82922 684.65571
5395.0000 -124.81421 -120.24555 4.56866 2.24123 -119.62761 662.88782
5400.0000 -124.14715 -119.90659 4.24056 2.21465 -119.99318 683.14380
5405.0000 -125.59561 -120.49896 5.09665 2.18549 -120.39417 652.04835
5410.0000 -124.90608 -120.22354 4.68254 2.14580 -120.93996 636.23515
5415.0000 -125.87768 -121.24138 4.63629 2.21026 -120.05356 673.80664
5420.0000 -123.99057 -120.57971 3.41085 2.13894 -121.03430 603.80561
5425.0000 -124.76294 -120.10070 4.66224 2.18700 -120.37335 673.62834
5430.0000 -124.44921 -119.56814 4.88108 2.20672 -120.10221 691.42839
5435.0000 -124.47139 -119.12830 5.34309 2.27629 -119.14548 729.53342
5440.0000 -124.64983 -120.17761 4.47223 2.23565 -119.70436 678.13035
5445.0000 -125.07869 -120.84061 4.23808 2.18473 -120.40467 648.22864
5450.0000 -124.20301 -119.70582 4.49719 2.19893 -120.20935 677.16133
5455.0000 -123.17838 -118.86552 4.31287 2.25150 -119.48642 696.02435
5460.0000 -123.29258 -119.49612 3.79647 2.29288 -118.91722 708.01318
5465.0000 -124.28348 -120.42551 3.85797 2.20855 -120.07706 644.88110
5470.0000 -124.36726 -120.31947 4.04779 2.17871 -120.48735 644.11523
5475.0000 -123.81664 -119.39884 4.41779 2.18516 -120.39865 648.02023
5480.0000 -124.21367 -119.95156 4.26211 2.26655 -119.27932 720.36402
5485.0000 -124.83383 -121.38807 3.44576 2.14319 -120.97591 612.45953
5490.0000 -125.35154 -121.46636 3.88518 2.14596 -120.93772 642.09381
5495.0000 -125.28183 -121.64466 3.63716 2.11244 -121.39880 601.03754
5500.0000 -124.74706 -121.18970 3.55736 2.14735 -120.91863 608.66551
FREEZING PROCESS: loop number 23 T-loop= 631.00000000000000
main_MD> interactions number 23 at Temperature= 631.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.93047 0.91651 -3.97363
force_rgl> df(natom) 0.74165 -2.29311 -2.47381
5505.0000 -125.57236 -121.69005 3.88230 2.09984 -121.57200 547.65813
5510.0000 -124.88715 -119.99805 4.88910 2.15875 -120.76196 623.31517
5515.0000 -124.36215 -119.44508 4.91707 2.23603 -119.69913 719.76419
5520.0000 -125.42637 -121.03322 4.39314 2.17509 -120.53712 644.48555
5525.0000 -124.94723 -121.30849 3.63874 2.14525 -120.94761 620.81519
5530.0000 -125.96226 -121.40342 4.55884 2.12690 -121.19995 607.31353
5535.0000 -125.00703 -120.86169 4.14533 2.10332 -121.52420 618.90045
5540.0000 -124.64193 -120.72138 3.92056 2.17938 -120.47813 654.89712
5545.0000 -125.73748 -121.60451 4.13297 2.13419 -121.09970 617.07579
5550.0000 -123.83992 -119.30666 4.53326 2.20654 -120.10470 652.86595
5555.0000 -124.35355 -120.75091 3.60264 2.25503 -119.43782 684.12163
5560.0000 -125.15639 -120.61875 4.53763 2.17184 -120.58182 619.55830
5565.0000 -124.01775 -119.95926 4.05849 2.14059 -121.01166 582.01801
5570.0000 -125.64299 -121.48887 4.15412 2.15309 -120.83974 621.66196
5575.0000 -124.50040 -120.84209 3.65831 2.14906 -120.89516 614.95876
5580.0000 -124.65449 -120.55834 4.09614 2.15181 -120.85736 608.18506
5585.0000 -124.93069 -120.89749 4.03320 2.14471 -120.95501 582.39769
5590.0000 -123.95446 -119.79967 4.15479 2.21143 -120.03739 674.67484
5595.0000 -124.78919 -120.33911 4.45008 2.23453 -119.71967 658.34868
5600.0000 -124.12975 -119.64918 4.48057 2.18864 -120.35080 654.66936
5605.0000 -124.30620 -120.46990 3.83631 2.16069 -120.73523 597.70045
5610.0000 -125.07013 -120.91459 4.15554 2.19412 -120.27544 646.24482
5615.0000 -124.13811 -119.93195 4.20615 2.20341 -120.14768 637.18413
5620.0000 -124.81394 -120.15028 4.66366 2.22747 -119.81687 665.96848
5625.0000 -124.35065 -120.68580 3.66485 2.17350 -120.55904 622.73617
5630.0000 -124.31164 -120.33013 3.98150 2.16663 -120.65357 639.23690
5635.0000 -124.54552 -119.46111 5.08442 2.24475 -119.57919 651.57644
5640.0000 -123.78383 -119.29195 4.49188 2.28905 -118.96998 703.50491
5645.0000 -124.00036 -119.43097 4.56939 2.27457 -119.16903 708.61743
5650.0000 -124.52005 -119.97072 4.54934 2.21228 -120.02578 651.95172
5655.0000 -125.33039 -121.56255 3.76784 2.14978 -120.88525 591.88314
5660.0000 -125.44336 -121.34411 4.09925 2.14687 -120.92524 588.17135
5665.0000 -124.58438 -120.67641 3.90797 2.13613 -121.07302 601.71045
5670.0000 -124.78552 -120.56204 4.22348 2.20296 -120.15388 675.73666
5675.0000 -125.34814 -120.81879 4.52935 2.15400 -120.82721 624.14667
5680.0000 -125.34460 -120.83124 4.51336 2.13756 -121.05326 622.36518
5685.0000 -125.28659 -120.73206 4.55453 2.12425 -121.23641 603.63891
5690.0000 -125.50786 -121.28207 4.22579 2.14214 -120.99036 620.40902
5695.0000 -124.56498 -120.63717 3.92781 2.15161 -120.86004 616.49337
5700.0000 -124.07861 -120.08694 3.99167 2.20763 -120.08963 632.39736
5705.0000 -124.85611 -120.41438 4.44172 2.20756 -120.09058 653.05287
5710.0000 -124.63556 -120.70006 3.93550 2.21733 -119.95625 691.86368
5715.0000 -125.63149 -121.62030 4.01118 2.16857 -120.62679 639.33393
5720.0000 -125.10167 -120.99754 4.10413 2.12230 -121.26323 599.02574
5725.0000 -123.87623 -119.43261 4.44363 2.20061 -120.18620 673.98990
5730.0000 -124.96469 -120.71187 4.25281 2.20356 -120.14569 669.34101
5735.0000 -124.40689 -120.43511 3.97178 2.16413 -120.68785 643.16841
5740.0000 -124.09553 -119.49687 4.59866 2.22340 -119.87276 659.33422
5745.0000 -124.78291 -120.38198 4.40093 2.19194 -120.30542 623.27448
5750.0000 -124.97344 -120.58467 4.38877 2.17367 -120.55664 626.09404
FREEZING PROCESS: loop number 24 T-loop= 606.00000000000000
main_MD> interactions number 24 at Temperature= 606.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.16386 -2.03355 1.35844
force_rgl> df(natom) -2.04885 -0.68923 0.15973
5755.0000 -125.51122 -121.77877 3.73245 2.09904 -121.58312 571.65080
5760.0000 -124.76737 -120.23210 4.53527 2.17999 -120.46983 638.46811
5765.0000 -124.58069 -120.90107 3.67961 2.17971 -120.47367 644.08098
5770.0000 -125.50037 -121.21218 4.28819 2.15262 -120.84616 621.86142
5775.0000 -124.37956 -120.82835 3.55121 2.11999 -121.29499 571.58831
5780.0000 -124.18623 -120.19466 3.99157 2.20681 -120.10102 638.75254
5785.0000 -124.74430 -120.15129 4.59302 2.20600 -120.11213 658.58056
5790.0000 -123.91908 -119.84283 4.07625 2.24160 -119.62252 698.10967
5795.0000 -124.50527 -120.67025 3.83502 2.18120 -120.45309 647.72434
5800.0000 -124.39218 -119.96685 4.42533 2.16688 -120.65003 616.81330
5805.0000 -124.34314 -120.58019 3.76295 2.20316 -120.15117 642.35327
5810.0000 -124.52091 -119.96386 4.55705 2.14259 -120.98414 596.33541
5815.0000 -123.81274 -119.87486 3.93788 2.23988 -119.64613 689.83370
5820.0000 -125.42401 -121.32360 4.10041 2.15448 -120.82067 615.75353
5825.0000 -124.64403 -120.52068 4.12336 2.18560 -120.39268 657.61745
5830.0000 -124.98008 -120.55663 4.42345 2.16511 -120.67444 620.55485
5835.0000 -125.20822 -121.11348 4.09474 2.19084 -120.32057 660.89191
5840.0000 -124.96221 -120.82767 4.13455 2.14345 -120.97227 616.25495
5845.0000 -125.22588 -120.95306 4.27282 2.13077 -121.14671 619.21311
5850.0000 -124.84925 -120.65229 4.19696 2.15071 -120.87248 626.94384
5855.0000 -124.49579 -120.54609 3.94969 2.16440 -120.68419 611.96672
5860.0000 -125.04393 -120.22669 4.81724 2.17587 -120.52642 613.80576
5865.0000 -125.48668 -121.53633 3.95035 2.09251 -121.67287 570.88972
5870.0000 -124.59093 -120.59774 3.99318 2.14076 -121.00931 632.07853
5875.0000 -125.49763 -120.14740 5.35022 2.19307 -120.28986 647.45922
5880.0000 -125.14434 -120.49603 4.64831 2.19917 -120.20600 674.20713
5885.0000 -126.35253 -121.96166 4.39087 2.11239 -121.39947 600.06636
5890.0000 -124.65681 -121.88478 2.77203 2.09906 -121.58282 557.92841
5895.0000 -125.40947 -121.60617 3.80330 2.09439 -121.64694 572.43220
5900.0000 -124.88860 -121.31770 3.57090 2.10379 -121.51776 603.75107
5905.0000 -124.96043 -121.10136 3.85907 2.14366 -120.96945 625.35802
5910.0000 -126.44140 -122.26966 4.17175 2.13540 -121.08298 609.67720
5915.0000 -125.99860 -122.68636 3.31225 2.04945 -122.26502 545.73051
5920.0000 -124.89287 -121.61442 3.27845 2.09157 -121.68574 571.42794
5925.0000 -125.56373 -122.23699 3.32674 2.10975 -121.43574 581.63093
5930.0000 -125.09731 -121.59727 3.50004 2.06812 -122.00832 560.52124
5935.0000 -125.18437 -120.77238 4.41198 2.09278 -121.66920 569.63423
5940.0000 -124.84347 -121.29205 3.55143 2.16526 -120.67232 630.81960
5945.0000 -125.09186 -121.48128 3.61058 2.10525 -121.49764 575.54002
5950.0000 -124.26811 -119.50906 4.75905 2.19663 -120.24099 613.30246
5955.0000 -124.53402 -119.69961 4.83442 2.22530 -119.84668 685.05814
5960.0000 -124.41427 -121.12154 3.29274 2.19347 -120.28437 648.74910
5965.0000 -124.38630 -119.26089 5.12542 2.16995 -120.60791 620.90065
5970.0000 -125.07922 -120.84400 4.23521 2.22778 -119.81251 685.18026
5975.0000 -124.60994 -121.43468 3.17526 2.14714 -120.92157 608.22418
5980.0000 -124.19629 -120.52409 3.67221 2.18313 -120.42655 644.50638
5985.0000 -124.39996 -119.66515 4.73482 2.21184 -120.03176 700.51313
5990.0000 -124.46301 -120.62407 3.83893 2.19209 -120.30337 669.08905
5995.0000 -125.19200 -121.18975 4.00224 2.11619 -121.34716 594.38519
6000.0000 -125.47060 -121.70882 3.76178 2.11861 -121.31399 596.99305
FREEZING PROCESS: loop number 25 T-loop= 581.00000000000000
main_MD> interactions number 25 at Temperature= 581.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.33835 -0.52468 3.32867
force_rgl> df(natom) -1.85841 -1.55350 -0.40021
6005.0000 -125.47043 -121.53839 3.93204 2.07152 -121.96148 555.54502
6010.0000 -125.61059 -122.10075 3.50984 2.06576 -122.04077 539.76149
6015.0000 -125.02568 -121.32092 3.70476 2.13694 -121.06180 617.88298
6020.0000 -125.56147 -121.03002 4.53144 2.15366 -120.83190 602.32200
6025.0000 -124.66256 -120.32517 4.33739 2.14762 -120.91495 606.23408
6030.0000 -124.53366 -121.13549 3.39817 2.14959 -120.88786 596.66471
6035.0000 -125.42667 -121.49591 3.93076 2.09028 -121.70357 575.49102
6040.0000 -126.10499 -122.40653 3.69846 2.05590 -122.17639 542.15239
6045.0000 -125.94902 -123.03824 2.91079 2.03435 -122.47266 527.33670
6050.0000 -126.06635 -122.51318 3.55317 2.02531 -122.59701 527.93850
6055.0000 -126.30974 -122.63298 3.67676 2.01473 -122.74251 521.17862
6060.0000 -124.72547 -121.11584 3.60963 2.07899 -121.85875 561.81338
6065.0000 -125.28710 -121.59222 3.69489 2.10543 -121.49518 557.18283
6070.0000 -125.51562 -121.25846 4.25717 2.10996 -121.43287 584.16696
6075.0000 -124.31836 -120.59894 3.71942 2.18819 -120.35707 624.13348
6080.0000 -124.65083 -121.10290 3.54794 2.14989 -120.88371 612.24266
6085.0000 -126.37774 -122.14810 4.22963 2.09690 -121.61244 578.59385
6090.0000 -125.24123 -121.02216 4.21907 2.08910 -121.71974 590.11504
6095.0000 -126.17910 -121.73982 4.43928 2.07574 -121.90350 564.55123
6100.0000 -126.25697 -123.00101 3.25596 2.04686 -122.30062 559.94688
6105.0000 -126.47102 -123.01610 3.45492 2.03948 -122.40217 556.11655
6110.0000 -125.90691 -122.42371 3.48320 1.99961 -122.95053 511.10312
6115.0000 -125.04698 -121.31637 3.73061 2.05078 -122.24671 555.18257
6120.0000 -125.23183 -121.61709 3.61474 2.12735 -121.19370 600.32318
6125.0000 -125.17938 -121.52556 3.65382 2.08176 -121.82073 567.89663
6130.0000 -125.30927 -120.92863 4.38064 2.10275 -121.53204 598.60347
6135.0000 -125.51876 -120.43138 5.08737 2.13864 -121.03839 603.92406
6140.0000 -124.93688 -121.24108 3.69580 2.14283 -120.98080 623.77344
6145.0000 -125.79328 -122.08274 3.71054 2.11978 -121.29777 585.08013
6150.0000 -124.99070 -121.11521 3.87549 2.08783 -121.73727 562.39309
6155.0000 -124.02413 -120.22720 3.79693 2.12242 -121.26157 584.36596
6160.0000 -124.10397 -120.62912 3.47485 2.16731 -120.64424 598.22672
6165.0000 -125.01168 -121.13474 3.87695 2.11498 -121.36385 565.52240
6170.0000 -124.83644 -120.92936 3.90708 2.16352 -120.69634 611.62033
6175.0000 -125.52906 -121.80050 3.72856 2.15351 -120.83395 620.30794
6180.0000 -124.25897 -120.62099 3.63797 2.10186 -121.54434 576.72103
6185.0000 -125.46684 -121.45910 4.00774 2.12006 -121.29402 588.51243
6190.0000 -124.06966 -119.89201 4.17765 2.16478 -120.67890 630.71529
6195.0000 -124.07851 -120.45590 3.62261 2.19888 -120.21006 611.22015
6200.0000 -125.11429 -120.84953 4.26476 2.14861 -120.90139 580.68666
6205.0000 -124.67143 -121.17827 3.49317 2.15421 -120.82432 571.82231
6210.0000 -125.50652 -121.77069 3.73583 2.08742 -121.74292 571.17322
6215.0000 -124.88282 -121.46755 3.41527 2.09696 -121.61163 549.70406
6220.0000 -124.96400 -120.51632 4.44767 2.15028 -120.87835 599.70174
6225.0000 -123.99912 -121.00618 2.99294 2.12709 -121.19723 565.53356
6230.0000 -125.41852 -121.50852 3.91000 2.11350 -121.38421 602.44199
6235.0000 -125.41852 -121.14039 4.27813 2.13767 -121.05180 634.88856
6240.0000 -126.85129 -122.50739 4.34390 2.04674 -122.30237 559.82954
6245.0000 -124.71958 -121.62898 3.09060 2.05499 -122.18886 577.02716
6250.0000 -125.64818 -121.36450 4.28368 2.11761 -121.32771 622.35782
FREEZING PROCESS: loop number 26 T-loop= 556.00000000000000
main_MD> interactions number 26 at Temperature= 556.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.38193 1.82682 1.81790
force_rgl> df(natom) -0.39421 -1.01926 -1.50502
6255.0000 -126.33111 -122.13918 4.19192 2.06127 -122.10251 562.85003
6260.0000 -125.67025 -122.08910 3.58116 2.04980 -122.26029 548.35413
6265.0000 -125.93698 -122.15441 3.78257 2.06463 -122.05622 563.22698
6270.0000 -125.52846 -122.05630 3.47216 2.08808 -121.73384 579.96032
6275.0000 -125.83033 -122.03851 3.79182 2.08157 -121.82326 570.71126
6280.0000 -126.53246 -122.51587 4.01660 2.02361 -122.62043 534.23705
6285.0000 -126.10333 -122.54234 3.56100 2.02675 -122.57720 539.79408
6290.0000 -125.80602 -122.57215 3.23387 2.03439 -122.47221 545.79661
6295.0000 -125.18859 -122.00160 3.18699 2.03383 -122.47981 543.67449
6300.0000 -124.10056 -121.19017 2.91040 2.09845 -121.59114 575.95214
6305.0000 -125.08153 -121.23561 3.84591 2.09574 -121.62840 568.16135
6310.0000 -126.38728 -122.44769 3.93959 2.07401 -121.92724 553.08350
6315.0000 -125.90588 -123.29715 2.60873 2.01225 -122.77656 517.43023
6320.0000 -125.76427 -122.28596 3.47831 2.04422 -122.33701 566.04275
6325.0000 -126.23700 -122.32227 3.91473 2.03786 -122.42440 553.88198
6330.0000 -125.91964 -122.38098 3.53865 2.05588 -122.17660 569.25675
6335.0000 -125.65580 -122.51989 3.13591 2.04438 -122.33480 530.73470
6340.0000 -126.23187 -122.48649 3.74537 2.04479 -122.32915 542.51030
6345.0000 -125.94851 -122.31509 3.63342 2.01581 -122.72761 527.91529
6350.0000 -126.73100 -123.32598 3.40502 1.98159 -123.19827 481.41831
6355.0000 -125.63888 -122.22515 3.41373 2.01543 -122.73295 518.84022
6360.0000 -126.14408 -122.31472 3.82936 2.00933 -122.81683 528.53337
6365.0000 -125.90203 -120.94907 4.95296 2.08877 -121.72425 598.47957
6370.0000 -125.09662 -121.39468 3.70194 2.12568 -121.21665 596.54209
6375.0000 -125.17811 -121.36250 3.81561 2.10379 -121.51772 559.24134
6380.0000 -125.24804 -120.88974 4.35830 2.14129 -121.00207 607.77961
6385.0000 -124.31569 -120.59680 3.71889 2.14942 -120.89018 614.97543
6390.0000 -125.18479 -120.80700 4.37779 2.14171 -120.99626 625.15071
6395.0000 -125.22726 -121.75433 3.47293 2.10842 -121.45411 578.78184
6400.0000 -126.91895 -123.30236 3.61659 2.04692 -122.29982 581.62712
6405.0000 -126.85665 -122.97625 3.88039 2.02236 -122.63757 562.50568
6410.0000 -125.93167 -121.95432 3.97735 2.03968 -122.39946 556.70920
6415.0000 -125.66494 -121.86420 3.80074 2.09668 -121.61548 613.82801
6420.0000 -125.44595 -122.05557 3.39039 2.07048 -121.97582 543.76309
6425.0000 -126.24230 -122.24958 3.99271 2.08262 -121.80885 560.97764
6430.0000 -125.46560 -122.12330 3.34231 2.05806 -122.14665 521.93886
6435.0000 -125.52951 -122.01830 3.51121 2.05335 -122.21143 520.10225
6440.0000 -125.82863 -121.64797 4.18066 2.05766 -122.15220 559.03610
6445.0000 -126.00128 -122.20635 3.79493 2.05733 -122.15661 533.42322
6450.0000 -125.33891 -121.83412 3.50480 2.06946 -121.98985 598.51373
6455.0000 -125.59708 -121.81792 3.77916 2.05523 -122.18549 550.24282
6460.0000 -125.32810 -121.16102 4.16708 2.07877 -121.86184 561.61746
6465.0000 -124.63472 -120.72272 3.91200 2.16173 -120.72085 635.86034
6470.0000 -125.40346 -121.53183 3.87163 2.11130 -121.41443 585.36692
6475.0000 -126.18126 -122.74477 3.43649 2.03351 -122.48423 533.73585
6480.0000 -125.62704 -122.25790 3.36914 2.03968 -122.39940 542.00764
6485.0000 -125.53488 -122.18312 3.35176 2.09522 -121.63556 569.93568
6490.0000 -125.95065 -122.21490 3.73575 2.04448 -122.33340 521.79022
6495.0000 -126.84837 -123.90544 2.94293 1.97920 -123.23120 487.69392
6500.0000 -126.22169 -122.90424 3.31745 1.99660 -122.99191 497.67827
FREEZING PROCESS: loop number 27 T-loop= 531.00000000000000
main_MD> interactions number 27 at Temperature= 531.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.74690 1.15281 -0.43226
force_rgl> df(natom) -1.10657 0.57014 -2.60607
6505.0000 -126.40902 -123.38411 3.02492 1.96064 -123.48642 480.94423
6510.0000 -126.61036 -123.57605 3.03431 1.94576 -123.69102 454.77404
6515.0000 -126.45381 -122.19393 4.25989 2.00098 -122.93162 514.74880
6520.0000 -126.15730 -123.29172 2.86558 2.00977 -122.81072 509.20770
6525.0000 -126.26016 -122.52217 3.73799 1.97940 -123.22843 495.64263
6530.0000 -126.10292 -122.65438 3.44853 1.99974 -122.94860 505.43812
6535.0000 -126.63253 -122.98530 3.64724 2.03204 -122.50443 543.40418
6540.0000 -125.59569 -122.57571 3.01999 2.01124 -122.79054 528.15557
6545.0000 -126.39078 -123.10977 3.28101 1.99478 -123.01689 513.61003
6550.0000 -125.65380 -122.25991 3.39389 2.03871 -122.41279 556.43434
6555.0000 -124.98875 -121.75608 3.23267 2.06841 -122.00434 548.04953
6560.0000 -125.16802 -121.04146 4.12656 2.07839 -121.86700 569.66245
6565.0000 -125.55029 -121.73382 3.81647 2.07206 -121.95414 558.89569
6570.0000 -125.34637 -121.66549 3.68088 2.09316 -121.66391 562.29533
6575.0000 -126.07381 -122.26826 3.80555 2.06426 -122.06137 538.46790
6580.0000 -126.84849 -122.99496 3.85353 2.01853 -122.69030 539.55697
6585.0000 -126.30708 -122.71019 3.59688 1.99572 -123.00399 510.60759
6590.0000 -125.50024 -122.23177 3.26847 2.02797 -122.56039 539.30875
6595.0000 -126.53323 -123.61393 2.91930 1.98243 -123.18674 491.44301
6600.0000 -126.51765 -122.46456 4.05309 1.97048 -123.35101 485.26025
6605.0000 -126.86671 -123.57746 3.28925 2.00246 -122.91120 512.79203
6610.0000 -126.62846 -123.32566 3.30280 1.95839 -123.51732 463.09350
6615.0000 -126.12385 -123.38153 2.74232 1.97128 -123.34005 457.82222
6620.0000 -125.64932 -122.33884 3.31049 1.99291 -123.04261 483.78978
6625.0000 -124.34552 -120.99178 3.35374 2.05822 -122.14450 529.51136
6630.0000 -125.39788 -121.68021 3.71767 2.11699 -121.33615 602.62861
6635.0000 -125.64280 -121.90753 3.73527 2.06168 -122.09681 572.35182
6640.0000 -126.08294 -122.56479 3.51815 2.04573 -122.31625 543.87983
6645.0000 -125.73700 -122.50462 3.23238 2.01380 -122.75529 526.41131
6650.0000 -126.21527 -123.19136 3.02391 2.01645 -122.71890 520.51428
6655.0000 -126.57915 -123.38123 3.19792 1.98380 -123.16784 498.80981
6660.0000 -126.03992 -123.23681 2.80310 1.97620 -123.27244 485.86812
6665.0000 -126.64434 -123.97329 2.67105 1.96461 -123.43173 472.77023
6670.0000 -125.84450 -122.78494 3.05957 1.97192 -123.33133 464.04258
6675.0000 -126.40027 -122.39060 4.00966 2.04451 -122.33297 525.59970
6680.0000 -126.37501 -122.67437 3.70064 2.02163 -122.64763 515.73125
6685.0000 -125.75486 -122.10756 3.64730 2.01890 -122.68513 517.09142
6690.0000 -125.58027 -121.61302 3.96725 2.07665 -121.89098 548.49545
6695.0000 -125.78608 -122.07429 3.71179 2.08507 -121.77523 575.50222
6700.0000 -125.24466 -121.69142 3.55324 2.09864 -121.58850 592.11456
6705.0000 -125.29013 -121.65449 3.63564 2.10935 -121.44127 569.09499
6710.0000 -125.85788 -121.82960 4.02828 2.07539 -121.90828 556.37649
6715.0000 -126.65155 -122.82791 3.82364 2.05963 -122.12510 549.47620
6720.0000 -126.44838 -123.27359 3.17479 2.01150 -122.78692 515.86778
6725.0000 -126.22926 -122.71679 3.51247 2.00260 -122.90939 513.71274
6730.0000 -124.99638 -122.18354 2.81284 2.02304 -122.62824 501.52258
6735.0000 -125.94202 -122.10523 3.83679 2.05542 -122.18299 539.87840
6740.0000 -125.51043 -121.17046 4.33998 2.12145 -121.27481 595.99342
6745.0000 -125.64795 -122.61780 3.03016 2.07471 -121.91764 544.23190
6750.0000 -126.20082 -122.64337 3.55745 2.02500 -122.60127 515.98210
FREEZING PROCESS: loop number 28 T-loop= 506.00000000000000
main_MD> interactions number 28 at Temperature= 506.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.39048 -2.13012 -0.63695
force_rgl> df(natom) 0.37749 -1.43089 -1.82986
6755.0000 -125.56668 -122.59300 2.97369 2.00580 -122.86529 522.92853
6760.0000 -126.10093 -122.52510 3.57584 2.03233 -122.50042 516.24986
6765.0000 -125.34055 -122.06408 3.27648 2.03512 -122.46215 511.91271
6770.0000 -125.34946 -122.06696 3.28250 2.08534 -121.77153 560.45306
6775.0000 -125.34737 -122.48931 2.85806 2.02955 -122.53870 517.77209
6780.0000 -125.76681 -122.14584 3.62097 2.05202 -122.22973 558.64690
6785.0000 -125.95526 -122.22667 3.72859 2.06122 -122.10320 538.32755
6790.0000 -125.88421 -122.48643 3.39778 2.05064 -122.24871 541.59483
6795.0000 -125.79658 -122.24428 3.55230 2.03639 -122.44469 527.04148
6800.0000 -125.45354 -122.23614 3.21739 2.02118 -122.65385 506.56485
6805.0000 -125.97346 -123.02636 2.94710 2.03350 -122.48434 532.13658
6810.0000 -126.73410 -123.04624 3.68786 2.01887 -122.68565 514.73557
6815.0000 -125.76928 -122.20755 3.56173 2.03036 -122.52756 548.26933
6820.0000 -126.20362 -122.33045 3.87317 2.03590 -122.45141 543.46336
6825.0000 -126.56045 -123.26913 3.29132 2.03006 -122.53166 541.46906
6830.0000 -125.99492 -122.41005 3.58487 1.99601 -122.99998 497.83732
6835.0000 -126.66527 -123.46809 3.19718 1.98965 -123.08740 485.74078
6840.0000 -126.21721 -123.09549 3.12172 1.99317 -123.03905 494.82927
6845.0000 -126.65641 -124.11629 2.54012 1.97063 -123.34900 471.44956
6850.0000 -126.14292 -123.08900 3.05392 1.95838 -123.51752 466.46539
6855.0000 -126.49419 -123.33934 3.15484 1.96059 -123.48706 474.50663
6860.0000 -125.64154 -122.62687 3.01467 1.98536 -123.14639 478.78597
6865.0000 -125.39319 -121.81669 3.57650 2.04714 -122.29674 526.15627
6870.0000 -126.20730 -122.53450 3.67280 2.05970 -122.12406 534.76224
6875.0000 -125.65773 -122.61541 3.04232 2.03283 -122.49364 536.40272
6880.0000 -125.65580 -122.90762 2.74818 2.01151 -122.78681 492.92738
6885.0000 -126.29527 -122.37347 3.92180 2.02205 -122.64180 524.55722
6890.0000 -125.46811 -122.14226 3.32585 2.01974 -122.67367 527.53004
6895.0000 -126.38555 -122.81607 3.56948 2.02901 -122.54621 547.08131
6900.0000 -127.39096 -124.62098 2.76999 1.92404 -123.98967 442.38099
6905.0000 -127.11545 -123.72994 3.38551 1.90142 -124.30080 428.56335
6910.0000 -126.16628 -123.59423 2.57205 1.95255 -123.59760 464.39286
6915.0000 -126.07640 -123.14507 2.93134 1.97519 -123.28631 479.93170
6920.0000 -125.79114 -122.55621 3.23493 2.00348 -122.89724 496.56391
6925.0000 -125.61257 -121.41832 4.19425 2.05405 -122.20182 545.74199
6930.0000 -126.03330 -122.14557 3.88773 2.04447 -122.33355 541.86846
6935.0000 -126.53286 -123.37360 3.15926 2.01272 -122.77015 513.60891
6940.0000 -126.75491 -123.36818 3.38674 1.98056 -123.21241 507.00131
6945.0000 -126.30858 -122.81173 3.49685 1.98525 -123.14801 489.72340
6950.0000 -125.16187 -122.27240 2.88947 2.04674 -122.30237 498.20274
6955.0000 -125.85051 -122.08431 3.76620 2.05930 -122.12959 520.06235
6960.0000 -125.04917 -121.58740 3.46177 2.04320 -122.35103 515.67943
6965.0000 -125.73950 -122.09607 3.64343 2.08635 -121.75763 535.25704
6970.0000 -126.03767 -122.32555 3.71211 2.07816 -121.87026 548.19624
6975.0000 -126.58662 -122.95457 3.63205 2.03842 -122.41674 543.62963
6980.0000 -127.34671 -123.71188 3.63483 1.95381 -123.58036 504.33836
6985.0000 -126.42696 -123.09771 3.32925 1.96488 -123.42813 513.34256
6990.0000 -126.47463 -123.63542 2.83921 1.96932 -123.36698 479.20940
6995.0000 -126.67587 -123.34770 3.32817 1.99754 -122.97894 511.08660
7000.0000 -126.92794 -124.28199 2.64595 1.93151 -123.88695 454.40798
FREEZING PROCESS: loop number 29 T-loop= 481.00000000000000
main_MD> interactions number 29 at Temperature= 481.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.90166 1.88885 0.90648
force_rgl> df(natom) 1.65273 1.78998 -0.96958
7005.0000 -126.80611 -123.90525 2.90086 1.93030 -123.90359 446.66329
7010.0000 -126.69618 -124.14950 2.54668 1.91713 -124.08470 437.50156
7015.0000 -127.04524 -124.04387 3.00137 1.92590 -123.96414 459.71178
7020.0000 -127.23218 -123.69360 3.53858 1.92850 -123.92837 461.68809
7025.0000 -125.05815 -122.45484 2.60330 1.97887 -123.23565 483.86965
7030.0000 -126.91823 -122.49393 4.42430 2.01802 -122.69730 497.07002
7035.0000 -125.97832 -122.66238 3.31595 2.02289 -122.63033 542.59902
7040.0000 -127.46011 -123.75265 3.70746 1.97096 -123.34443 499.48310
7045.0000 -126.28226 -123.55794 2.72432 1.95355 -123.58385 455.88975
7050.0000 -127.13194 -123.69612 3.43582 1.95948 -123.50239 478.28342
7055.0000 -127.72521 -124.65488 3.07033 1.90543 -124.24567 452.04228
7060.0000 -126.80875 -123.68144 3.12731 1.90442 -124.25959 433.75365
7065.0000 -126.22552 -122.46276 3.76276 1.97089 -123.34550 479.11228
7070.0000 -125.97860 -122.43441 3.54419 2.02343 -122.62292 522.42668
7075.0000 -126.54823 -123.01245 3.53578 2.00688 -122.85051 525.87777
7080.0000 -126.73779 -123.71521 3.02258 1.94105 -123.75582 451.58855
7085.0000 -126.89973 -123.37307 3.52666 1.96857 -123.37731 484.82368
7090.0000 -126.52434 -123.36895 3.15539 1.97246 -123.32391 500.61667
7095.0000 -126.73862 -123.52122 3.21740 1.95473 -123.56772 467.39776
7100.0000 -126.80959 -122.89352 3.91608 1.97843 -123.24179 483.77679
7105.0000 -126.10340 -123.11541 2.98799 1.99456 -123.01985 497.77999
7110.0000 -126.14031 -123.62415 2.51616 1.97922 -123.23092 486.30291
7115.0000 -126.16844 -123.36729 2.80115 1.97551 -123.28188 469.66792
7120.0000 -126.38174 -123.06063 3.32111 1.98496 -123.15198 479.18093
7125.0000 -126.34823 -123.14971 3.19852 2.01316 -122.76415 523.02618
7130.0000 -127.02711 -123.50233 3.52478 1.95583 -123.55253 476.03853
7135.0000 -126.96180 -123.27922 3.68259 1.97631 -123.27091 497.92861
7140.0000 -126.47675 -123.36408 3.11267 1.97467 -123.29349 473.07059
7145.0000 -126.63833 -123.42785 3.21048 1.97114 -123.34204 448.53432
7150.0000 -126.16167 -123.09415 3.06752 1.97227 -123.32647 456.98541
7155.0000 -126.27823 -123.64974 2.62850 1.96014 -123.49325 467.98398
7160.0000 -126.07517 -122.97190 3.10326 1.98479 -123.15422 493.79879
7165.0000 -126.72685 -124.25286 2.47399 1.95466 -123.56859 465.67595
7170.0000 -126.91145 -123.86775 3.04370 1.93349 -123.85984 471.37833
7175.0000 -127.09266 -124.15673 2.93593 1.93389 -123.85432 470.06758
7180.0000 -127.10053 -123.36095 3.73958 1.94663 -123.67913 506.37750
7185.0000 -127.04961 -123.33555 3.71406 1.95719 -123.53381 508.79417
7190.0000 -126.07570 -122.55466 3.52104 1.98912 -123.09472 526.52082
7195.0000 -126.66505 -123.64169 3.02336 1.97522 -123.28587 496.13283
7200.0000 -125.89089 -122.87351 3.01738 1.97970 -123.22426 489.03191
7205.0000 -127.15038 -123.74240 3.40798 1.97807 -123.24667 486.05475
7210.0000 -126.52104 -123.30980 3.21124 1.96972 -123.36159 491.13609
7215.0000 -126.48320 -122.91296 3.57024 2.00653 -122.85534 518.20750
7220.0000 -126.89416 -123.42446 3.46970 1.98300 -123.17889 490.62211
7225.0000 -126.45417 -123.50626 2.94791 1.94896 -123.64700 446.08948
7230.0000 -126.52291 -123.64789 2.87502 1.95631 -123.54597 474.50466
7235.0000 -125.99244 -123.19465 2.79780 1.94336 -123.72402 449.89620
7240.0000 -126.45648 -123.43475 3.02172 1.94998 -123.63299 465.61123
7245.0000 -125.67832 -122.58210 3.09622 1.95723 -123.53326 469.25584
7250.0000 -125.38718 -122.35903 3.02816 2.04623 -122.30933 550.68005
FREEZING PROCESS: loop number 30 T-loop= 456.00000000000000
main_MD> interactions number 30 at Temperature= 456.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.84786 0.47558 -0.09828
force_rgl> df(natom) 2.31787 1.32193 1.48403
7255.0000 -126.71981 -122.61827 4.10154 2.01458 -122.74465 517.80463
7260.0000 -127.16953 -123.83525 3.33428 1.99299 -123.04152 503.65798
7265.0000 -127.15251 -124.32215 2.83036 1.92918 -123.91900 455.50343
7270.0000 -126.91626 -123.73530 3.18096 1.91456 -124.12013 440.66944
7275.0000 -126.86608 -123.70616 3.15992 1.94811 -123.65866 489.38054
7280.0000 -126.56383 -124.01434 2.54949 1.94234 -123.73803 464.71608
7285.0000 -127.10497 -124.38089 2.72407 1.92500 -123.97651 457.48581
7290.0000 -126.42188 -123.95325 2.46863 1.92677 -123.95223 466.62097
7295.0000 -126.81971 -123.88322 2.93649 1.94640 -123.68217 479.32007
7300.0000 -126.90940 -124.07442 2.83498 1.95226 -123.60159 476.14680
7305.0000 -126.50954 -123.61096 2.89858 1.94290 -123.73036 455.33860
7310.0000 -126.55345 -123.36214 3.19131 1.94958 -123.63848 464.61092
7315.0000 -126.95404 -123.78294 3.17109 1.99207 -123.05413 505.09940
7320.0000 -126.61892 -123.40996 3.20895 1.95806 -123.52194 476.38157
7325.0000 -126.62303 -124.47686 2.14616 1.92617 -123.96038 455.72435
7330.0000 -126.79765 -123.75013 3.04752 1.91388 -124.12941 429.03410
7335.0000 -126.57161 -123.94820 2.62342 1.89717 -124.35932 421.90877
7340.0000 -126.89394 -124.01878 2.87516 1.96407 -123.43920 455.70095
7345.0000 -125.96147 -123.60680 2.35467 1.95423 -123.57452 442.49104
7350.0000 -126.26980 -123.59274 2.67706 1.95668 -123.54081 444.07573
7355.0000 -126.32939 -122.83443 3.49497 1.95311 -123.59000 419.21731
7360.0000 -126.54616 -123.42516 3.12100 1.98236 -123.18765 467.35270
7365.0000 -127.03797 -123.79133 3.24665 1.95155 -123.61138 444.50544
7370.0000 -127.30269 -124.45306 2.84963 1.91874 -124.06262 429.24506
7375.0000 -126.57600 -124.10132 2.47468 1.92825 -123.93186 428.26294
7380.0000 -126.17866 -123.71620 2.46247 1.94054 -123.76284 426.34744
7385.0000 -126.79205 -123.62337 3.16868 1.97169 -123.33436 438.48552
7390.0000 -127.49451 -124.12293 3.37159 1.92394 -123.99115 442.82543
7395.0000 -126.21874 -122.69617 3.52258 1.99164 -123.06011 517.60727
7400.0000 -127.17602 -124.11004 3.06598 1.96883 -123.37377 488.36114
7405.0000 -127.44421 -124.02416 3.42005 1.87106 -124.71830 436.84370
7410.0000 -127.55214 -124.64917 2.90297 1.89928 -124.33024 458.09099
7415.0000 -127.98911 -125.33921 2.64990 1.88198 -124.56811 440.05358
7420.0000 -128.17749 -125.24460 2.93288 1.84658 -125.05504 415.64830
7425.0000 -128.10707 -124.83009 3.27698 1.87790 -124.62424 436.83007
7430.0000 -127.24199 -124.80621 2.43578 1.84992 -125.00912 416.13201
7435.0000 -128.02382 -125.27876 2.74506 1.84391 -125.09172 415.77832
7440.0000 -127.54611 -124.13121 3.41489 1.86851 -124.75345 437.64976
7445.0000 -128.31710 -124.93439 3.38271 1.88068 -124.58608 453.54768
7450.0000 -128.50216 -125.60325 2.89891 1.79859 -125.71499 384.47770
7455.0000 -127.48384 -124.81531 2.66853 1.80862 -125.57700 389.66138
7460.0000 -127.26098 -125.31897 1.94202 1.83741 -125.18112 411.47488
7465.0000 -127.59340 -124.08398 3.50943 1.86383 -124.81783 440.07431
7470.0000 -127.53089 -124.39781 3.13308 1.91193 -124.15632 480.66052
7475.0000 -126.99840 -123.78147 3.21693 1.89745 -124.35545 468.65226
7480.0000 -127.87351 -124.29228 3.58122 1.91401 -124.12766 489.05731
7485.0000 -127.52276 -124.42087 3.10189 1.88062 -124.58689 461.63187
7490.0000 -126.95637 -124.20286 2.75351 1.89430 -124.39868 462.83385
7495.0000 -126.35853 -123.23458 3.12395 1.93402 -123.85243 473.71282
7500.0000 -127.13837 -124.27572 2.86264 1.92382 -123.99275 475.14386
FREEZING PROCESS: loop number 31 T-loop= 431.00000000000000
main_MD> interactions number 31 at Temperature= 431.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.34806 0.17059 -0.15001
force_rgl> df(natom) -2.23495 -1.61553 -1.67320
7505.0000 -127.20928 -124.59683 2.61245 1.88634 -124.50825 462.47443
7510.0000 -127.49903 -124.90851 2.59053 1.85199 -124.98063 420.23182
7515.0000 -127.73536 -125.07346 2.66190 1.86865 -124.75151 438.97480
7520.0000 -127.11573 -124.74182 2.37392 1.85263 -124.97182 417.67638
7525.0000 -127.39827 -124.35832 3.03995 1.87742 -124.63087 454.08253
7530.0000 -127.77962 -124.98313 2.79650 1.85899 -124.88435 439.12075
7535.0000 -127.27615 -124.60006 2.67609 1.85101 -124.99407 423.20250
7540.0000 -127.81095 -124.78526 3.02569 1.87679 -124.63948 444.00809
7545.0000 -127.65195 -124.96420 2.68774 1.85886 -124.88609 433.19201
7550.0000 -128.27646 -125.45956 2.81690 1.83206 -125.25470 419.56980
7555.0000 -127.41611 -124.73207 2.68405 1.85127 -124.99043 416.36778
7560.0000 -127.13256 -124.13563 2.99694 1.90165 -124.29758 430.27535
7565.0000 -127.33966 -124.55701 2.78265 1.88932 -124.46727 427.11290
7570.0000 -127.85024 -124.89852 2.95172 1.85639 -124.92011 439.47329
7575.0000 -127.87330 -125.02953 2.84377 1.85023 -125.00484 432.25959
7580.0000 -127.94020 -124.68784 3.25236 1.85187 -124.98221 425.30067
7585.0000 -128.01560 -125.62078 2.39482 1.83133 -125.26467 414.66253
7590.0000 -127.89470 -125.05469 2.84001 1.81094 -125.54507 388.43952
7595.0000 -127.73963 -124.87305 2.86658 1.82655 -125.33045 396.71280
7600.0000 -127.90262 -125.18767 2.71495 1.85798 -124.89823 430.04139
7605.0000 -128.21771 -125.32534 2.89237 1.81534 -125.48464 399.47382
7610.0000 -127.63204 -125.00018 2.63186 1.83805 -125.17226 419.95213
7615.0000 -128.48848 -125.70269 2.78580 1.81130 -125.54016 391.04724
7620.0000 -128.21129 -125.51303 2.69826 1.79269 -125.79617 380.51634
7625.0000 -128.27826 -126.03933 2.23894 1.79099 -125.81946 371.72859
7630.0000 -128.02346 -125.26049 2.76297 1.79672 -125.74065 384.52226
7635.0000 -128.10350 -125.57460 2.52890 1.80167 -125.67259 388.19738
7640.0000 -127.48026 -124.75575 2.72451 1.83169 -125.25977 404.00884
7645.0000 -127.49516 -124.54815 2.94701 1.87316 -124.68941 431.64503
7650.0000 -127.26351 -124.64086 2.62265 1.90612 -124.23611 458.27745
7655.0000 -127.31694 -124.33361 2.98333 1.88456 -124.53275 442.99171
7660.0000 -127.77590 -124.04828 3.72762 1.91690 -124.08791 454.97841
7665.0000 -127.10686 -124.36899 2.73787 1.88303 -124.55379 425.87228
7670.0000 -127.40522 -124.23752 3.16770 1.90409 -124.26409 463.83782
7675.0000 -127.54445 -125.08453 2.45992 1.85977 -124.87361 429.82751
7680.0000 -127.67044 -125.31412 2.35631 1.83487 -125.21599 414.24189
7685.0000 -128.05039 -125.58703 2.46336 1.82247 -125.38657 395.08099
7690.0000 -127.52592 -124.88509 2.64083 1.82087 -125.40851 391.13381
7695.0000 -127.82699 -125.02773 2.79926 1.85228 -124.97661 420.37861
7700.0000 -127.27690 -124.81736 2.45954 1.86070 -124.86080 424.27307
7705.0000 -127.88536 -124.85134 3.03403 1.85399 -124.95313 420.66865
7710.0000 -127.07685 -124.72722 2.34963 1.86298 -124.82950 432.77128
7715.0000 -127.99043 -125.11525 2.87518 1.87124 -124.71586 458.24257
7720.0000 -127.94305 -124.58183 3.36123 1.83344 -125.23566 402.33741
7725.0000 -127.65122 -125.18189 2.46933 1.87242 -124.69967 440.74855
7730.0000 -127.54489 -124.25900 3.28590 1.87314 -124.68975 442.32517
7735.0000 -127.76906 -125.05687 2.71220 1.84125 -125.12824 410.33369
7740.0000 -127.03485 -124.53763 2.49722 1.87256 -124.69773 438.75535
7745.0000 -127.67871 -125.06308 2.61563 1.86948 -124.74005 437.85699
7750.0000 -128.15865 -124.99769 3.16096 1.87284 -124.69392 438.84440
FREEZING PROCESS: loop number 32 T-loop= 406.00000000000000
main_MD> interactions number 32 at Temperature= 406.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.07083 -0.82909 -1.99348
force_rgl> df(natom) 0.40057 -0.17238 0.65650
7755.0000 -128.13466 -125.48091 2.65374 1.82757 -125.31646 405.94417
7760.0000 -128.33202 -126.15671 2.17531 1.79229 -125.80156 369.84904
7765.0000 -127.88604 -125.48535 2.40069 1.79738 -125.73165 368.95047
7770.0000 -127.20287 -124.86265 2.34021 1.86574 -124.79152 431.04492
7775.0000 -127.77989 -125.14683 2.63306 1.84685 -125.05133 416.13684
7780.0000 -128.21057 -125.04355 3.16703 1.85141 -124.98861 415.06203
7785.0000 -127.73374 -124.60246 3.13128 1.85876 -124.88755 432.96174
7790.0000 -126.92792 -124.72516 2.20276 1.85413 -124.95122 415.66876
7795.0000 -128.07708 -124.60674 3.47034 1.86729 -124.77019 447.11113
7800.0000 -128.03688 -125.32354 2.71334 1.86420 -124.81271 443.92634
7805.0000 -128.53188 -125.87518 2.65671 1.79028 -125.82932 374.97111
7810.0000 -128.26381 -125.80413 2.45968 1.77631 -126.02138 360.71964
7815.0000 -127.87869 -125.21465 2.66405 1.82209 -125.39177 405.19861
7820.0000 -128.72776 -125.76526 2.96249 1.82509 -125.35052 403.37290
7825.0000 -127.65509 -125.10714 2.54795 1.83036 -125.27812 413.24896
7830.0000 -128.00714 -125.73877 2.26837 1.86429 -124.81144 438.95197
7835.0000 -128.05738 -125.41651 2.64087 1.79788 -125.72480 381.31515
7840.0000 -128.35838 -125.75377 2.60460 1.81869 -125.43860 411.26110
7845.0000 -128.53809 -126.05071 2.48739 1.79406 -125.77723 381.75198
7850.0000 -128.21921 -125.39564 2.82357 1.80742 -125.59359 385.84587
7855.0000 -127.97076 -124.98530 2.98545 1.83214 -125.25363 414.68769
7860.0000 -127.33981 -124.88400 2.45581 1.85790 -124.89934 439.58048
7865.0000 -128.56375 -125.78512 2.77862 1.82952 -125.28959 412.37134
7870.0000 -128.44189 -126.11548 2.32641 1.80739 -125.59394 390.75662
7875.0000 -128.11974 -125.65408 2.46566 1.80213 -125.66625 390.72647
7880.0000 -128.36951 -125.75581 2.61369 1.78568 -125.89255 370.38420
7885.0000 -128.29152 -125.62532 2.66619 1.79346 -125.78547 375.30604
7890.0000 -127.73671 -125.52278 2.21393 1.81874 -125.43780 398.83657
7895.0000 -127.58054 -124.69545 2.88509 1.86642 -124.78214 429.74346
7900.0000 -128.34144 -125.75486 2.58659 1.84222 -125.11491 414.22744
7905.0000 -128.45588 -126.46273 1.99316 1.76285 -126.20644 347.93423
7910.0000 -128.33182 -125.34768 2.98414 1.78115 -125.95476 362.27191
7915.0000 -127.42678 -124.27373 3.15305 1.88002 -124.59509 457.59351
7920.0000 -127.57813 -124.61424 2.96389 1.88007 -124.59437 455.58847
7925.0000 -128.24258 -125.24956 2.99303 1.83323 -125.23862 396.71772
7930.0000 -128.16649 -124.75257 3.41393 1.84804 -125.03498 431.08206
7935.0000 -128.46850 -125.65261 2.81589 1.84191 -125.11919 424.91169
7940.0000 -128.26977 -125.75417 2.51560 1.80931 -125.56750 395.83867
7945.0000 -128.06292 -125.29940 2.76351 1.81434 -125.49841 404.29324
7950.0000 -128.20947 -125.29827 2.91120 1.83375 -125.23142 415.50952
7955.0000 -128.02002 -125.47196 2.54806 1.82728 -125.32038 411.63897
7960.0000 -128.40944 -125.81256 2.59688 1.83051 -125.27602 413.21823
7965.0000 -128.16260 -125.26129 2.90131 1.81485 -125.49137 394.68738
7970.0000 -128.33635 -125.45500 2.88135 1.85026 -125.00435 429.99199
7975.0000 -127.39789 -124.82310 2.57479 1.83610 -125.19910 418.44964
7980.0000 -127.93976 -125.51952 2.42024 1.82159 -125.39867 407.01774
7985.0000 -128.34070 -125.73785 2.60286 1.80136 -125.67687 385.66525
7990.0000 -128.22412 -125.60900 2.61512 1.82015 -125.41843 398.61032
7995.0000 -128.07695 -125.50064 2.57631 1.82519 -125.34916 414.11139
8000.0000 -129.01253 -126.00496 3.00756 1.80560 -125.61860 390.73044
FREEZING PROCESS: loop number 33 T-loop= 381.00000000000000
main_MD> interactions number 33 at Temperature= 381.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.32326 0.33725 -1.90896
force_rgl> df(natom) 5.67084 2.76440 -4.96043
8005.0000 -128.38676 -125.62768 2.75908 1.81315 -125.51478 381.67470
8010.0000 -128.12817 -125.80712 2.32105 1.78143 -125.95097 366.03916
8015.0000 -128.34308 -125.92129 2.42179 1.78938 -125.84167 373.03849
8020.0000 -128.17363 -125.79681 2.37682 1.79596 -125.75117 372.06485
8025.0000 -128.23225 -125.47982 2.75243 1.81767 -125.45252 392.18483
8030.0000 -128.09215 -125.83319 2.25896 1.81061 -125.54964 395.62712
8035.0000 -128.17424 -125.97488 2.19936 1.78357 -125.92160 370.93654
8040.0000 -128.48692 -126.14778 2.33914 1.76539 -126.17156 349.16781
8045.0000 -127.95704 -125.82576 2.13128 1.78936 -125.84191 369.98096
8050.0000 -128.04324 -125.64830 2.39494 1.81539 -125.48399 398.89709
8055.0000 -128.08599 -125.52105 2.56493 1.79348 -125.78532 377.62724
8060.0000 -127.91721 -125.57571 2.34150 1.81678 -125.46479 403.52864
8065.0000 -127.84531 -125.62566 2.21965 1.83217 -125.25321 416.65462
8070.0000 -128.34497 -125.70144 2.64353 1.81043 -125.55222 390.00821
8075.0000 -128.02672 -124.97357 3.05315 1.82276 -125.38261 411.37875
8080.0000 -128.13605 -125.56649 2.56956 1.79476 -125.76765 379.96739
8085.0000 -128.33600 -125.89426 2.44174 1.78579 -125.89104 365.63240
8090.0000 -128.13643 -125.60603 2.53040 1.80173 -125.67177 383.78569
8095.0000 -128.42733 -125.65429 2.77303 1.83299 -125.24187 416.82913
8100.0000 -128.16366 -125.56828 2.59538 1.82647 -125.33156 411.37959
8105.0000 -128.71197 -125.90370 2.80826 1.78953 -125.83959 379.62272
8110.0000 -128.58078 -126.13882 2.44196 1.77915 -125.98239 367.66420
8115.0000 -127.93219 -125.55040 2.38179 1.80209 -125.66679 388.75276
8120.0000 -128.14133 -125.45634 2.68499 1.81462 -125.49447 402.94003
8125.0000 -127.84691 -125.37203 2.47488 1.82204 -125.39244 406.78149
8130.0000 -128.15333 -125.54109 2.61224 1.81896 -125.43481 398.03327
8135.0000 -128.74238 -126.00131 2.74107 1.80628 -125.60918 389.10619
8140.0000 -127.78299 -124.86715 2.91584 1.84553 -125.06938 430.79310
8145.0000 -128.59772 -125.51729 3.08043 1.83422 -125.22493 413.67703
8150.0000 -127.79952 -125.45152 2.34801 1.80383 -125.64287 396.08105
8155.0000 -128.54323 -126.03363 2.50959 1.82320 -125.37658 408.95408
8160.0000 -128.34289 -125.85418 2.48871 1.79233 -125.80102 371.81113
8165.0000 -127.59549 -125.10230 2.49319 1.79713 -125.73504 373.58075
8170.0000 -128.12627 -125.49636 2.62991 1.83106 -125.26837 408.28060
8175.0000 -128.39215 -125.57212 2.82004 1.80692 -125.60036 389.10116
8180.0000 -128.30299 -126.09820 2.20479 1.78460 -125.90734 369.11843
8185.0000 -127.83560 -124.94531 2.89029 1.80751 -125.59235 386.53637
8190.0000 -128.39025 -125.93721 2.45304 1.81937 -125.42917 410.18004
8195.0000 -128.53570 -126.08394 2.45176 1.78192 -125.94418 370.15364
8200.0000 -128.40180 -125.79651 2.60529 1.78950 -125.84002 373.73289
8205.0000 -128.19966 -125.44429 2.75537 1.78978 -125.83612 373.43563
8210.0000 -127.99511 -125.20749 2.78762 1.82130 -125.40270 402.89571
8215.0000 -128.08515 -125.41081 2.67434 1.82351 -125.37220 411.53859
8220.0000 -128.14929 -125.64025 2.50904 1.81327 -125.51308 392.90418
8225.0000 -128.58388 -126.09166 2.49222 1.79285 -125.79385 370.79363
8230.0000 -128.34083 -126.26203 2.07880 1.74898 -126.39727 337.08904
8235.0000 -127.80976 -125.48696 2.32280 1.78770 -125.86479 377.10039
8240.0000 -127.66685 -125.15966 2.50719 1.83697 -125.18712 426.71211
8245.0000 -127.87425 -125.36231 2.51194 1.81000 -125.55811 392.22134
8250.0000 -128.14411 -125.29774 2.84636 1.80204 -125.66749 387.14148
FREEZING PROCESS: loop number 34 T-loop= 356.00000000000000
main_MD> interactions number 34 at Temperature= 356.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.46263 0.13450 -2.11388
force_rgl> df(natom) 5.22632 0.62327 1.80160
8255.0000 -128.64538 -126.67663 1.96875 1.75479 -126.31730 341.50837
8260.0000 -128.42767 -125.56964 2.85803 1.77215 -126.07855 356.92547
8265.0000 -128.45400 -126.02037 2.43364 1.76452 -126.18354 348.14805
8270.0000 -128.13539 -125.70619 2.42920 1.77947 -125.97796 364.96787
8275.0000 -128.09324 -125.39191 2.70133 1.77261 -126.07230 357.12960
8280.0000 -128.41748 -126.31425 2.10323 1.77814 -125.99617 362.13378
8285.0000 -128.31303 -126.17090 2.14213 1.75945 -126.25324 346.96055
8290.0000 -128.36008 -126.09958 2.26050 1.77930 -125.98033 355.53378
8295.0000 -128.05512 -125.20715 2.84797 1.79327 -125.78820 377.50701
8300.0000 -128.31302 -125.54334 2.76968 1.82034 -125.41584 395.54813
8305.0000 -127.98689 -125.51765 2.46924 1.81746 -125.45546 395.43779
8310.0000 -128.53059 -126.43708 2.09351 1.78180 -125.94594 364.66652
8315.0000 -128.75052 -126.28554 2.46497 1.75777 -126.27639 339.86854
8320.0000 -128.80908 -126.21863 2.59046 1.73705 -126.56127 320.93081
8325.0000 -128.60143 -126.48978 2.11165 1.75045 -126.37695 339.39867
8330.0000 -128.74794 -126.27046 2.47748 1.76275 -126.20785 347.94399
8335.0000 -128.59439 -126.12382 2.47056 1.76885 -126.12402 351.68721
8340.0000 -128.13919 -125.85250 2.28668 1.79675 -125.74029 378.69385
8345.0000 -128.72571 -125.95268 2.77303 1.78750 -125.86753 369.28843
8350.0000 -128.81090 -126.35318 2.45772 1.74368 -126.47013 328.64483
8355.0000 -128.95581 -126.59362 2.36219 1.75633 -126.29620 335.02454
8360.0000 -128.71432 -126.64318 2.07114 1.71850 -126.81644 306.90105
8365.0000 -128.34238 -126.18665 2.15572 1.74372 -126.46952 330.32889
8370.0000 -128.36043 -126.11317 2.24726 1.76738 -126.14420 359.20214
8375.0000 -128.70849 -126.38595 2.32254 1.77024 -126.10488 352.45148
8380.0000 -128.90849 -126.63462 2.27387 1.73250 -126.62393 322.03930
8385.0000 -128.81852 -126.26189 2.55663 1.75054 -126.37574 331.06910
8390.0000 -127.98855 -125.72231 2.26624 1.78773 -125.86438 379.58157
8395.0000 -128.42730 -126.09911 2.32819 1.77538 -126.03413 363.31746
8400.0000 -128.52922 -126.11747 2.41175 1.76127 -126.22818 349.20415
8405.0000 -128.78788 -126.68561 2.10227 1.75110 -126.36807 331.52051
8410.0000 -128.74975 -126.40837 2.34138 1.73442 -126.59753 318.27451
8415.0000 -128.22120 -126.22132 1.99988 1.77259 -126.07256 356.26363
8420.0000 -128.28406 -125.90243 2.38163 1.75350 -126.33502 338.25619
8425.0000 -128.54269 -125.86855 2.67414 1.77335 -126.06206 361.14734
8430.0000 -128.34490 -125.89256 2.45234 1.77584 -126.02791 358.22861
8435.0000 -128.49574 -125.75534 2.74040 1.77261 -126.07232 355.76913
8440.0000 -128.37898 -125.63050 2.74849 1.80751 -125.59234 390.87688
8445.0000 -128.27407 -126.02030 2.25377 1.79552 -125.75721 381.17100
8450.0000 -128.56540 -126.03936 2.52604 1.77816 -125.99600 363.09176
8455.0000 -128.16883 -126.23884 1.92999 1.77867 -125.98892 357.89869
8460.0000 -128.24069 -125.68559 2.55510 1.77321 -126.06399 352.98738
8465.0000 -128.31710 -126.18082 2.13627 1.78557 -125.89400 372.60005
8470.0000 -128.62945 -126.71674 1.91271 1.73753 -126.55469 324.44740
8475.0000 -128.39989 -126.57227 1.82761 1.73040 -126.65272 314.74031
8480.0000 -128.66830 -126.00491 2.66339 1.75715 -126.28485 346.03647
8485.0000 -128.26726 -125.65548 2.61179 1.79006 -125.83234 375.07941
8490.0000 -128.39859 -125.93271 2.46588 1.79197 -125.80598 378.75334
8495.0000 -128.72666 -126.67319 2.05347 1.75875 -126.26293 333.31303
8500.0000 -128.91333 -126.81327 2.10006 1.73258 -126.62281 316.28643
FREEZING PROCESS: loop number 35 T-loop= 331.00000000000000
main_MD> interactions number 35 at Temperature= 331.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.84770 1.08827 3.63673
force_rgl> df(natom) -0.07016 -0.86791 -0.15650
8505.0000 -128.82212 -126.44947 2.37265 1.72913 -126.67029 313.88307
8510.0000 -128.46096 -126.21513 2.24583 1.75947 -126.25293 347.63542
8515.0000 -128.74744 -126.89932 1.84811 1.73972 -126.52464 318.31695
8520.0000 -128.38933 -126.34536 2.04397 1.71995 -126.79648 305.64848
8525.0000 -128.53614 -126.65235 1.88379 1.73022 -126.65527 312.11414
8530.0000 -128.65913 -126.66582 1.99331 1.72406 -126.73993 305.38316
8535.0000 -128.47177 -126.12495 2.34682 1.74694 -126.42524 332.52950
8540.0000 -128.57788 -126.22661 2.35126 1.76393 -126.19166 338.79712
8545.0000 -128.41239 -126.18442 2.22797 1.75801 -126.27310 335.03851
8550.0000 -128.27736 -125.92421 2.35315 1.77136 -126.08944 349.81002
8555.0000 -128.65247 -126.61596 2.03651 1.74203 -126.49287 328.80179
8560.0000 -128.91402 -126.61208 2.30194 1.72628 -126.70941 309.31378
8565.0000 -128.56106 -126.03015 2.53091 1.74581 -126.44078 331.54036
8570.0000 -128.59293 -126.14793 2.44499 1.77756 -126.00415 362.50126
8575.0000 -128.61982 -126.62932 1.99050 1.75867 -126.26398 347.21323
8580.0000 -129.01201 -127.08486 1.92715 1.72803 -126.68539 313.47725
8585.0000 -128.90444 -126.66154 2.24290 1.72222 -126.76525 311.57851
8590.0000 -128.88431 -126.66650 2.21780 1.73821 -126.54535 319.27328
8595.0000 -128.33048 -126.35718 1.97329 1.72176 -126.77164 307.16964
8600.0000 -128.85387 -126.63160 2.22227 1.72554 -126.71956 312.52453
8605.0000 -129.03348 -126.77918 2.25430 1.73230 -126.62656 315.72578
8610.0000 -128.32704 -126.21130 2.11573 1.74480 -126.45466 327.31096
8615.0000 -128.18366 -126.25426 1.92939 1.76150 -126.22509 346.41049
8620.0000 -128.85851 -126.23643 2.62207 1.77698 -126.01214 353.39238
8625.0000 -128.96588 -126.94570 2.02018 1.73690 -126.56336 329.33730
8630.0000 -128.43602 -126.70389 1.73213 1.72246 -126.76192 309.14482
8635.0000 -129.04604 -126.39139 2.65465 1.72393 -126.74168 307.94572
8640.0000 -128.75302 -126.28744 2.46558 1.74674 -126.42808 330.18243
8645.0000 -128.30852 -126.16209 2.14642 1.75909 -126.25819 350.20764
8650.0000 -128.30609 -125.84511 2.46098 1.77335 -126.06212 354.99418
8655.0000 -128.72439 -126.81304 1.91135 1.76471 -126.18092 358.44798
8660.0000 -128.85529 -126.75582 2.09946 1.71820 -126.82060 300.05893
8665.0000 -128.81879 -126.50781 2.31099 1.76004 -126.24517 327.51657
8670.0000 -128.10402 -125.97403 2.12998 1.76919 -126.11932 356.10274
8675.0000 -128.74633 -126.19007 2.55626 1.76994 -126.10902 361.18977
8680.0000 -128.53391 -126.11527 2.41864 1.75700 -126.28692 335.45523
8685.0000 -128.39725 -125.54642 2.85083 1.78021 -125.96775 359.60436
8690.0000 -128.58977 -126.20556 2.38421 1.80551 -125.61975 389.63255
8695.0000 -128.82289 -126.78636 2.03654 1.73772 -126.55203 329.40317
8700.0000 -128.76852 -126.61182 2.15670 1.71572 -126.85469 301.80939
8705.0000 -128.06377 -126.02457 2.03919 1.78052 -125.96353 362.71298
8710.0000 -128.48350 -126.01505 2.46844 1.77041 -126.10248 353.17182
8715.0000 -128.36294 -126.41645 1.94650 1.77452 -126.04602 356.90734
8720.0000 -128.30042 -126.01473 2.28570 1.77269 -126.07114 357.41846
8725.0000 -128.56512 -125.94298 2.62214 1.77948 -125.97780 356.91066
8730.0000 -128.57694 -126.09201 2.48493 1.73412 -126.60162 318.84254
8735.0000 -128.62729 -126.26313 2.36416 1.77178 -126.08373 355.67009
8740.0000 -128.87540 -126.61583 2.25956 1.74847 -126.40424 332.69282
8745.0000 -128.39082 -126.61496 1.77586 1.73430 -126.59909 317.56966
8750.0000 -129.06786 -126.65774 2.41012 1.72676 -126.70278 310.37332
FREEZING PROCESS: loop number 36 T-loop= 306.00000000000000
main_MD> interactions number 36 at Temperature= 306.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.80719 -1.00583 1.15915
force_rgl> df(natom) 1.46607 -1.52696 2.27705
8755.0000 -128.95230 -126.75867 2.19363 1.72131 -126.77783 307.79791
8760.0000 -129.22150 -127.45097 1.77052 1.68394 -127.29164 272.68678
8765.0000 -128.88729 -126.82479 2.06250 1.68490 -127.27846 275.27121
8770.0000 -128.51142 -126.49623 2.01519 1.73599 -126.57594 318.22563
8775.0000 -128.56752 -126.31923 2.24829 1.74624 -126.43487 329.43757
8780.0000 -128.67350 -126.74016 1.93334 1.73728 -126.55816 312.67873
8785.0000 -128.79138 -126.66406 2.12732 1.73135 -126.63974 316.73523
8790.0000 -128.57631 -126.49808 2.07823 1.74158 -126.49898 327.96692
8795.0000 -129.16587 -127.26828 1.89759 1.71363 -126.88332 301.36732
8800.0000 -128.91940 -127.18257 1.73682 1.67784 -127.37556 265.68999
8805.0000 -128.77393 -126.45860 2.31533 1.72508 -126.72598 312.11116
8810.0000 -128.62765 -126.58990 2.03775 1.72414 -126.73885 309.38024
8815.0000 -128.20556 -126.08816 2.11740 1.75108 -126.36843 335.84445
8820.0000 -128.85907 -126.91781 1.94126 1.74045 -126.51453 324.60349
8825.0000 -128.80811 -126.82178 1.98632 1.71706 -126.83619 307.17502
8830.0000 -128.57443 -126.83022 1.74421 1.72303 -126.75418 302.96189
8835.0000 -129.28079 -127.27202 2.00877 1.70816 -126.95863 298.54856
8840.0000 -128.77521 -126.53950 2.23571 1.72017 -126.79344 312.95630
8845.0000 -127.94824 -125.65320 2.29504 1.77686 -126.01386 356.60902
8850.0000 -128.79065 -126.63465 2.15601 1.74594 -126.43900 312.79477
8855.0000 -128.47165 -126.56771 1.90394 1.73722 -126.55898 301.32584
8860.0000 -128.79602 -126.68651 2.10951 1.74386 -126.46764 319.95523
8865.0000 -128.82194 -126.80361 2.01832 1.74090 -126.50836 321.20684
8870.0000 -128.51342 -126.41300 2.10042 1.73371 -126.60720 319.53458
8875.0000 -128.80510 -126.80741 1.99768 1.72731 -126.69532 314.22174
8880.0000 -128.99388 -126.82697 2.16691 1.70726 -126.97099 292.06232
8885.0000 -128.52743 -126.50592 2.02150 1.71993 -126.79678 308.00315
8890.0000 -128.68982 -126.67480 2.01501 1.73072 -126.64841 313.86872
8895.0000 -128.86640 -127.22990 1.63649 1.72382 -126.74330 306.53826
8900.0000 -128.97079 -127.39483 1.57596 1.70542 -126.99627 290.96966
8905.0000 -128.94060 -126.68851 2.25209 1.69440 -127.14783 278.36114
8910.0000 -128.26054 -126.31858 1.94196 1.74477 -126.45515 328.75860
8915.0000 -128.51940 -126.22224 2.29717 1.77002 -126.10787 352.99994
8920.0000 -128.82860 -126.48241 2.34619 1.75595 -126.30135 344.82307
8925.0000 -128.75325 -126.57588 2.17736 1.73986 -126.52263 329.99493
8930.0000 -128.66738 -126.47251 2.19488 1.74115 -126.50490 329.95383
8935.0000 -128.72671 -126.81133 1.91538 1.74039 -126.51537 324.86272
8940.0000 -128.70427 -126.66173 2.04254 1.70739 -126.96916 300.57904
8945.0000 -128.51890 -126.37157 2.14733 1.73628 -126.57186 317.27655
8950.0000 -128.67885 -127.03898 1.63987 1.73340 -126.61147 318.72205
8955.0000 -129.03900 -126.66144 2.37757 1.71349 -126.88529 299.10676
8960.0000 -128.85931 -126.92268 1.93663 1.71907 -126.80859 305.51291
8965.0000 -128.84573 -126.62792 2.21781 1.72119 -126.77947 306.35283
8970.0000 -128.36635 -126.45882 1.90753 1.73574 -126.57936 327.57469
8975.0000 -128.91551 -126.66828 2.24723 1.74170 -126.49741 327.08108
8980.0000 -128.64646 -126.54852 2.09794 1.73534 -126.58485 315.53655
8985.0000 -128.82134 -126.65246 2.16888 1.74937 -126.39187 324.74120
8990.0000 -129.35152 -127.75663 1.59489 1.68308 -127.30352 268.68212
8995.0000 -129.22179 -127.51883 1.70295 1.66548 -127.54560 253.66607
9000.0000 -128.90712 -126.57930 2.32782 1.71354 -126.88461 301.76224
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 9 [min], 5.2788865 [s].
main_MD> Deallocating global variables
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