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nanoparticlesims/growth_Melting_Silver_ICO_2451/freezeSims/run_69/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_69.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 = 69 ntipo2 = 0
read_input> Finish reading input
main_MD> Allocating global variables
main_MD> Number of outputs that will be created: 1750
main_MD> Size of nv and nvoiz: 69 6900
main_MD> Size of nv and nvoiz: 69 6900
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 = 69
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> 5.3751756365613287E-002 -5.9903243334005964E-002 -0.11512854642391296 initial drift of cluster / NP1 for coalescence
init> 0.34600453854098878 0.35431975190665066 0.32092241499056512 scaling for velocity /for coalescence NP1
init.f90 > facguy = 3.6943536297451667E-003
preparo> IN BIGVOI : LIMIT 1.2247448652052084 1.2247448652052084 1.2247448652052084
preparo> END t=0 TIME STEP
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.40463 -0.16213 -1.03373
force_rgl> df(natom) -3.70995 1.00832 0.78827
preparo> THERMALIZATION PROCESS AT 1181.9275577335693
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -150.12459119461246 13.500428883115879 -163.62502007772835 6.7223219501086860E-004
preparo> END THERMALISATION ON NPAST DEFINE IN PARACLUSTER MODULE
main_MD> Time-loop is starting for freezing
main_MD> Now the computation of EXECUTION TIME starts
main_MD> Running from loop 1 to 35
FREEZING PROCESS: loop number 1 T-loop= 1159.0000000000000
main_MD> interactions number 1 at Temperature= 1159.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.94817 -1.05393 -0.64739
force_rgl> df(natom) 0.89484 -1.17072 0.70862
5.0000 -161.68449 -150.00360 11.68089 3.14494 -150.64320 1221.95474
10.0000 -162.59284 -152.41428 10.17856 3.14885 -150.57743 1239.79659
15.0000 -162.29576 -151.55772 10.73804 3.02222 -152.70774 1133.93160
20.0000 -164.49882 -153.76744 10.73138 2.98128 -153.39636 1115.17491
25.0000 -163.77332 -153.65401 10.11931 2.91829 -154.45607 1098.98929
30.0000 -161.08558 -152.33233 8.75325 2.95056 -153.91317 1107.27152
35.0000 -162.71316 -151.92467 10.78849 3.05563 -152.14559 1133.08064
40.0000 -162.95167 -151.79330 11.15837 3.08334 -151.67951 1190.64349
45.0000 -163.53132 -154.18960 9.34172 2.95307 -153.87089 1095.16616
50.0000 -161.69053 -151.61941 10.07112 3.02486 -152.66330 1162.47814
55.0000 -160.96177 -151.58169 9.38008 3.05518 -152.15314 1186.07177
60.0000 -162.69440 -152.14414 10.55027 3.10668 -151.28685 1190.38953
65.0000 -162.22593 -152.41558 9.81035 3.11336 -151.17437 1201.05364
70.0000 -163.30150 -152.23758 11.06393 3.06764 -151.94354 1141.80299
75.0000 -162.82744 -151.97888 10.84856 3.07711 -151.78421 1184.90534
80.0000 -162.64993 -152.36513 10.28480 3.11273 -151.18498 1211.65932
85.0000 -164.58810 -153.74381 10.84429 2.98937 -153.26033 1104.10460
90.0000 -163.17301 -152.20915 10.96386 3.02437 -152.67148 1127.21417
95.0000 -162.79088 -153.87287 8.91801 3.05077 -152.22735 1144.24686
100.0000 -162.64839 -152.18643 10.46196 3.01808 -152.77736 1157.64574
105.0000 -163.50789 -153.18514 10.32274 3.07349 -151.84514 1165.25317
110.0000 -163.76763 -152.85010 10.91753 3.08414 -151.66592 1195.76830
115.0000 -161.20975 -150.53774 10.67201 3.04922 -152.25343 1127.94688
120.0000 -160.93069 -148.12762 12.80307 3.24446 -148.96888 1293.05553
125.0000 -161.05843 -150.90531 10.15312 3.22372 -149.31783 1221.50280
130.0000 -160.87662 -151.53094 9.34569 3.03377 -152.51334 1102.97252
135.0000 -161.54640 -150.91918 10.62722 3.12474 -150.98291 1230.89922
140.0000 -162.15625 -150.12895 12.02730 3.11586 -151.13240 1199.16629
145.0000 -162.25699 -150.59481 11.66218 3.14208 -150.69120 1214.04559
150.0000 -163.64026 -152.11188 11.52838 3.12963 -150.90078 1208.55213
155.0000 -162.16345 -153.08820 9.07525 3.13107 -150.87654 1212.26606
160.0000 -162.42795 -150.75021 11.67775 3.08702 -151.61759 1168.04283
165.0000 -161.01702 -151.25718 9.75985 3.10495 -151.31591 1199.29323
170.0000 -160.45386 -151.24963 9.20423 3.08390 -151.67010 1182.76066
175.0000 -163.30424 -152.43439 10.86985 3.04788 -152.27607 1135.78224
180.0000 -163.04605 -153.23375 9.81230 3.03155 -152.55078 1146.38993
185.0000 -162.79562 -153.51043 9.28519 3.01636 -152.80626 1158.28197
190.0000 -165.80448 -153.01342 12.79106 3.03676 -152.46302 1158.57641
195.0000 -164.51728 -153.35871 11.15857 3.10773 -151.26909 1175.45520
200.0000 -161.69951 -151.61353 10.08598 3.02188 -152.71336 1113.74869
205.0000 -163.29210 -152.93690 10.35521 3.08288 -151.68727 1211.06335
210.0000 -158.47205 -147.66357 10.80847 3.20714 -149.59681 1242.28383
215.0000 -163.56418 -152.92748 10.63670 3.14609 -150.62378 1206.66317
220.0000 -161.33757 -151.31446 10.02311 3.08813 -151.59887 1170.63571
225.0000 -163.77184 -153.80668 9.96516 3.06608 -151.96980 1163.58590
230.0000 -162.32381 -151.83206 10.49175 3.00695 -152.96458 1153.79849
235.0000 -164.15025 -153.91491 10.23534 3.03200 -152.54321 1177.23506
240.0000 -161.07446 -150.99649 10.07797 2.99574 -153.15312 1110.94001
245.0000 -161.94153 -150.70775 11.23378 3.16061 -150.37953 1239.27181
250.0000 -161.76064 -152.41450 9.34615 3.15269 -150.51281 1230.87688
FREEZING PROCESS: loop number 2 T-loop= 1134.0000000000000
main_MD> interactions number 2 at Temperature= 1134.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.34198 1.87703 -1.32287
force_rgl> df(natom) 0.20494 -0.21441 0.36115
255.0000 -162.32257 -151.55827 10.76431 3.08297 -151.68567 1144.11339
260.0000 -160.60673 -150.56443 10.04230 3.12573 -150.96628 1181.26245
265.0000 -162.83022 -151.81309 11.01713 3.17445 -150.14676 1245.09506
270.0000 -162.41382 -152.20616 10.20766 2.96538 -153.66384 1109.68094
275.0000 -162.05065 -151.59084 10.45981 3.00800 -152.94695 1143.39451
280.0000 -163.56597 -152.98798 10.57800 3.02506 -152.65992 1149.10253
285.0000 -161.04049 -151.60986 9.43062 3.05208 -152.20533 1138.58405
290.0000 -162.27401 -152.61338 9.66064 3.06719 -151.95121 1164.17912
295.0000 -162.95054 -151.95975 10.99079 3.02721 -152.62377 1099.96004
300.0000 -159.53424 -148.40013 11.13411 3.16826 -150.25086 1232.44198
305.0000 -160.84290 -151.68857 9.15433 3.15665 -150.44624 1205.55743
310.0000 -161.47407 -153.35276 8.12131 3.00555 -152.98813 1108.82468
315.0000 -162.17460 -151.26829 10.90631 3.06375 -152.00894 1183.62791
320.0000 -163.70827 -152.62744 11.08083 3.02311 -152.69263 1168.94152
325.0000 -161.72434 -151.45219 10.27215 3.06443 -151.99759 1185.16537
330.0000 -162.50298 -151.70614 10.79684 3.02283 -152.69740 1135.70467
335.0000 -162.12356 -151.63350 10.49006 3.11539 -151.14035 1215.23111
340.0000 -162.47595 -152.19686 10.27909 3.09194 -151.53482 1186.48276
345.0000 -160.70543 -150.60894 10.09649 3.06626 -151.96673 1185.01899
350.0000 -160.14830 -149.34471 10.80358 3.11733 -151.10764 1195.33212
355.0000 -161.10194 -150.76537 10.33657 3.22961 -149.21877 1281.56469
360.0000 -161.43489 -151.05791 10.37698 3.12433 -150.98988 1187.30888
365.0000 -160.75472 -151.75816 8.99655 3.11626 -151.12557 1185.82095
370.0000 -164.11280 -153.18541 10.92739 3.03766 -152.44795 1099.40536
375.0000 -161.62657 -150.71859 10.90798 3.02845 -152.60281 1115.10264
380.0000 -162.95044 -153.91502 9.03543 3.08590 -151.63637 1129.39768
385.0000 -162.23842 -152.81870 9.41973 2.92225 -154.38942 1075.83885
390.0000 -162.22487 -150.25483 11.97004 3.10642 -151.29119 1212.77913
395.0000 -164.55467 -154.56729 9.98738 3.01426 -152.84154 1124.78172
400.0000 -163.45998 -154.73544 8.72454 2.81689 -156.16198 1020.75309
405.0000 -163.33777 -151.34301 11.99476 2.99124 -153.22879 1118.05468
410.0000 -163.53384 -153.89629 9.63755 2.97107 -153.56822 1083.43154
415.0000 -164.25002 -154.35070 9.89932 3.00400 -153.01418 1118.61487
420.0000 -162.40909 -152.53418 9.87491 2.98928 -153.26178 1118.04682
425.0000 -165.27945 -155.60339 9.67606 2.92109 -154.40900 1055.51926
430.0000 -161.20584 -149.77032 11.43551 3.05428 -152.16831 1159.51471
435.0000 -161.35922 -149.57080 11.78842 3.21946 -149.38955 1308.76139
440.0000 -162.04496 -150.98670 11.05826 3.20214 -149.68091 1238.26820
445.0000 -162.64977 -152.89386 9.75591 3.01170 -152.88462 1086.19717
450.0000 -162.65806 -153.61478 9.04328 2.92535 -154.33731 1051.79506
455.0000 -162.56327 -151.86341 10.69986 3.07957 -151.74291 1176.94019
460.0000 -161.74064 -151.27819 10.46245 3.09857 -151.42330 1189.27830
465.0000 -164.71489 -154.54038 10.17451 2.98161 -153.39088 1096.07755
470.0000 -164.76315 -152.87773 11.88542 2.94676 -153.97717 1094.46827
475.0000 -162.04575 -153.13840 8.90734 3.00955 -152.92075 1147.72712
480.0000 -164.53183 -155.78579 8.74604 2.88841 -154.95876 1043.96758
485.0000 -165.16416 -155.24115 9.92301 2.85819 -155.46712 1044.94497
490.0000 -161.38942 -153.37715 8.01226 2.94756 -153.96358 1104.08786
495.0000 -161.47765 -151.79128 9.68637 2.97465 -153.50791 1101.38347
500.0000 -162.99066 -153.51277 9.47789 3.07094 -151.88806 1157.85087
FREEZING PROCESS: loop number 3 T-loop= 1109.0000000000000
main_MD> interactions number 3 at Temperature= 1109.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.48718 -3.00106 -1.67357
force_rgl> df(natom) 1.89343 3.19287 -0.55924
505.0000 -162.67544 -153.29619 9.37925 2.98753 -153.29124 1107.75110
510.0000 -163.70832 -153.49038 10.21794 3.03393 -152.51063 1121.51828
515.0000 -161.36199 -151.38938 9.97261 2.99135 -153.22704 1068.67007
520.0000 -165.54820 -153.51309 12.03511 3.02579 -152.64762 1129.83490
525.0000 -163.02795 -152.72454 10.30340 2.91480 -154.51479 1079.63113
530.0000 -164.39695 -155.48670 8.91025 2.94293 -154.04147 1102.06051
535.0000 -164.26483 -156.55401 7.71082 2.87159 -155.24174 1007.90999
540.0000 -164.28413 -153.31506 10.96908 2.83619 -155.83719 1002.11721
545.0000 -162.28240 -154.03706 8.24533 2.95038 -153.91619 1110.13101
550.0000 -164.05512 -154.18698 9.86814 2.94535 -154.00088 1081.99774
555.0000 -165.60936 -154.89682 10.71254 2.95451 -153.84680 1092.98642
560.0000 -163.92084 -155.67190 8.24894 2.84193 -155.74070 1053.32891
565.0000 -163.75262 -152.57046 11.18215 2.96855 -153.61059 1151.49838
570.0000 -165.72594 -156.60699 9.11895 2.88957 -154.93918 1073.04104
575.0000 -165.39547 -157.18481 8.21067 2.82189 -156.07774 1022.14964
580.0000 -160.91186 -153.62928 7.28258 2.90888 -154.61435 1059.61032
585.0000 -164.95061 -154.87416 10.07646 2.95347 -153.86429 1043.29397
590.0000 -163.59469 -155.51122 8.08348 2.93980 -154.09418 1112.93565
595.0000 -165.24071 -156.47055 8.77016 2.82115 -156.09027 982.38246
600.0000 -163.93838 -153.60775 10.33063 2.83706 -155.82254 1021.68188
605.0000 -165.33051 -155.60162 9.72889 2.87886 -155.11932 1051.32059
610.0000 -162.95585 -153.40096 9.55489 2.90037 -154.75751 1058.57808
615.0000 -163.30672 -153.42436 9.88236 3.01976 -152.74913 1158.71008
620.0000 -162.87337 -152.10504 10.76833 3.02044 -152.73759 1153.35159
625.0000 -161.94581 -150.30812 11.63769 3.04265 -152.36396 1143.13987
630.0000 -162.75847 -152.90512 9.85335 3.06672 -151.95904 1161.88747
635.0000 -162.26916 -152.37859 9.89057 3.04955 -152.24797 1127.65900
640.0000 -163.54371 -152.37329 11.17041 3.09605 -151.46564 1190.57861
645.0000 -162.88075 -154.56813 8.31262 2.96815 -153.61730 1085.65747
650.0000 -163.29990 -153.93257 9.36733 2.88150 -155.07492 1049.43221
655.0000 -164.30173 -155.97131 8.33042 2.90985 -154.59812 1054.20884
660.0000 -165.16415 -155.90229 9.26187 2.77039 -156.94415 969.30045
665.0000 -165.72172 -155.92933 9.79239 2.83994 -155.77416 1005.71142
670.0000 -162.64678 -152.39908 10.24770 2.92673 -154.31406 1080.86018
675.0000 -163.68317 -153.22105 10.46212 2.98667 -153.30572 1118.55546
680.0000 -163.99741 -154.00854 9.98886 2.97215 -153.55003 1107.76052
685.0000 -162.33600 -153.35749 8.97851 2.97500 -153.50210 1117.10291
690.0000 -162.76711 -150.64501 12.12210 3.09530 -151.47827 1172.55686
695.0000 -163.88619 -152.08316 11.80303 3.15514 -150.47162 1234.15437
700.0000 -163.51918 -154.50234 9.01683 3.06998 -151.90423 1179.13215
705.0000 -165.52414 -154.64941 10.87473 2.92292 -154.37819 1086.71413
710.0000 -164.32314 -154.26336 10.05978 2.96115 -153.73507 1096.60055
715.0000 -163.86515 -153.08326 10.78189 2.96604 -153.65275 1096.11149
720.0000 -161.62700 -151.38755 10.23945 3.03175 -152.54741 1108.84885
725.0000 -161.11918 -152.70002 8.41915 3.06862 -151.92709 1141.50609
730.0000 -165.69032 -154.17106 11.51926 3.01246 -152.87186 1131.78466
735.0000 -163.32019 -154.38773 8.93245 2.90713 -154.64375 1092.25115
740.0000 -162.42481 -152.18630 10.23851 2.93586 -154.16053 1086.78601
745.0000 -163.48394 -153.64049 9.84345 2.98290 -153.36921 1119.25894
750.0000 -162.39105 -151.96768 10.42336 3.04298 -152.35847 1171.42118
FREEZING PROCESS: loop number 4 T-loop= 1084.0000000000000
main_MD> interactions number 4 at Temperature= 1084.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.18528 1.59444 -2.43732
force_rgl> df(natom) 0.62165 0.22958 -1.47226
755.0000 -162.05446 -152.67071 9.38375 3.03475 -152.49686 1150.38211
760.0000 -164.53685 -153.92289 10.61396 3.01205 -152.87870 1154.07776
765.0000 -164.46865 -156.10825 8.36039 2.87087 -155.25384 1037.53425
770.0000 -161.64551 -152.36964 9.27588 2.93664 -154.14738 1050.28742
775.0000 -162.80206 -152.93187 9.87019 3.04504 -152.32372 1165.45135
780.0000 -162.29353 -151.95924 10.33429 3.05347 -152.18192 1168.47753
785.0000 -162.01873 -152.15567 9.86305 2.97173 -153.55705 1092.13401
790.0000 -161.68246 -151.78089 9.90157 3.06781 -151.94073 1165.84189
795.0000 -162.35164 -151.99870 10.35295 3.06784 -151.94014 1183.55058
800.0000 -161.15806 -152.37642 8.78164 3.01944 -152.75450 1124.61097
805.0000 -163.50444 -153.26324 10.24120 3.00305 -153.03011 1115.35128
810.0000 -164.71373 -154.36813 10.34561 2.94253 -154.04824 1066.38821
815.0000 -162.84875 -153.93360 8.91515 2.91962 -154.43368 1069.26942
820.0000 -163.27315 -153.62062 9.65252 2.96765 -153.62563 1059.39498
825.0000 -161.98115 -153.36983 8.61132 3.04147 -152.38386 1120.30088
830.0000 -163.69186 -152.79950 10.89236 3.01309 -152.86127 1146.67177
835.0000 -162.91846 -152.07205 10.84641 3.04855 -152.26470 1184.85269
840.0000 -161.28301 -151.20574 10.07727 3.11378 -151.16738 1167.05501
845.0000 -161.82354 -152.25293 9.57061 3.13677 -150.78064 1258.64778
850.0000 -163.34586 -153.06453 10.28133 2.99548 -153.15743 1125.23262
855.0000 -162.66537 -151.60090 11.06447 3.02306 -152.69350 1136.90286
860.0000 -164.29978 -154.58217 9.71761 2.98503 -153.33325 1073.52231
865.0000 -164.42207 -155.99385 8.42822 2.87008 -155.26715 1014.95760
870.0000 -162.45230 -154.99289 7.45941 2.84661 -155.66190 1012.76766
875.0000 -164.22052 -154.68772 9.53280 2.88600 -154.99924 1005.96155
880.0000 -165.22413 -155.80606 9.41807 2.85919 -155.45027 1009.34592
885.0000 -164.12624 -154.27932 9.84693 2.90065 -154.75278 1070.79179
890.0000 -163.99820 -153.32039 10.67781 3.00070 -153.06966 1157.72026
895.0000 -164.85815 -156.57172 8.28643 2.93044 -154.25172 1089.94964
900.0000 -164.09364 -154.96063 9.13301 2.82663 -155.99802 995.23882
905.0000 -163.98173 -153.22074 10.76100 2.94325 -154.03617 1094.70209
910.0000 -162.13973 -152.48545 9.65428 3.01602 -152.81200 1152.89847
915.0000 -161.83593 -152.25581 9.58013 3.10267 -151.35431 1168.41437
920.0000 -163.42171 -152.20910 11.21261 3.00220 -153.04441 1108.05623
925.0000 -162.59899 -152.06625 10.53275 3.11779 -151.09995 1190.80266
930.0000 -164.44171 -155.51749 8.92422 3.04683 -152.29373 1164.42027
935.0000 -164.10614 -155.18014 8.92600 2.83558 -155.84753 986.53933
940.0000 -164.48499 -154.31554 10.16945 2.93264 -154.21469 1080.50512
945.0000 -163.62166 -154.30733 9.31433 2.87628 -155.16272 1057.61764
950.0000 -165.37201 -154.66201 10.71000 2.93783 -154.12742 1082.97245
955.0000 -162.33888 -151.52164 10.81724 2.98528 -153.32911 1103.25405
960.0000 -162.23430 -152.42270 9.81160 3.09529 -151.47849 1175.91987
965.0000 -163.52597 -150.63978 12.88619 3.05597 -152.13993 1152.32501
970.0000 -162.60411 -155.19282 7.41129 3.00744 -152.95632 1124.26722
975.0000 -166.47108 -157.02915 9.44193 2.85993 -155.43777 996.84156
980.0000 -164.91412 -156.00634 8.90779 2.78347 -156.72404 969.79440
985.0000 -164.73825 -156.50105 8.23720 2.82642 -156.00150 1048.08204
990.0000 -165.94978 -155.24547 10.70431 2.87753 -155.14177 1055.69086
995.0000 -164.44982 -155.42024 9.02958 2.88291 -155.05121 1043.78725
1000.0000 -164.69188 -155.63607 9.05582 2.91137 -154.57243 1066.69635
FREEZING PROCESS: loop number 5 T-loop= 1059.0000000000000
main_MD> interactions number 5 at Temperature= 1059.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.08765 -1.76096 0.56113
force_rgl> df(natom) 2.46303 -1.44749 -0.44302
1005.0000 -163.89536 -156.49125 7.40411 2.84325 -155.71852 1016.12522
1010.0000 -165.18183 -155.98194 9.19989 2.80826 -156.30711 975.42288
1015.0000 -164.64524 -155.89925 8.74598 2.85512 -155.51872 1004.33622
1020.0000 -165.74033 -155.71762 10.02271 2.80742 -156.32120 977.70901
1025.0000 -162.88891 -153.52636 9.36255 2.88979 -154.93553 1067.45171
1030.0000 -164.35927 -154.12353 10.23574 2.96682 -153.63964 1082.46989
1035.0000 -164.05974 -154.79529 9.26445 2.87957 -155.10738 1036.44844
1040.0000 -166.45667 -158.09804 8.35863 2.74859 -157.31093 967.43261
1045.0000 -165.71556 -157.03736 8.67820 2.77932 -156.79400 976.29776
1050.0000 -165.44277 -158.34875 7.09402 2.75248 -157.24543 974.67480
1055.0000 -166.13325 -156.30484 9.82841 2.76261 -157.07509 981.57548
1060.0000 -166.43246 -158.13147 8.30098 2.76063 -157.10833 947.89787
1065.0000 -164.92196 -156.90058 8.02139 2.75847 -157.14474 932.74798
1070.0000 -164.61666 -154.37149 10.24516 2.88101 -155.08317 1070.31839
1075.0000 -163.99126 -154.97321 9.01806 2.94002 -154.09049 1080.36390
1080.0000 -164.46586 -154.96694 9.49891 2.91859 -154.45102 1064.15949
1085.0000 -165.92238 -157.72669 8.19568 2.77676 -156.83706 999.60605
1090.0000 -163.96394 -157.50579 6.45815 2.71203 -157.92599 946.53774
1095.0000 -164.36245 -154.34792 10.01453 2.87996 -155.10082 1060.86922
1100.0000 -162.57345 -154.44429 8.12916 2.89292 -154.88293 1066.20824
1105.0000 -163.36966 -154.51310 8.85656 2.97681 -153.47159 1121.04667
1110.0000 -163.32511 -153.50746 9.81765 2.94465 -154.01257 1101.32724
1115.0000 -164.62269 -155.08798 9.53471 2.92217 -154.39080 1062.94636
1120.0000 -167.94869 -156.64859 11.30010 2.80799 -156.31166 1021.88875
1125.0000 -166.14254 -155.65131 10.49123 2.82969 -155.94662 1022.82398
1130.0000 -164.68434 -155.68011 9.00424 2.85477 -155.52468 1033.31374
1135.0000 -164.96975 -155.85821 9.11154 2.83953 -155.78109 1032.44834
1140.0000 -164.37048 -153.77353 10.59694 2.88450 -155.02450 1039.75211
1145.0000 -162.40211 -152.17665 10.22546 2.95469 -153.84369 1086.84334
1150.0000 -164.11913 -154.31397 9.80516 2.97188 -153.55447 1090.12229
1155.0000 -165.06975 -156.13265 8.93710 2.83842 -155.79977 996.23143
1160.0000 -164.88197 -156.51098 8.37099 2.81884 -156.12902 980.45074
1165.0000 -163.06424 -153.71542 9.34882 2.85999 -155.43688 1020.90657
1170.0000 -163.64397 -153.82989 9.81408 2.97213 -153.55031 1096.74988
1175.0000 -164.14984 -155.27142 8.87842 2.94168 -154.06250 1081.21346
1180.0000 -164.42307 -156.70011 7.72296 2.81915 -156.12386 1003.15291
1185.0000 -165.51664 -157.11313 8.40351 2.78340 -156.72525 967.36273
1190.0000 -165.69399 -155.82137 9.87261 2.77430 -156.87831 991.94841
1195.0000 -164.58750 -157.29004 7.29747 2.80803 -156.31088 1021.37317
1200.0000 -164.10269 -155.85467 8.24802 2.78297 -156.73261 962.06856
1205.0000 -166.05002 -156.17305 9.87696 2.81986 -156.11197 998.29100
1210.0000 -163.98467 -154.24736 9.73731 2.88270 -155.05482 1043.47258
1215.0000 -163.99267 -155.16877 8.82390 2.88340 -155.04296 1058.78274
1220.0000 -163.60036 -153.03858 10.56178 2.94770 -153.96127 1138.30020
1225.0000 -162.85612 -153.69566 9.16046 2.90480 -154.68295 1019.60431
1230.0000 -164.04013 -153.69800 10.34213 2.90986 -154.59794 1014.96656
1235.0000 -164.89662 -155.49337 9.40325 2.89102 -154.91490 1059.60280
1240.0000 -165.87277 -154.95584 10.91692 2.86748 -155.31091 1057.58568
1245.0000 -163.83108 -154.67830 9.15279 2.88517 -155.01322 1057.77161
1250.0000 -165.35530 -155.86078 9.49452 2.89260 -154.88825 1039.77843
FREEZING PROCESS: loop number 6 T-loop= 1034.0000000000000
main_MD> interactions number 6 at Temperature= 1034.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.81661 -2.87578 -2.59777
force_rgl> df(natom) -4.80083 2.52979 -0.79202
1255.0000 -166.27177 -156.24772 10.02405 2.85364 -155.54373 1024.26417
1260.0000 -165.19604 -156.39691 8.79913 2.77843 -156.80892 969.96293
1265.0000 -163.21318 -154.91923 8.29395 2.80983 -156.28070 1002.38776
1270.0000 -163.82530 -154.03724 9.78805 2.97446 -153.51114 1078.18330
1275.0000 -164.40517 -154.57169 9.83348 2.91530 -154.50630 1055.42039
1280.0000 -163.15403 -153.18172 9.97231 2.95488 -153.84060 1092.53052
1285.0000 -162.24364 -153.56175 8.68189 2.97384 -153.52160 1084.95329
1290.0000 -164.06096 -154.16790 9.89306 2.95022 -153.91884 1067.68775
1295.0000 -165.57731 -155.99000 9.58732 2.85513 -155.51861 1038.99961
1300.0000 -164.67292 -155.41058 9.26234 2.89870 -154.78563 1045.69588
1305.0000 -163.73992 -154.93318 8.80674 2.86673 -155.32341 1020.79540
1310.0000 -165.16712 -155.93867 9.22844 2.86505 -155.35169 1028.29318
1315.0000 -163.65868 -155.46390 8.19478 2.78512 -156.69643 980.10832
1320.0000 -165.17631 -156.21729 8.95902 2.79592 -156.51475 964.54019
1325.0000 -165.74695 -158.25512 7.49183 2.75599 -157.18645 951.66317
1330.0000 -166.28610 -157.56361 8.72249 2.71715 -157.83985 943.51455
1335.0000 -167.11369 -157.45962 9.65408 2.78286 -156.73439 995.45350
1340.0000 -164.95957 -155.78859 9.17099 2.74443 -157.38093 928.68816
1345.0000 -164.90396 -155.91522 8.98874 2.79193 -156.58178 973.35764
1350.0000 -166.17810 -155.79540 10.38271 2.80456 -156.36940 1023.06942
1355.0000 -165.72547 -156.18970 9.53577 2.83040 -155.93458 1037.64051
1360.0000 -163.58719 -154.29113 9.29606 2.86106 -155.41883 1021.51428
1365.0000 -163.30407 -155.89232 7.41175 2.82346 -156.05132 989.11174
1370.0000 -165.14061 -156.72571 8.41490 2.79426 -156.54254 985.86979
1375.0000 -164.72917 -155.90160 8.82757 2.79301 -156.56367 999.93375
1380.0000 -162.95901 -153.13309 9.82592 2.91291 -154.54656 1107.90393
1385.0000 -164.73205 -155.20016 9.53189 2.94088 -154.07606 1115.65105
1390.0000 -163.22727 -154.21374 9.01353 2.85187 -155.57337 1035.36138
1395.0000 -164.49270 -152.61734 11.87536 2.97732 -153.46307 1132.74965
1400.0000 -162.18718 -152.06822 10.11896 3.09328 -151.51221 1201.22616
1405.0000 -162.72125 -152.71521 10.00604 3.03021 -152.57323 1152.74452
1410.0000 -165.72381 -156.90424 8.81958 2.80669 -156.33350 1009.08819
1415.0000 -164.53461 -156.31344 8.22116 2.87252 -155.22603 1047.02597
1420.0000 -165.16681 -156.85590 8.31091 2.88146 -155.07569 1030.98495
1425.0000 -165.12527 -156.48351 8.64176 2.75523 -157.19925 971.59471
1430.0000 -165.63422 -156.40448 9.22975 2.80723 -156.32443 958.04355
1435.0000 -163.31181 -152.82030 10.49150 2.89951 -154.77194 1075.77492
1440.0000 -164.46421 -153.63358 10.83063 3.00009 -153.08000 1115.91391
1445.0000 -166.12995 -154.54935 11.58060 2.96567 -153.65906 1112.31721
1450.0000 -162.38776 -152.45349 9.93427 2.96891 -153.60455 1113.27441
1455.0000 -165.11064 -156.65769 8.45295 2.95598 -153.82204 1072.01610
1460.0000 -163.20694 -154.51223 8.69471 2.87261 -155.22453 1020.17427
1465.0000 -164.33905 -155.42271 8.91634 2.91392 -154.52963 1045.78309
1470.0000 -166.67382 -157.37842 9.29540 2.82116 -156.09003 1015.46228
1475.0000 -165.23763 -155.70731 9.53031 2.84179 -155.74309 1041.22788
1480.0000 -165.56323 -155.53538 10.02784 2.86763 -155.30838 1034.23985
1485.0000 -164.98427 -155.52431 9.45995 2.86524 -155.34855 1051.49102
1490.0000 -164.90161 -156.40923 8.49239 2.86739 -155.31242 1032.14530
1495.0000 -163.04508 -154.86889 8.17619 2.87703 -155.15024 1025.49995
1500.0000 -165.41474 -154.95437 10.46036 2.81557 -156.18419 1035.28719
FREEZING PROCESS: loop number 7 T-loop= 1009.0000000000000
main_MD> interactions number 7 at Temperature= 1009.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.70362 0.30242 -1.79128
force_rgl> df(natom) 2.38818 -0.88226 0.39726
1505.0000 -164.69340 -156.86939 7.82400 2.82374 -156.04675 987.20855
1510.0000 -165.21771 -155.48909 9.72862 2.81174 -156.24846 1011.91897
1515.0000 -163.55699 -154.60354 8.95345 2.94931 -153.93425 1074.82427
1520.0000 -164.14430 -154.98635 9.15795 2.87652 -155.15877 993.70943
1525.0000 -162.26877 -154.11805 8.15072 2.90956 -154.60292 1047.57119
1530.0000 -165.08353 -155.91736 9.16617 2.91203 -154.56138 1004.56243
1535.0000 -162.90705 -153.26192 9.64513 2.86303 -155.38563 1016.83831
1540.0000 -163.33454 -153.81855 9.51599 2.98896 -153.26721 1115.79344
1545.0000 -164.51116 -154.41823 10.09292 2.88848 -154.95760 1044.39092
1550.0000 -163.77092 -154.80357 8.96736 2.92117 -154.40758 1088.51902
1555.0000 -166.47538 -157.86580 8.60958 2.78932 -156.62577 969.52424
1560.0000 -164.53462 -155.29106 9.24356 2.75999 -157.11919 1002.82761
1565.0000 -162.80416 -154.14427 8.65989 2.91214 -154.55944 1072.13609
1570.0000 -165.15644 -155.02324 10.13321 2.88846 -154.95786 1063.53927
1575.0000 -163.00523 -154.85027 8.15496 2.90680 -154.64929 1084.74439
1580.0000 -162.60960 -153.12903 9.48057 2.88318 -155.04674 1013.94184
1585.0000 -164.43783 -154.71559 9.72224 2.98835 -153.27749 1123.01843
1590.0000 -165.44875 -155.35163 10.09712 2.87125 -155.24735 1028.91284
1595.0000 -164.74881 -155.21150 9.53731 2.82861 -155.96470 1010.15680
1600.0000 -163.39848 -153.21467 10.18380 2.91510 -154.50978 1058.37988
1605.0000 -164.38721 -155.59939 8.78782 2.93513 -154.17274 1060.56847
1610.0000 -166.90132 -156.16892 10.73241 2.80713 -156.32602 981.70797
1615.0000 -164.58080 -158.26476 6.31604 2.77648 -156.84163 993.58488
1620.0000 -163.64546 -155.35596 8.28951 2.80213 -156.41019 993.81496
1625.0000 -164.26047 -155.16381 9.09666 2.89553 -154.83902 1052.35537
1630.0000 -163.07148 -155.53276 7.53872 2.89925 -154.77638 1033.63649
1635.0000 -165.00251 -155.89820 9.10430 2.83346 -155.88315 975.79852
1640.0000 -166.07678 -157.20754 8.86924 2.84703 -155.65482 1027.44408
1645.0000 -164.26536 -154.94645 9.31891 2.84761 -155.64505 1034.42681
1650.0000 -164.23349 -155.12585 9.10764 2.86541 -155.34563 1020.05077
1655.0000 -165.33461 -156.52214 8.81246 2.89088 -154.91725 1045.14420
1660.0000 -165.47791 -158.03323 7.44468 2.71752 -157.83365 944.20085
1665.0000 -166.59193 -157.09014 9.50179 2.72043 -157.78463 957.02946
1670.0000 -164.98669 -156.26041 8.72628 2.73005 -157.62287 964.25818
1675.0000 -165.33159 -156.73665 8.59494 2.83909 -155.78837 1001.89424
1680.0000 -166.17348 -157.41449 8.75898 2.78437 -156.70891 990.53947
1685.0000 -165.90440 -158.43571 7.46869 2.78789 -156.64969 958.99852
1690.0000 -166.43850 -159.03275 7.40575 2.69135 -158.27383 917.30710
1695.0000 -165.25043 -155.60743 9.64300 2.75131 -157.26519 975.20135
1700.0000 -165.46041 -157.50741 7.95301 2.80067 -156.43484 988.26485
1705.0000 -163.77724 -154.84856 8.92868 2.83548 -155.84916 999.59310
1710.0000 -162.27586 -153.96821 8.30765 2.92494 -154.34422 1062.16579
1715.0000 -165.28906 -156.16132 9.12775 2.94388 -154.02563 1103.29869
1720.0000 -164.26643 -154.78641 9.48002 2.89115 -154.91269 1047.47996
1725.0000 -163.48216 -155.14131 8.34085 2.93718 -154.13826 1065.03699
1730.0000 -162.97134 -154.34090 8.63044 2.92128 -154.40579 1057.59705
1735.0000 -163.65941 -153.61012 10.04929 2.94103 -154.07346 1076.92039
1740.0000 -163.53765 -155.21391 8.32374 2.91436 -154.52210 1033.26090
1745.0000 -165.15972 -156.65531 8.50440 2.78645 -156.67398 952.15603
1750.0000 -165.69933 -155.12014 10.57919 2.83265 -155.89673 1028.84621
FREEZING PROCESS: loop number 8 T-loop= 984.00000000000000
main_MD> interactions number 8 at Temperature= 984.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.16670 -0.72025 -0.00067
force_rgl> df(natom) 0.18353 -1.77237 -2.58673
1755.0000 -164.90823 -155.52537 9.38286 2.88859 -154.95577 1063.37425
1760.0000 -164.33803 -155.05054 9.28749 2.84949 -155.61353 1005.15159
1765.0000 -164.42931 -154.11119 10.31812 2.93991 -154.09234 1078.15943
1770.0000 -164.81406 -155.37190 9.44216 2.82816 -155.97230 988.64478
1775.0000 -164.78691 -157.82194 6.96496 2.77881 -156.80258 957.72060
1780.0000 -166.14345 -157.21978 8.92367 2.79157 -156.58787 972.41460
1785.0000 -167.08913 -157.12923 9.95990 2.70882 -157.97991 958.63984
1790.0000 -167.25014 -157.83362 9.41652 2.68134 -158.44225 921.63301
1795.0000 -166.01453 -158.03256 7.98196 2.66439 -158.72736 929.92011
1800.0000 -167.38138 -159.31143 8.06995 2.69545 -158.20490 915.55375
1805.0000 -166.03592 -158.62583 7.41009 2.68047 -158.45692 913.64049
1810.0000 -165.93668 -157.44713 8.48954 2.71490 -157.87762 926.07815
1815.0000 -166.65319 -158.14832 8.50487 2.78603 -156.68099 1001.92748
1820.0000 -165.71963 -158.46279 7.25684 2.64692 -159.02121 897.08738
1825.0000 -164.95961 -155.76318 9.19643 2.72058 -157.78211 954.83937
1830.0000 -163.76801 -155.61395 8.15406 2.82803 -155.97442 988.10013
1835.0000 -164.29988 -155.65148 8.64841 2.85508 -155.51937 1003.97404
1840.0000 -166.40929 -157.34987 9.05942 2.73253 -157.58104 962.45931
1845.0000 -166.16533 -156.99706 9.16827 2.78496 -156.69902 966.37026
1850.0000 -164.66448 -157.36251 7.30197 2.80204 -156.41170 961.10170
1855.0000 -165.47294 -156.53854 8.93440 2.69727 -158.17431 937.30225
1860.0000 -165.73286 -156.61727 9.11559 2.79079 -156.60104 1007.48097
1865.0000 -164.11219 -155.57768 8.53451 2.92313 -154.37462 1056.99303
1870.0000 -162.61461 -155.20020 7.41441 2.87238 -155.22834 1008.76381
1875.0000 -164.47632 -156.24842 8.22790 2.86524 -155.34847 1011.14602
1880.0000 -163.65505 -154.51892 9.13612 2.83100 -155.92457 996.90027
1885.0000 -166.12780 -155.46049 10.66731 2.86361 -155.37594 1066.43487
1890.0000 -163.08885 -153.64722 9.44163 2.87704 -155.14997 1048.97877
1895.0000 -165.91771 -155.90449 10.01322 2.87692 -155.15198 1037.76064
1900.0000 -164.86283 -156.03383 8.82900 2.79262 -156.57013 987.52865
1905.0000 -166.34053 -157.86181 8.47873 2.77649 -156.84149 968.45275
1910.0000 -165.17784 -156.20636 8.97148 2.79571 -156.51819 1005.26886
1915.0000 -164.51712 -155.14911 9.36801 2.80321 -156.39204 1012.38215
1920.0000 -166.50657 -158.26416 8.24242 2.79886 -156.46518 1007.01432
1925.0000 -164.98292 -155.64687 9.33605 2.76352 -157.05978 982.48664
1930.0000 -164.47926 -155.58914 8.89012 2.87909 -155.11556 1070.21258
1935.0000 -163.76384 -154.81893 8.94492 2.83926 -155.78558 1005.27367
1940.0000 -165.18237 -156.13073 9.05164 2.85613 -155.50177 1003.87832
1945.0000 -163.87314 -154.92264 8.95049 2.81301 -156.22719 987.37515
1950.0000 -164.92027 -156.35732 8.56296 2.84428 -155.70117 1010.82376
1955.0000 -165.89271 -156.55539 9.33731 2.78182 -156.75187 986.30550
1960.0000 -164.47272 -155.60332 8.86940 2.83283 -155.89376 991.59927
1965.0000 -164.53924 -154.55958 9.97966 2.85376 -155.54167 1033.90277
1970.0000 -162.33007 -153.42881 8.90126 2.91532 -154.50609 1062.31680
1975.0000 -161.79637 -153.53777 8.25860 2.95803 -153.78753 1094.62604
1980.0000 -166.89069 -157.60184 9.28885 2.87007 -155.26730 1064.51670
1985.0000 -166.23085 -156.84634 9.38451 2.74778 -157.32456 984.69805
1990.0000 -164.51199 -155.34173 9.17027 2.82014 -156.10722 1008.83354
1995.0000 -166.47019 -156.47755 9.99264 2.84321 -155.71913 1027.94962
2000.0000 -164.84491 -156.16910 8.67580 2.77795 -156.81694 978.24955
FREEZING PROCESS: loop number 9 T-loop= 959.00000000000000
main_MD> interactions number 9 at Temperature= 959.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.20201 0.02570 3.40225
force_rgl> df(natom) 0.17153 -0.41691 1.19158
2005.0000 -165.54965 -157.63623 7.91342 2.72917 -157.63768 943.58742
2010.0000 -164.54457 -155.84710 8.69746 2.79877 -156.46677 1019.68647
2015.0000 -165.40545 -158.60486 6.80058 2.77020 -156.94737 955.17032
2020.0000 -168.21046 -159.97693 8.23353 2.65835 -158.82904 872.08615
2025.0000 -167.69306 -160.40849 7.28457 2.62729 -159.35158 864.23838
2030.0000 -166.79970 -157.83741 8.96229 2.68038 -158.45832 920.76628
2035.0000 -166.19488 -158.16750 8.02737 2.68131 -158.44268 919.21914
2040.0000 -165.21482 -156.52347 8.69135 2.78455 -156.70603 1018.69763
2045.0000 -164.39048 -156.96961 7.42087 2.79692 -156.49787 988.92053
2050.0000 -165.68716 -157.83007 7.85709 2.73945 -157.46460 926.53679
2055.0000 -166.55533 -158.99019 7.56514 2.71621 -157.85561 933.86497
2060.0000 -167.05877 -157.69997 9.35880 2.75031 -157.28200 963.46681
2065.0000 -166.19946 -157.95179 8.24767 2.69953 -158.13631 920.45337
2070.0000 -164.42289 -155.20793 9.21495 2.76045 -157.11137 968.04719
2075.0000 -165.04518 -157.06075 7.98443 2.79865 -156.46877 965.18711
2080.0000 -165.35767 -156.89950 8.45817 2.78592 -156.68295 956.26235
2085.0000 -164.81315 -157.22579 7.58736 2.80798 -156.31179 965.61137
2090.0000 -165.97393 -157.77179 8.20214 2.75071 -157.27523 956.66602
2095.0000 -165.21788 -157.55403 7.66385 2.77137 -156.92772 947.77783
2100.0000 -166.50405 -157.28711 9.21694 2.79999 -156.44627 1021.00449
2105.0000 -167.41015 -157.86478 9.54537 2.73120 -157.60352 959.29006
2110.0000 -166.29878 -160.08572 6.21305 2.58495 -160.06373 859.83932
2115.0000 -168.31966 -158.69084 9.62882 2.60940 -159.65239 869.93250
2120.0000 -167.17979 -157.16147 10.01832 2.72480 -157.71108 942.17233
2125.0000 -165.90509 -157.03453 8.87056 2.80772 -156.31621 995.68659
2130.0000 -164.49362 -155.41099 9.08263 2.87534 -155.17856 1053.51115
2135.0000 -165.38192 -156.30498 9.07694 2.85384 -155.54033 1017.83067
2140.0000 -164.82387 -156.84707 7.97680 2.77786 -156.81845 945.75324
2145.0000 -165.72609 -156.27412 9.45198 2.79103 -156.59688 975.93373
2150.0000 -163.37525 -155.20483 8.17042 2.83370 -155.87904 1012.13969
2155.0000 -163.35918 -154.42565 8.93354 2.89075 -154.91929 1052.70488
2160.0000 -165.36974 -155.46316 9.90658 2.83792 -155.80812 1005.15818
2165.0000 -165.63700 -157.69975 7.93725 2.73873 -157.47685 964.66906
2170.0000 -165.60925 -157.66182 7.94744 2.72972 -157.62835 951.77376
2175.0000 -166.23315 -157.78701 8.44614 2.70696 -158.01117 899.78153
2180.0000 -166.86863 -157.98529 8.88334 2.70190 -158.09630 924.67279
2185.0000 -164.52737 -155.38221 9.14516 2.75310 -157.23508 957.31037
2190.0000 -163.25906 -154.10720 9.15186 2.95889 -153.77309 1094.16219
2195.0000 -165.46660 -156.88313 8.58347 2.86369 -155.37460 1023.01808
2200.0000 -166.47589 -157.64863 8.82727 2.79057 -156.60468 1008.00700
2205.0000 -164.60762 -157.55062 7.05700 2.77816 -156.81344 970.71181
2210.0000 -164.32855 -155.89635 8.43221 2.76139 -157.09560 952.28268
2215.0000 -164.69317 -156.05592 8.63725 2.88944 -154.94138 1063.21603
2220.0000 -166.28118 -156.73070 9.55048 2.80106 -156.42824 979.72067
2225.0000 -166.86209 -158.06434 8.79775 2.70968 -157.96554 926.61882
2230.0000 -166.23899 -156.35168 9.88731 2.71809 -157.82405 948.57782
2235.0000 -164.74349 -156.01897 8.72452 2.83035 -155.93544 1012.12450
2240.0000 -165.11262 -157.13344 7.97918 2.80961 -156.28441 973.66992
2245.0000 -166.67128 -157.22048 9.45080 2.77311 -156.89833 980.81424
2250.0000 -165.76945 -156.90013 8.86931 2.74328 -157.40018 974.13761
FREEZING PROCESS: loop number 10 T-loop= 934.00000000000000
main_MD> interactions number 10 at Temperature= 934.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.23750 -1.23706 -0.89423
force_rgl> df(natom) 0.59021 0.49958 1.29453
2255.0000 -166.08149 -157.80395 8.27754 2.76715 -156.99861 958.00804
2260.0000 -167.40281 -160.65763 6.74518 2.67587 -158.53418 884.60574
2265.0000 -167.02973 -158.92873 8.10100 2.61886 -159.49341 861.56377
2270.0000 -167.74323 -159.30934 8.43389 2.64099 -159.12106 861.43114
2275.0000 -167.28169 -158.35960 8.92209 2.64196 -159.10475 869.16448
2280.0000 -168.32779 -160.89412 7.43367 2.63104 -159.28850 879.65988
2285.0000 -167.41274 -159.94181 7.47094 2.59780 -159.84767 857.23780
2290.0000 -164.55946 -157.13599 7.42347 2.66058 -158.79147 874.67174
2295.0000 -166.63657 -159.03759 7.59898 2.72724 -157.67002 922.78796
2300.0000 -166.35594 -157.00772 9.34822 2.65118 -158.94963 869.58691
2305.0000 -165.50402 -156.74001 8.76401 2.76626 -157.01369 974.78862
2310.0000 -165.81281 -157.40765 8.40515 2.74624 -157.35043 947.40916
2315.0000 -166.89944 -157.21917 9.68026 2.67833 -158.49288 914.27817
2320.0000 -166.90119 -159.45192 7.44927 2.68564 -158.36982 916.40984
2325.0000 -167.13238 -160.32274 6.80964 2.59548 -159.88658 846.49009
2330.0000 -167.08472 -158.05799 9.02673 2.61917 -159.48809 839.05320
2335.0000 -165.96721 -156.86805 9.09916 2.69268 -158.25145 903.16750
2340.0000 -167.40438 -159.54461 7.85977 2.69770 -158.16708 929.08350
2345.0000 -167.41195 -158.51477 8.89717 2.64531 -159.04836 917.62165
2350.0000 -169.02499 -161.44309 7.58190 2.54859 -160.67544 820.72460
2355.0000 -169.19247 -162.04856 7.14391 2.50167 -161.46471 815.11099
2360.0000 -167.17429 -158.63022 8.54408 2.59398 -159.91186 855.77094
2365.0000 -167.90515 -160.00079 7.90436 2.63135 -159.28319 859.55443
2370.0000 -167.30878 -159.34155 7.96723 2.58839 -160.00600 834.77167
2375.0000 -166.93143 -157.90192 9.02951 2.66525 -158.71287 922.27448
2380.0000 -167.02141 -158.70032 8.32109 2.68165 -158.43699 918.34710
2385.0000 -166.10736 -159.20230 6.90506 2.68373 -158.40209 916.97733
2390.0000 -167.45535 -158.68277 8.77258 2.65606 -158.86747 904.12488
2395.0000 -166.08486 -158.13870 7.94616 2.63579 -159.20846 889.73376
2400.0000 -165.49255 -157.75360 7.73895 2.72303 -157.74085 967.37211
2405.0000 -165.76447 -157.49444 8.27003 2.73350 -157.56481 925.96970
2410.0000 -166.03570 -158.24838 7.78732 2.69471 -158.21731 926.02468
2415.0000 -166.43407 -158.51344 7.92064 2.71051 -157.95144 938.17447
2420.0000 -166.87313 -157.13006 9.74307 2.67035 -158.62710 892.82439
2425.0000 -165.61277 -158.45230 7.16047 2.74932 -157.29866 939.91522
2430.0000 -165.32607 -156.80467 8.52141 2.77366 -156.88919 993.09249
2435.0000 -166.77083 -157.16529 9.60555 2.75143 -157.26317 978.52861
2440.0000 -166.48650 -156.96675 9.51976 2.76133 -157.09666 967.87775
2445.0000 -165.38552 -156.95125 8.43428 2.70691 -158.01203 931.63977
2450.0000 -164.85084 -156.66813 8.18270 2.72923 -157.63659 913.79761
2455.0000 -165.58062 -156.98555 8.59507 2.81018 -156.27472 1000.15577
2460.0000 -164.28364 -155.48964 8.79400 2.81814 -156.14091 978.92357
2465.0000 -163.01616 -154.42708 8.58909 2.85551 -155.51213 1015.69759
2470.0000 -165.08444 -155.93618 9.14827 2.83793 -155.80799 1001.34825
2475.0000 -165.69377 -157.00439 8.68938 2.75613 -157.18412 981.58491
2480.0000 -168.17316 -159.82996 8.34320 2.66833 -158.66104 880.48291
2485.0000 -166.44064 -157.37851 9.06212 2.70766 -157.99948 951.61324
2490.0000 -165.99207 -157.13924 8.85283 2.77181 -156.92032 955.62768
2495.0000 -165.64247 -156.19666 9.44581 2.80611 -156.34329 981.01725
2500.0000 -166.48714 -157.07800 9.40914 2.75463 -157.20937 932.38685
FREEZING PROCESS: loop number 11 T-loop= 909.00000000000000
main_MD> interactions number 11 at Temperature= 909.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.08653 3.38761 2.53545
force_rgl> df(natom) 0.81847 0.73475 -3.13431
2505.0000 -166.14415 -158.71264 7.43150 2.73575 -157.52689 930.76176
2510.0000 -167.49656 -158.07298 9.42359 2.67251 -158.59083 884.28953
2515.0000 -165.94314 -158.78300 7.16014 2.71559 -157.86609 927.17185
2520.0000 -165.80932 -158.20949 7.59983 2.68808 -158.32885 920.69064
2525.0000 -165.42304 -158.08421 7.33884 2.75113 -157.26815 950.70822
2530.0000 -168.21111 -159.05855 9.15256 2.66766 -158.67236 883.13694
2535.0000 -167.36422 -158.84951 8.51471 2.59148 -159.95390 857.90632
2540.0000 -167.01229 -160.00486 7.00744 2.60293 -159.76124 870.49016
2545.0000 -166.56351 -159.31138 7.25213 2.61390 -159.57682 853.66237
2550.0000 -166.42328 -158.91859 7.50470 2.63814 -159.16902 876.59125
2555.0000 -166.94768 -158.40399 8.54369 2.69337 -158.23979 887.77034
2560.0000 -167.23738 -158.33368 8.90370 2.64254 -159.09499 872.48681
2565.0000 -165.30660 -156.15983 9.14677 2.74232 -157.41640 961.77410
2570.0000 -165.26084 -156.65856 8.60228 2.79754 -156.48742 988.44387
2575.0000 -167.48525 -158.55364 8.93161 2.72344 -157.73404 931.79310
2580.0000 -167.02209 -160.21753 6.80456 2.61417 -159.57226 843.84370
2585.0000 -165.09632 -158.80343 6.29289 2.62695 -159.35728 899.17961
2590.0000 -167.84185 -159.76025 8.08160 2.62274 -159.42802 878.67821
2595.0000 -167.78607 -159.22291 8.56316 2.60083 -159.79660 853.91593
2600.0000 -167.59796 -160.29555 7.30241 2.59140 -159.95534 865.84236
2605.0000 -167.48077 -160.11484 7.36593 2.54081 -160.80635 810.72701
2610.0000 -166.60685 -159.75665 6.85020 2.69583 -158.19850 905.51029
2615.0000 -166.63176 -156.58945 10.04231 2.64984 -158.97214 908.24659
2620.0000 -166.79905 -158.37596 8.42309 2.71822 -157.82188 961.83344
2625.0000 -166.14901 -157.61584 8.53317 2.71977 -157.79568 939.69938
2630.0000 -166.87200 -159.06088 7.81111 2.64507 -159.05241 882.51656
2635.0000 -166.10731 -157.86993 8.23738 2.65073 -158.95715 880.16068
2640.0000 -167.59189 -159.83839 7.75350 2.68229 -158.42624 901.61819
2645.0000 -167.92257 -159.87588 8.04669 2.62629 -159.36834 947.62638
2650.0000 -168.63522 -161.26684 7.36838 2.59399 -159.91179 855.78469
2655.0000 -166.96568 -158.72274 8.24294 2.57957 -160.15427 848.33234
2660.0000 -166.13081 -158.56312 7.56769 2.67627 -158.52755 917.65711
2665.0000 -166.43935 -159.58195 6.85740 2.66033 -158.79564 900.03569
2670.0000 -167.74201 -159.01285 8.72916 2.63561 -159.21160 904.95639
2675.0000 -165.02053 -156.88126 8.13927 2.71163 -157.93263 938.30323
2680.0000 -165.24088 -156.39378 8.84710 2.81016 -156.27512 992.21692
2685.0000 -166.77320 -158.03517 8.73803 2.71809 -157.82397 926.98716
2690.0000 -166.59584 -159.44945 7.14640 2.71299 -157.90988 949.88285
2695.0000 -168.81832 -161.14990 7.66842 2.57000 -160.31531 822.65428
2700.0000 -165.80902 -158.55446 7.25456 2.59381 -159.91468 878.47872
2705.0000 -167.22144 -159.74000 7.48144 2.67291 -158.58410 925.04862
2710.0000 -167.19063 -158.72939 8.46124 2.61958 -159.48126 878.95633
2715.0000 -165.30223 -157.67835 7.62388 2.66431 -158.72867 920.86419
2720.0000 -166.09881 -157.99867 8.10014 2.71654 -157.85008 920.14862
2725.0000 -166.02251 -157.34015 8.68236 2.73596 -157.52339 944.23868
2730.0000 -166.81928 -158.12262 8.69665 2.71932 -157.80324 939.11836
2735.0000 -167.52451 -158.90899 8.61552 2.67653 -158.52315 899.77790
2740.0000 -166.45552 -159.47463 6.98090 2.64362 -159.07688 873.38534
2745.0000 -165.84299 -157.54736 8.29563 2.69955 -158.13592 920.99108
2750.0000 -164.64311 -157.10680 7.53631 2.71574 -157.86358 922.80062
FREEZING PROCESS: loop number 12 T-loop= 884.00000000000000
main_MD> interactions number 12 at Temperature= 884.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.08416 -0.76190 0.53525
force_rgl> df(natom) 5.55224 -6.69049 0.77313
2755.0000 -167.31887 -159.34463 7.97424 2.70745 -158.00297 888.06473
2760.0000 -167.93401 -160.20108 7.73293 2.57724 -160.19348 830.67811
2765.0000 -167.38483 -159.97038 7.41445 2.56354 -160.42399 811.98224
2770.0000 -167.74169 -159.56310 8.17859 2.55093 -160.63611 815.80843
2775.0000 -167.01394 -158.59264 8.42131 2.66640 -158.69354 918.47878
2780.0000 -167.37473 -158.47222 8.90251 2.68782 -158.33321 887.55919
2785.0000 -165.35377 -157.58056 7.77321 2.70257 -158.08515 877.28650
2790.0000 -165.17479 -157.32446 7.85033 2.76687 -157.00335 922.60253
2795.0000 -165.88731 -157.54118 8.34613 2.71626 -157.85476 928.81524
2800.0000 -167.10084 -158.91621 8.18463 2.67388 -158.56769 920.01889
2805.0000 -166.68524 -159.52755 7.15769 2.56413 -160.41399 829.90982
2810.0000 -166.43198 -158.69620 7.73578 2.64521 -159.05007 881.19014
2815.0000 -167.80817 -159.33803 8.47014 2.63492 -159.22314 882.02862
2820.0000 -166.30498 -157.44590 8.85908 2.72286 -157.74373 930.41984
2825.0000 -166.48186 -158.39899 8.08287 2.71914 -157.80642 954.42030
2830.0000 -167.50952 -158.92933 8.58019 2.66919 -158.64670 916.48898
2835.0000 -166.40935 -157.00589 9.40346 2.66645 -158.69265 903.42105
2840.0000 -166.83681 -158.76298 8.07383 2.67424 -158.56168 916.99037
2845.0000 -166.62483 -158.51359 8.11125 2.67469 -158.55405 892.18955
2850.0000 -168.95090 -161.58499 7.36591 2.55490 -160.56927 825.60210
2855.0000 -166.97496 -159.76869 7.20626 2.60021 -159.80714 840.99500
2860.0000 -165.05846 -157.27160 7.78686 2.70526 -158.03985 932.44298
2865.0000 -166.14522 -158.25633 7.88889 2.71015 -157.95761 905.08550
2870.0000 -167.70675 -159.89369 7.81307 2.62775 -159.34384 889.71059
2875.0000 -164.87322 -156.97319 7.90003 2.70825 -157.98961 893.40245
2880.0000 -164.79401 -157.45310 7.34090 2.71664 -157.84836 933.39539
2885.0000 -167.53285 -159.71190 7.82095 2.64032 -159.13230 908.43661
2890.0000 -167.89033 -160.85180 7.03854 2.56518 -160.39634 833.76016
2895.0000 -168.06015 -159.12191 8.93824 2.54952 -160.65986 844.48121
2900.0000 -165.45573 -157.72593 7.72979 2.70499 -158.04435 913.93547
2905.0000 -166.48826 -159.59562 6.89263 2.74021 -157.45192 964.60185
2910.0000 -167.11542 -159.05743 8.05799 2.61134 -159.61977 885.15453
2915.0000 -167.20378 -159.56531 7.63847 2.63940 -159.14772 861.58815
2920.0000 -167.25372 -159.04606 8.20766 2.64039 -159.13119 876.39623
2925.0000 -169.56027 -160.92861 8.63166 2.62874 -159.32713 881.17969
2930.0000 -166.99715 -158.18871 8.80844 2.63013 -159.30375 882.65722
2935.0000 -167.13174 -158.78111 8.35062 2.66749 -158.67523 888.85154
2940.0000 -166.87023 -158.39836 8.47187 2.65640 -158.86180 905.60639
2945.0000 -166.76787 -159.96110 6.80677 2.65340 -158.91231 905.88516
2950.0000 -167.52149 -160.44628 7.07521 2.56133 -160.46115 834.98864
2955.0000 -166.67012 -158.97222 7.69790 2.62319 -159.42044 870.97720
2960.0000 -167.51406 -159.78812 7.72594 2.59344 -159.92100 871.62023
2965.0000 -167.18289 -158.97459 8.20830 2.62710 -159.35468 889.06936
2970.0000 -166.66887 -158.48077 8.18810 2.66883 -158.65266 902.55619
2975.0000 -166.66698 -157.73730 8.92969 2.73007 -157.62246 936.90919
2980.0000 -167.67649 -159.64597 8.03052 2.63971 -159.14258 888.99068
2985.0000 -167.46085 -158.46268 8.99817 2.67777 -158.50223 915.26961
2990.0000 -166.70892 -158.54014 8.16878 2.64396 -159.07115 891.53660
2995.0000 -167.35366 -159.83631 7.51735 2.65283 -158.92191 873.12772
3000.0000 -166.72752 -160.13793 6.58959 2.59540 -159.88799 820.35951
FREEZING PROCESS: loop number 13 T-loop= 859.00000000000000
main_MD> interactions number 13 at Temperature= 859.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.14495 -2.43058 0.12602
force_rgl> df(natom) 0.42355 2.01668 0.34724
3005.0000 -167.33558 -160.44392 6.89166 2.58495 -160.06386 869.95497
3010.0000 -166.97354 -157.85200 9.12154 2.61027 -159.63784 846.41103
3015.0000 -166.30089 -158.54775 7.75315 2.71287 -157.91190 951.39240
3020.0000 -168.59095 -159.69089 8.90007 2.62271 -159.42861 883.92943
3025.0000 -168.40191 -160.38710 8.01481 2.58038 -160.14071 841.31013
3030.0000 -166.42652 -157.99648 8.43005 2.60058 -159.80092 867.95216
3035.0000 -167.12181 -158.42088 8.70093 2.72801 -157.65704 948.73512
3040.0000 -167.64347 -158.77276 8.87071 2.71605 -157.85827 923.04209
3045.0000 -167.12908 -158.18534 8.94373 2.64378 -159.07402 886.09508
3050.0000 -166.80782 -159.77059 7.03724 2.68054 -158.45565 905.47522
3055.0000 -168.18368 -160.04512 8.13857 2.59186 -159.94756 834.18959
3060.0000 -167.73097 -159.78981 7.94117 2.62883 -159.32558 883.07397
3065.0000 -167.63772 -160.80302 6.83469 2.62274 -159.42803 887.40513
3070.0000 -168.34283 -160.63939 7.70344 2.52268 -161.11141 813.73369
3075.0000 -167.69437 -161.11190 6.58247 2.56902 -160.33175 836.34030
3080.0000 -166.45277 -159.18944 7.26333 2.60452 -159.73453 861.56785
3085.0000 -168.30362 -160.62384 7.67978 2.60667 -159.69832 884.45071
3090.0000 -167.56893 -160.33853 7.23040 2.58013 -160.14491 829.92639
3095.0000 -166.61527 -158.87597 7.73930 2.62736 -159.35029 869.69570
3100.0000 -165.88712 -158.75395 7.13317 2.71829 -157.82064 964.76221
3105.0000 -167.93521 -159.59841 8.33680 2.58671 -160.03416 841.79370
3110.0000 -167.75733 -159.33933 8.41799 2.60379 -159.74678 837.24367
3115.0000 -167.42009 -160.52281 6.89727 2.61826 -159.50338 898.71383
3120.0000 -167.82020 -160.29321 7.52699 2.59109 -159.96049 849.13655
3125.0000 -167.10616 -159.26870 7.83746 2.59703 -159.86061 869.26172
3130.0000 -166.22671 -156.88960 9.33710 2.69351 -158.23748 919.80628
3135.0000 -165.16766 -158.77612 6.39154 2.69669 -158.18400 907.31941
3140.0000 -168.04974 -159.45036 8.59938 2.66867 -158.65530 883.74900
3145.0000 -168.41979 -160.77098 7.64881 2.56679 -160.36930 846.75598
3150.0000 -166.87396 -159.22983 7.64412 2.57568 -160.21975 836.20932
3155.0000 -166.18409 -158.68985 7.49424 2.67384 -158.56843 920.84266
3160.0000 -167.35125 -159.87800 7.47325 2.61100 -159.62554 867.41945
3165.0000 -168.06311 -161.09745 6.96566 2.56317 -160.43027 831.38521
3170.0000 -168.12276 -161.81098 6.31179 2.50640 -161.38525 784.61208
3175.0000 -167.80273 -160.10006 7.70266 2.56549 -160.39118 838.50634
3180.0000 -167.58670 -159.43283 8.15387 2.65026 -158.96509 891.96444
3185.0000 -168.02733 -160.56052 7.46681 2.61493 -159.55947 863.63223
3190.0000 -165.38004 -157.24500 8.13504 2.67211 -158.59744 866.26735
3195.0000 -168.75247 -160.62299 8.12948 2.58216 -160.11065 847.62903
3200.0000 -167.83378 -160.97084 6.86295 2.52429 -161.08431 810.30091
3205.0000 -167.24645 -160.53592 6.71053 2.58151 -160.12158 860.54261
3210.0000 -166.00974 -159.67419 6.33555 2.59691 -159.86256 858.70809
3215.0000 -166.49091 -159.17052 7.32039 2.62337 -159.41744 873.60823
3220.0000 -167.99932 -161.06219 6.93713 2.58268 -160.10197 867.50680
3225.0000 -167.93128 -160.64345 7.28782 2.61492 -159.55953 864.68730
3230.0000 -166.44689 -158.06119 8.38570 2.63655 -159.19572 875.51427
3235.0000 -168.60441 -160.73938 7.86502 2.62309 -159.42212 851.49756
3240.0000 -167.73065 -159.18042 8.55023 2.58998 -159.97916 838.02552
3245.0000 -168.54970 -161.19077 7.35893 2.53923 -160.83287 789.29864
3250.0000 -167.34427 -158.76425 8.58002 2.59922 -159.82367 873.55236
FREEZING PROCESS: loop number 14 T-loop= 834.00000000000000
main_MD> interactions number 14 at Temperature= 834.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.76096 -2.20153 2.99223
force_rgl> df(natom) -3.23374 -4.80750 -4.67403
3255.0000 -167.75798 -160.75288 7.00511 2.60699 -159.69310 889.05557
3260.0000 -168.14914 -161.68201 6.46713 2.50957 -161.33197 806.23310
3265.0000 -166.98193 -160.68980 6.29213 2.49636 -161.55412 798.02041
3270.0000 -167.42704 -159.87897 7.54807 2.58098 -160.13064 876.30320
3275.0000 -169.27205 -162.42928 6.84278 2.53018 -160.98526 827.26794
3280.0000 -167.54952 -159.76843 7.78109 2.51415 -161.25492 825.49214
3285.0000 -166.99534 -159.14099 7.85435 2.63927 -159.14994 878.71246
3290.0000 -166.06613 -158.79081 7.27533 2.66515 -158.71465 905.76002
3295.0000 -168.53388 -159.59170 8.94218 2.60787 -159.67818 883.81066
3300.0000 -168.12380 -161.04885 7.07495 2.59587 -159.88009 891.29667
3305.0000 -167.56866 -160.05038 7.51829 2.58269 -160.10187 848.02317
3310.0000 -166.67764 -159.94590 6.73173 2.61188 -159.61076 877.49241
3315.0000 -168.40570 -160.68765 7.71806 2.60477 -159.73032 858.18498
3320.0000 -167.49033 -159.99080 7.49953 2.52186 -161.12518 793.88236
3325.0000 -167.78566 -158.47015 9.31550 2.64496 -159.05431 880.63532
3330.0000 -167.64953 -159.61088 8.03864 2.62843 -159.33242 868.36591
3335.0000 -167.64765 -159.70394 7.94372 2.62624 -159.36922 892.68368
3340.0000 -166.80085 -159.80702 6.99383 2.63014 -159.30355 888.11164
3345.0000 -166.82048 -159.40251 7.41797 2.58448 -160.07167 840.97058
3350.0000 -165.62074 -158.11143 7.50931 2.62297 -159.42424 847.79686
3355.0000 -165.92299 -159.29027 6.63272 2.64215 -159.10149 859.92064
3360.0000 -168.92578 -161.01823 7.90754 2.60932 -159.65389 870.46899
3365.0000 -169.13830 -161.38237 7.75593 2.52260 -161.11264 808.81419
3370.0000 -168.40350 -161.15297 7.25053 2.56036 -160.47751 861.20856
3375.0000 -168.93866 -161.20687 7.73179 2.55157 -160.62538 823.12457
3380.0000 -168.59989 -161.93971 6.66018 2.47324 -161.94307 789.39615
3385.0000 -167.83188 -161.39733 6.43455 2.50346 -161.43471 790.93776
3390.0000 -167.80756 -159.72760 8.07997 2.50784 -161.36105 779.39525
3395.0000 -168.39804 -160.45827 7.93977 2.62003 -159.47366 886.89310
3400.0000 -166.98555 -159.30090 7.68465 2.63800 -159.17129 861.80220
3405.0000 -167.11858 -161.51640 5.60218 2.57439 -160.24146 830.93032
3410.0000 -167.41385 -160.10071 7.31314 2.52961 -160.99472 798.34378
3415.0000 -167.67012 -160.10617 7.56395 2.62036 -159.46809 856.78527
3420.0000 -168.31386 -160.29896 8.01490 2.58943 -159.98845 852.43444
3425.0000 -168.03130 -160.84202 7.18928 2.58856 -160.00302 838.76227
3430.0000 -166.91542 -160.28378 6.63164 2.56288 -160.43511 829.82989
3435.0000 -165.88523 -158.85866 7.02656 2.59735 -159.85511 846.56846
3440.0000 -167.16584 -158.48222 8.68363 2.64661 -159.02647 906.38237
3445.0000 -166.69415 -159.57007 7.12408 2.60422 -159.73960 842.90331
3450.0000 -167.34396 -159.73966 7.60430 2.59397 -159.91197 833.33942
3455.0000 -167.68021 -160.61484 7.06537 2.57943 -160.15662 823.58753
3460.0000 -168.69715 -161.64551 7.05164 2.52502 -161.07202 829.71769
3465.0000 -169.32638 -162.07329 7.25309 2.47029 -161.99264 769.66938
3470.0000 -168.33485 -161.01852 7.31633 2.50066 -161.48181 813.98935
3475.0000 -168.23074 -160.28916 7.94158 2.54235 -160.78038 807.14221
3480.0000 -167.40270 -160.19387 7.20883 2.56157 -160.45704 833.93652
3485.0000 -168.09924 -160.17319 7.92605 2.59020 -159.97550 846.56680
3490.0000 -168.06989 -161.11733 6.95255 2.55921 -160.49676 819.24256
3495.0000 -166.54429 -157.83084 8.71346 2.62687 -159.35859 858.23794
3500.0000 -166.67577 -158.29396 8.38181 2.67250 -158.59102 910.86203
FREEZING PROCESS: loop number 15 T-loop= 809.00000000000000
main_MD> interactions number 15 at Temperature= 809.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.14949 -1.24951 0.32198
force_rgl> df(natom) -1.23041 3.26570 1.07543
3505.0000 -167.70193 -160.03817 7.66376 2.67772 -158.50314 904.65423
3510.0000 -167.54646 -160.22191 7.32456 2.58519 -160.05973 867.98790
3515.0000 -165.65423 -158.53200 7.12223 2.68145 -158.44047 898.70129
3520.0000 -166.79753 -159.55379 7.24374 2.61672 -159.52925 841.41760
3525.0000 -166.13755 -158.72221 7.41533 2.67512 -158.54680 873.91635
3530.0000 -168.10946 -162.23804 5.87142 2.53691 -160.87188 836.17747
3535.0000 -168.52344 -160.71659 7.80685 2.53206 -160.95348 784.42119
3540.0000 -168.75007 -161.06332 7.68675 2.55962 -160.48987 827.53832
3545.0000 -168.07942 -160.45571 7.62371 2.53274 -160.94219 815.96557
3550.0000 -168.68016 -163.55871 5.12145 2.48736 -161.70558 800.40112
3555.0000 -170.51112 -163.46992 7.04119 2.36281 -163.80087 717.89811
3560.0000 -168.57996 -162.17332 6.40664 2.40854 -163.03155 740.98166
3565.0000 -167.21417 -160.24425 6.96992 2.54581 -160.72226 812.26779
3570.0000 -168.01107 -159.81959 8.19148 2.62982 -159.30903 890.70415
3575.0000 -167.69812 -160.00218 7.69594 2.54146 -160.79540 839.02089
3580.0000 -166.53483 -159.51443 7.02040 2.58785 -160.01506 872.21020
3585.0000 -167.43608 -160.28356 7.15252 2.65380 -158.90549 888.66709
3590.0000 -166.10747 -158.06950 8.03797 2.63291 -159.25700 865.46004
3595.0000 -167.45556 -159.07836 8.37720 2.63361 -159.24511 863.95015
3600.0000 -167.66720 -158.58467 9.08253 2.64065 -159.12675 871.61737
3605.0000 -166.17669 -157.90926 8.26743 2.70407 -158.05987 909.14246
3610.0000 -168.20641 -160.40802 7.79839 2.62709 -159.35491 888.04427
3615.0000 -169.61114 -162.16842 7.44272 2.47981 -161.83251 810.72206
3620.0000 -167.13782 -160.49040 6.64743 2.48439 -161.75548 784.56002
3625.0000 -168.92073 -160.71668 8.20405 2.57410 -160.24640 842.84443
3630.0000 -168.02043 -161.59011 6.43032 2.55317 -160.59842 824.40360
3635.0000 -168.76903 -161.23867 7.53036 2.51509 -161.23911 783.40525
3640.0000 -169.02864 -162.50718 6.52147 2.47520 -161.91002 758.99614
3645.0000 -169.32289 -162.10236 7.22053 2.43640 -162.56284 739.29996
3650.0000 -168.58345 -160.87728 7.70617 2.48423 -161.75815 791.26335
3655.0000 -167.49897 -160.92983 6.56914 2.52246 -161.11513 807.44450
3660.0000 -166.10990 -158.51303 7.59687 2.59740 -159.85433 846.57692
3665.0000 -167.32711 -159.91148 7.41563 2.62236 -159.43447 860.94830
3670.0000 -168.96503 -161.09558 7.86944 2.52593 -161.05667 799.14520
3675.0000 -169.00172 -161.73908 7.26264 2.52977 -160.99207 817.55642
3680.0000 -168.38822 -161.88271 6.50551 2.51514 -161.23824 802.06312
3685.0000 -168.18554 -160.77199 7.41355 2.49941 -161.50274 803.45172
3690.0000 -168.37108 -160.54216 7.82891 2.61067 -159.63104 854.50487
3695.0000 -169.23476 -161.00043 8.23432 2.56164 -160.45587 838.92237
3700.0000 -167.89060 -160.58049 7.31011 2.57967 -160.15259 847.53324
3705.0000 -167.60677 -160.17007 7.43669 2.53321 -160.93428 809.02315
3710.0000 -167.75785 -161.21702 6.54083 2.58065 -160.13606 841.77025
3715.0000 -170.46303 -162.76167 7.70136 2.51558 -161.23074 791.88641
3720.0000 -168.16569 -160.15092 8.01477 2.50048 -161.48490 808.31638
3725.0000 -167.21800 -160.46543 6.75257 2.56607 -160.38136 810.03845
3730.0000 -168.06076 -161.64672 6.41404 2.54658 -160.70926 813.53957
3735.0000 -168.20218 -160.73324 7.46894 2.54512 -160.73381 817.86447
3740.0000 -167.59097 -160.88922 6.70175 2.53559 -160.89421 822.05833
3745.0000 -168.89790 -160.80212 8.09578 2.50259 -161.44933 803.09237
3750.0000 -169.70863 -162.38210 7.32653 2.44544 -162.41077 788.18189
FREEZING PROCESS: loop number 16 T-loop= 784.00000000000000
main_MD> interactions number 16 at Temperature= 784.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.50661 2.86190 1.23464
force_rgl> df(natom) 5.62265 -4.05029 -1.50816
3755.0000 -170.87823 -164.02751 6.85072 2.38425 -163.44006 734.23824
3760.0000 -169.17764 -163.03981 6.13783 2.38632 -163.40526 697.90099
3765.0000 -170.70497 -163.31191 7.39305 2.40588 -163.07628 739.27990
3770.0000 -170.11582 -162.87581 7.24001 2.36885 -163.69915 696.93121
3775.0000 -170.48028 -162.43678 8.04350 2.44950 -162.34237 757.64876
3780.0000 -168.11449 -161.48973 6.62476 2.44668 -162.38994 767.24106
3785.0000 -168.96013 -162.30211 6.65802 2.48741 -161.70475 771.48276
3790.0000 -168.65432 -162.20825 6.44607 2.45789 -162.20133 772.17835
3795.0000 -168.25136 -160.96927 7.28209 2.47986 -161.83178 784.55241
3800.0000 -168.51314 -161.45474 7.05840 2.51912 -161.17120 794.86206
3805.0000 -168.92541 -162.53495 6.39046 2.48339 -161.77238 769.25656
3810.0000 -169.98913 -162.55939 7.42973 2.43989 -162.50407 739.59053
3815.0000 -167.43447 -160.99151 6.44296 2.46745 -162.04041 784.89971
3820.0000 -169.89659 -163.14995 6.74664 2.43451 -162.59458 754.99670
3825.0000 -167.37786 -160.57159 6.80627 2.49960 -161.49959 769.63177
3830.0000 -167.52654 -161.17993 6.34661 2.59995 -159.81150 823.37362
3835.0000 -168.68506 -161.24604 7.43902 2.53809 -160.85209 816.75303
3840.0000 -167.41142 -159.66914 7.74228 2.51456 -161.24790 779.13750
3845.0000 -167.30230 -160.13543 7.16688 2.58873 -160.00015 837.69453
3850.0000 -167.18688 -159.92424 7.26264 2.55678 -160.53771 806.54937
3855.0000 -168.17573 -160.93610 7.23963 2.55624 -160.54676 830.16871
3860.0000 -168.63592 -161.80138 6.83454 2.51731 -161.20174 815.30577
3865.0000 -168.41371 -161.73011 6.68360 2.50573 -161.39653 783.51107
3870.0000 -167.11264 -160.58420 6.52844 2.56345 -160.42545 810.01654
3875.0000 -166.90878 -159.65625 7.25254 2.55175 -160.62231 821.90333
3880.0000 -166.98662 -159.41113 7.57549 2.62624 -159.36925 840.55462
3885.0000 -167.70641 -160.73139 6.97503 2.52192 -161.12410 787.47597
3890.0000 -168.97505 -161.50980 7.46525 2.50912 -161.33954 789.38218
3895.0000 -168.84034 -161.58794 7.25240 2.49654 -161.55114 800.09604
3900.0000 -167.80195 -161.44579 6.35616 2.50081 -161.47932 795.03525
3905.0000 -168.57906 -160.53825 8.04081 2.54809 -160.68390 834.99184
3910.0000 -166.42531 -158.68967 7.73564 2.60102 -159.79344 863.51393
3915.0000 -168.60414 -159.82364 8.78051 2.62602 -159.37296 882.90979
3920.0000 -167.91318 -160.90427 7.00890 2.56846 -160.34114 874.76340
3925.0000 -168.87754 -160.89418 7.98336 2.49490 -161.57863 801.61572
3930.0000 -168.34605 -162.28948 6.05657 2.48537 -161.73894 764.87056
3935.0000 -168.67743 -160.64321 8.03422 2.49257 -161.61792 776.82478
3940.0000 -167.61955 -161.89582 5.72373 2.56076 -160.47078 815.04235
3945.0000 -169.56020 -162.72706 6.83314 2.48109 -161.81096 765.58979
3950.0000 -169.93117 -163.65073 6.28044 2.37454 -163.60344 709.45821
3955.0000 -170.06659 -163.24733 6.81926 2.39478 -163.26292 715.72376
3960.0000 -168.64712 -162.49614 6.15099 2.38108 -163.49351 713.91606
3965.0000 -169.91638 -163.10377 6.81262 2.43324 -162.61591 760.82259
3970.0000 -168.65110 -162.06334 6.58776 2.41477 -162.92669 751.55169
3975.0000 -169.33678 -162.81760 6.51918 2.42108 -162.82061 738.15073
3980.0000 -169.26383 -163.36230 5.90153 2.40047 -163.16732 729.64486
3985.0000 -169.75084 -162.05459 7.69625 2.45642 -162.22606 784.33284
3990.0000 -168.38163 -162.65419 5.72744 2.42491 -162.75618 722.09907
3995.0000 -169.24385 -161.98959 7.25425 2.41117 -162.98729 735.92437
4000.0000 -168.97527 -161.90795 7.06732 2.45532 -162.24459 814.41155
FREEZING PROCESS: loop number 17 T-loop= 759.00000000000000
main_MD> interactions number 17 at Temperature= 759.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.88774 -1.11766 3.08386
force_rgl> df(natom) -2.45659 -2.38898 -1.16733
4005.0000 -171.82878 -163.85698 7.97180 2.44594 -162.40239 773.66748
4010.0000 -169.40792 -162.45788 6.95005 2.40085 -163.16094 728.97483
4015.0000 -169.66616 -162.86799 6.79817 2.40244 -163.13416 730.92331
4020.0000 -169.06684 -162.49445 6.57239 2.39902 -163.19165 728.33439
4025.0000 -170.77539 -163.15975 7.61564 2.39612 -163.24043 717.34703
4030.0000 -170.26775 -165.20369 5.06407 2.32913 -164.36735 692.23189
4035.0000 -170.29622 -164.99874 5.29748 2.29434 -164.95265 654.33174
4040.0000 -168.67260 -162.98889 5.68372 2.39171 -163.31463 714.67033
4045.0000 -169.05447 -164.00973 5.04474 2.39950 -163.18354 724.90627
4050.0000 -169.98758 -164.22480 5.76279 2.35515 -163.92972 651.17894
4055.0000 -169.91233 -163.74349 6.16884 2.38552 -163.41882 707.59051
4060.0000 -169.29325 -162.02927 7.26398 2.44714 -162.38214 732.72598
4065.0000 -168.20773 -160.50538 7.70235 2.53328 -160.93308 830.83368
4070.0000 -169.45995 -161.55210 7.90785 2.49991 -161.49436 799.56096
4075.0000 -168.86917 -162.74424 6.12493 2.43480 -162.58975 748.32665
4080.0000 -168.17613 -161.83446 6.34167 2.44866 -162.35651 726.81216
4085.0000 -168.82168 -163.02654 5.79514 2.45626 -162.22873 764.77830
4090.0000 -167.66928 -159.96153 7.70775 2.49191 -161.62894 801.48911
4095.0000 -168.66314 -162.11180 6.55134 2.51254 -161.28189 781.63761
4100.0000 -169.41793 -162.43479 6.98314 2.46689 -162.04991 789.15116
4105.0000 -168.90864 -161.52775 7.38089 2.47350 -161.93874 778.02742
4110.0000 -169.93682 -162.96273 6.97409 2.45996 -162.16653 770.99186
4115.0000 -170.39491 -163.01761 7.37730 2.44122 -162.48180 744.12782
4120.0000 -169.85184 -163.63035 6.22149 2.34675 -164.07094 685.70284
4125.0000 -170.78727 -164.17551 6.61176 2.38924 -163.35620 729.43027
4130.0000 -170.37283 -164.60604 5.76679 2.33212 -164.31706 680.81378
4135.0000 -169.29466 -162.57951 6.71516 2.37340 -163.62272 691.02146
4140.0000 -167.88890 -161.30135 6.58755 2.44967 -162.33962 763.11527
4145.0000 -169.36458 -163.53498 5.82960 2.45345 -162.27598 748.94945
4150.0000 -170.14409 -163.90092 6.24316 2.37970 -163.51667 731.24825
4155.0000 -168.78937 -162.28080 6.50857 2.38947 -163.35226 714.83913
4160.0000 -168.70559 -162.88270 5.82289 2.43276 -162.62413 728.08420
4165.0000 -167.63977 -160.58348 7.05629 2.50637 -161.38570 790.79160
4170.0000 -168.74759 -161.28229 7.46530 2.51893 -161.17448 755.95887
4175.0000 -168.29193 -162.38551 5.90643 2.47483 -161.91625 770.94005
4180.0000 -167.99455 -161.67247 6.32208 2.47894 -161.84717 793.21480
4185.0000 -168.51453 -160.34356 8.17098 2.56495 -160.40025 817.43495
4190.0000 -168.97180 -161.91308 7.05872 2.53880 -160.84025 812.63996
4195.0000 -168.63696 -162.67444 5.96252 2.47042 -161.99049 762.82665
4200.0000 -169.06444 -161.27963 7.78482 2.46943 -162.00718 766.33039
4205.0000 -168.48195 -161.01405 7.46790 2.53654 -160.87813 805.52142
4210.0000 -167.31492 -160.62028 6.69464 2.48550 -161.73676 780.67311
4215.0000 -168.30250 -161.70399 6.59851 2.50863 -161.34775 778.83799
4220.0000 -168.47001 -161.05252 7.41749 2.54347 -160.76163 825.99666
4225.0000 -168.49121 -161.05882 7.43239 2.51334 -161.26849 800.44980
4230.0000 -167.80853 -159.90665 7.90188 2.55688 -160.53604 824.57234
4235.0000 -168.37999 -162.95242 5.42756 2.50252 -161.45056 798.58744
4240.0000 -167.73474 -161.13567 6.59907 2.44120 -162.48210 729.38109
4245.0000 -168.74060 -161.98776 6.75283 2.48458 -161.75237 776.93029
4250.0000 -167.38599 -160.84688 6.53911 2.51035 -161.31871 812.43396
FREEZING PROCESS: loop number 18 T-loop= 734.00000000000000
main_MD> interactions number 18 at Temperature= 734.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.25681 -1.63914 0.85499
force_rgl> df(natom) 0.97387 0.40041 0.72537
4255.0000 -168.27250 -162.05631 6.21619 2.53138 -160.96503 811.89707
4260.0000 -169.30117 -163.38110 5.92006 2.43376 -162.60725 736.26740
4265.0000 -168.81170 -162.75715 6.05455 2.39995 -163.17599 722.93140
4270.0000 -168.13893 -162.29999 5.83894 2.40556 -163.08162 724.78776
4275.0000 -168.49206 -163.46042 5.03164 2.38177 -163.48191 684.90257
4280.0000 -168.94520 -162.34180 6.60340 2.43644 -162.56219 733.14734
4285.0000 -168.42111 -163.03848 5.38263 2.44803 -162.36714 742.63141
4290.0000 -171.40371 -164.90206 6.50165 2.34861 -164.03968 692.51054
4295.0000 -168.17910 -161.60534 6.57375 2.40970 -163.01202 763.23756
4300.0000 -169.05702 -162.20667 6.85035 2.51611 -161.22187 800.55186
4305.0000 -168.87722 -162.40905 6.46817 2.47219 -161.96076 757.61390
4310.0000 -169.54302 -163.33168 6.21133 2.41083 -162.99295 702.26305
4315.0000 -170.80357 -164.01379 6.78977 2.39355 -163.28373 715.01934
4320.0000 -168.94415 -162.96298 5.98117 2.37845 -163.53766 690.45291
4325.0000 -169.73177 -162.50111 7.23066 2.41498 -162.92320 707.98355
4330.0000 -170.56190 -163.43256 7.12934 2.42078 -162.82563 748.20578
4335.0000 -169.27114 -162.46490 6.80624 2.41638 -162.89959 725.51086
4340.0000 -167.96403 -161.53832 6.42572 2.47838 -161.85664 753.96060
4345.0000 -167.77971 -160.36571 7.41400 2.52040 -161.14975 782.30738
4350.0000 -166.98855 -159.83975 7.14880 2.56571 -160.38754 834.20759
4355.0000 -169.72102 -162.93339 6.78763 2.48884 -161.68058 757.57074
4360.0000 -169.93383 -163.26050 6.67333 2.41441 -162.93269 728.55712
4365.0000 -169.14574 -162.01931 7.12643 2.46078 -162.15263 747.66125
4370.0000 -168.89101 -161.62283 7.26818 2.45208 -162.29907 759.81533
4375.0000 -168.35149 -160.79502 7.55647 2.51636 -161.21765 806.90623
4380.0000 -168.29345 -160.55610 7.73735 2.59039 -159.97232 836.09397
4385.0000 -168.94265 -161.84865 7.09400 2.48173 -161.80022 784.32403
4390.0000 -169.67549 -162.76988 6.90561 2.44901 -162.35064 766.14492
4395.0000 -168.76438 -161.92716 6.83722 2.41747 -162.88126 753.35997
4400.0000 -169.49866 -162.18148 7.31718 2.45684 -162.21889 745.55898
4405.0000 -168.95373 -162.73589 6.21784 2.43711 -162.55083 743.55757
4410.0000 -169.20529 -163.00723 6.19806 2.43279 -162.62357 736.70323
4415.0000 -169.62448 -162.51365 7.11083 2.40871 -163.02858 742.14895
4420.0000 -171.07809 -164.34464 6.73345 2.39034 -163.33775 721.68224
4425.0000 -168.56932 -162.82826 5.74105 2.35513 -163.93002 684.67873
4430.0000 -169.81575 -164.13254 5.68321 2.38794 -163.37801 699.74601
4435.0000 -170.10860 -164.00051 6.10809 2.38681 -163.39705 709.08790
4440.0000 -168.79963 -163.49344 5.30619 2.33519 -164.26554 699.24079
4445.0000 -168.09950 -161.40972 6.68978 2.43224 -162.63289 747.64945
4450.0000 -168.05344 -162.43904 5.61440 2.47778 -161.86662 757.03955
4455.0000 -169.56825 -163.34677 6.22147 2.43480 -162.58970 751.71230
4460.0000 -168.95581 -162.16003 6.79578 2.44759 -162.37456 750.56221
4465.0000 -168.27415 -161.58633 6.68782 2.47334 -161.94145 789.75520
4470.0000 -171.10931 -165.09178 6.01753 2.37216 -163.64350 721.40531
4475.0000 -170.19749 -163.05610 7.14140 2.34403 -164.11675 707.44341
4480.0000 -169.83973 -163.54850 6.29124 2.38373 -163.44897 727.26885
4485.0000 -170.27777 -163.99451 6.28326 2.40130 -163.15329 744.75770
4490.0000 -169.71311 -163.55953 6.15358 2.36741 -163.72341 710.28074
4495.0000 -168.64175 -162.04003 6.60172 2.42924 -162.68323 730.46888
4500.0000 -170.50580 -163.36497 7.14083 2.42671 -162.72590 768.61150
FREEZING PROCESS: loop number 19 T-loop= 709.00000000000000
main_MD> interactions number 19 at Temperature= 709.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.47325 -1.77826 -4.07855
force_rgl> df(natom) 1.47956 5.31837 3.75167
4505.0000 -170.45930 -163.90679 6.55252 2.38125 -163.49066 729.98452
4510.0000 -168.87865 -161.89488 6.98377 2.36281 -163.80089 697.66869
4515.0000 -169.50719 -162.39981 7.10738 2.46543 -162.07451 786.32647
4520.0000 -170.27808 -163.88299 6.39509 2.40598 -163.07461 739.26280
4525.0000 -169.79863 -164.04401 5.75462 2.37738 -163.55563 697.35861
4530.0000 -170.62791 -164.72731 5.90060 2.37634 -163.57321 681.53529
4535.0000 -171.35903 -165.49150 5.86753 2.24395 -165.80032 608.40590
4540.0000 -170.63781 -165.22718 5.41063 2.28327 -165.13893 661.02030
4545.0000 -171.69168 -164.36342 7.32826 2.30834 -164.71708 670.45217
4550.0000 -168.91246 -163.20077 5.71169 2.34625 -164.07947 706.91489
4555.0000 -169.74052 -162.91886 6.82166 2.40163 -163.14780 714.29043
4560.0000 -169.48479 -162.94400 6.54079 2.44668 -162.38986 775.69676
4565.0000 -169.76394 -163.66534 6.09861 2.41025 -163.00274 743.51956
4570.0000 -170.30724 -164.62353 5.68371 2.33043 -164.34551 683.37671
4575.0000 -170.29654 -163.94759 6.34895 2.30933 -164.70059 669.02430
4580.0000 -169.87435 -162.74130 7.13305 2.37076 -163.66712 724.46220
4585.0000 -169.59505 -162.07578 7.51927 2.46394 -162.09953 785.15856
4590.0000 -170.39433 -164.66098 5.73335 2.38624 -163.40672 726.72627
4595.0000 -171.11843 -165.08938 6.02905 2.30759 -164.72981 682.74518
4600.0000 -169.34389 -162.17819 7.16569 2.36699 -163.73057 703.24021
4605.0000 -169.64320 -162.33605 7.30715 2.43187 -162.63911 727.72596
4610.0000 -169.50011 -163.02220 6.47791 2.42948 -162.67917 735.52059
4615.0000 -169.17651 -162.49983 6.67668 2.43407 -162.60199 718.61305
4620.0000 -168.74039 -162.61892 6.12147 2.41717 -162.88627 726.19143
4625.0000 -168.83553 -161.88117 6.95437 2.46183 -162.13499 744.17704
4630.0000 -169.81565 -161.93982 7.87584 2.47029 -161.99268 764.26614
4635.0000 -169.70560 -162.93530 6.77031 2.39682 -163.22863 696.45810
4640.0000 -169.89795 -163.21383 6.68412 2.40123 -163.15443 699.63383
4645.0000 -169.59902 -163.06344 6.53558 2.41335 -162.95061 737.95488
4650.0000 -170.21249 -164.57581 5.63669 2.34601 -164.08337 668.81659
4655.0000 -171.11119 -164.37840 6.73279 2.33889 -164.20323 698.93835
4660.0000 -170.10953 -164.18851 5.92102 2.33048 -164.34467 687.18039
4665.0000 -170.72820 -163.22849 7.49971 2.35719 -163.89531 688.95720
4670.0000 -169.61123 -162.91822 6.69301 2.41795 -162.87313 739.39252
4675.0000 -170.55399 -163.56303 6.99096 2.39310 -163.29119 719.95496
4680.0000 -171.87154 -164.78604 7.08550 2.31267 -164.64429 664.93986
4685.0000 -171.15206 -164.17466 6.97740 2.32934 -164.36381 702.60873
4690.0000 -170.09680 -163.83986 6.25693 2.33778 -164.22196 682.02272
4695.0000 -170.30263 -164.30354 5.99909 2.32889 -164.37149 666.91203
4700.0000 -169.25781 -162.46744 6.79037 2.43117 -162.65088 749.87754
4705.0000 -168.56740 -162.74215 5.82525 2.44522 -162.41441 764.62195
4710.0000 -169.94903 -163.22126 6.72777 2.38842 -163.37000 718.03008
4715.0000 -170.57046 -164.42285 6.14761 2.39188 -163.31176 724.00220
4720.0000 -169.80829 -162.79817 7.01012 2.37407 -163.61134 713.53846
4725.0000 -170.97350 -163.91111 7.06239 2.40532 -163.08574 731.58409
4730.0000 -171.05095 -165.87269 5.17827 2.27810 -165.22593 662.61980
4735.0000 -170.61236 -164.90889 5.70347 2.25865 -165.55311 632.17237
4740.0000 -170.12961 -164.33893 5.79068 2.32415 -164.45112 676.23448
4745.0000 -170.39798 -164.45004 5.94794 2.30312 -164.80490 624.51633
4750.0000 -169.92215 -164.02651 5.89564 2.36765 -163.71939 678.34278
FREEZING PROCESS: loop number 20 T-loop= 684.00000000000000
main_MD> interactions number 20 at Temperature= 684.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.72644 0.23724 0.05144
force_rgl> df(natom) 5.44620 2.82620 -0.79651
4755.0000 -171.11799 -165.04708 6.07091 2.34339 -164.12759 702.78504
4760.0000 -170.93263 -165.12353 5.80910 2.30552 -164.76467 676.00770
4765.0000 -171.54133 -165.61499 5.92633 2.25903 -165.54668 638.64831
4770.0000 -171.22924 -166.46048 4.76876 2.25697 -165.58140 637.48266
4775.0000 -172.54169 -166.89758 5.64411 2.22654 -166.09325 619.70740
4780.0000 -172.05174 -166.65755 5.39419 2.16545 -167.12092 577.48533
4785.0000 -171.71728 -165.41251 6.30477 2.22879 -166.05541 640.74381
4790.0000 -170.53776 -164.52565 6.01211 2.37609 -163.57735 746.27292
4795.0000 -170.24112 -163.39216 6.84897 2.34527 -164.09596 686.95680
4800.0000 -169.14563 -163.07831 6.06732 2.41714 -162.88680 751.04225
4805.0000 -169.42931 -163.42979 5.99952 2.39582 -163.24546 717.72947
4810.0000 -170.39313 -164.31528 6.07785 2.32435 -164.44778 672.64827
4815.0000 -170.67403 -164.61784 6.05619 2.28126 -165.17268 651.57892
4820.0000 -171.60077 -165.61591 5.98486 2.30533 -164.76787 674.19630
4825.0000 -170.65536 -165.63250 5.02286 2.26695 -165.41351 627.90238
4830.0000 -171.01299 -165.76650 5.24649 2.24906 -165.71450 629.55900
4835.0000 -170.84011 -165.09946 5.74065 2.27409 -165.29342 645.81765
4840.0000 -170.51887 -164.97985 5.53901 2.28317 -165.14059 645.23782
4845.0000 -172.52850 -167.03607 5.49243 2.24498 -165.78306 600.22545
4850.0000 -172.16973 -165.94887 6.22086 2.22966 -166.04076 621.80488
4855.0000 -170.21708 -163.94676 6.27033 2.31074 -164.67684 649.92674
4860.0000 -171.23440 -164.94815 6.28625 2.30271 -164.81191 636.72891
4865.0000 -170.67044 -165.32095 5.34949 2.27730 -165.23936 642.06163
4870.0000 -170.93615 -165.60431 5.33184 2.29375 -164.96257 638.80906
4875.0000 -170.72622 -164.11427 6.61195 2.30068 -164.84595 649.66182
4880.0000 -169.92559 -164.14779 5.77781 2.38157 -163.48527 732.83307
4885.0000 -171.32555 -163.82205 7.50350 2.35032 -164.01093 712.19240
4890.0000 -170.23144 -163.95386 6.27758 2.37854 -163.53612 734.85939
4895.0000 -170.55554 -163.77378 6.78176 2.39212 -163.30781 714.66671
4900.0000 -169.67484 -164.02737 5.64747 2.34131 -164.16243 697.29039
4905.0000 -171.62054 -166.27323 5.34731 2.26382 -165.46603 663.13972
4910.0000 -171.41636 -165.05650 6.35987 2.24646 -165.75808 638.35466
4915.0000 -168.88249 -163.50517 5.37732 2.32938 -164.36315 693.98858
4920.0000 -171.37250 -164.57085 6.80165 2.37395 -163.61339 742.52806
4925.0000 -171.22458 -165.38122 5.84336 2.29287 -164.97748 658.68925
4930.0000 -171.36371 -164.77562 6.58809 2.26555 -165.43703 613.96144
4935.0000 -169.89101 -163.78224 6.10877 2.35390 -163.95064 687.15987
4940.0000 -170.01768 -163.63016 6.38752 2.35396 -163.94965 681.04251
4945.0000 -170.83870 -165.59423 5.24447 2.30172 -164.82852 667.72325
4950.0000 -170.56180 -164.52717 6.03463 2.30045 -164.84985 654.75327
4955.0000 -170.39690 -164.95366 5.44324 2.33423 -164.28159 664.09505
4960.0000 -170.10519 -163.34089 6.76430 2.33523 -164.26480 691.39908
4965.0000 -171.16007 -164.13114 7.02893 2.35411 -163.94710 726.27753
4970.0000 -170.68621 -164.25580 6.43041 2.29419 -164.95513 658.60323
4975.0000 -169.96762 -163.50548 6.46214 2.35346 -163.95811 707.22168
4980.0000 -170.25507 -163.82191 6.43316 2.31526 -164.60078 671.49649
4985.0000 -169.91451 -163.70167 6.21284 2.37217 -163.64333 721.45765
4990.0000 -169.74942 -163.65322 6.09620 2.36206 -163.81336 678.91525
4995.0000 -169.31083 -162.62410 6.68674 2.42315 -162.78576 711.02223
5000.0000 -170.42193 -163.04500 7.37693 2.42562 -162.74416 706.12458
FREEZING PROCESS: loop number 21 T-loop= 659.00000000000000
main_MD> interactions number 21 at Temperature= 659.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.33293 -2.00360 0.26298
force_rgl> df(natom) -0.39660 1.74072 0.22709
5005.0000 -170.02719 -163.80216 6.22503 2.35020 -164.01289 692.24512
5010.0000 -168.92223 -163.74915 5.17309 2.33779 -164.22169 688.94850
5015.0000 -170.24973 -164.09044 6.15930 2.34911 -164.03132 682.20505
5020.0000 -170.78876 -165.38248 5.40628 2.33493 -164.26985 665.51148
5025.0000 -169.54833 -163.32977 6.21856 2.30506 -164.77233 640.38814
5030.0000 -170.07404 -164.24436 5.82968 2.34662 -164.07324 677.33602
5035.0000 -171.05905 -165.20988 5.84917 2.30325 -164.80276 646.91777
5040.0000 -170.62027 -164.95154 5.66873 2.30266 -164.81264 665.31535
5045.0000 -170.82760 -165.15397 5.67363 2.31529 -164.60025 671.20020
5050.0000 -171.27625 -165.46937 5.80688 2.24026 -165.86240 618.12711
5055.0000 -170.67744 -165.79520 4.88223 2.23680 -165.92067 602.06740
5060.0000 -169.98070 -165.32071 4.65999 2.28052 -165.18518 637.96402
5065.0000 -171.49059 -165.33631 6.15428 2.26480 -165.44966 635.69834
5070.0000 -171.37046 -165.22100 6.14946 2.28196 -165.16101 660.03672
5075.0000 -171.70047 -165.88605 5.81442 2.25007 -165.69736 651.43403
5080.0000 -171.97757 -165.54488 6.43269 2.26285 -165.48241 616.46701
5085.0000 -170.86142 -165.24225 5.61917 2.26550 -165.43788 625.29615
5090.0000 -169.52299 -163.73666 5.78633 2.34092 -164.16907 685.79432
5095.0000 -169.97375 -164.18069 5.79306 2.35167 -163.98823 702.61125
5100.0000 -170.71394 -165.44820 5.26574 2.28989 -165.02749 656.24128
5105.0000 -170.42205 -165.28474 5.13731 2.28111 -165.17526 647.25227
5110.0000 -170.70537 -165.39574 5.30963 2.29205 -164.99126 660.28410
5115.0000 -171.27326 -165.95267 5.32059 2.28339 -165.13691 662.61890
5120.0000 -169.12980 -163.53697 5.59283 2.27171 -165.33346 637.23582
5125.0000 -170.37138 -164.67715 5.69422 2.32712 -164.40126 690.35495
5130.0000 -170.85294 -165.14471 5.70823 2.32623 -164.41622 657.52967
5135.0000 -172.09852 -165.03685 7.06167 2.30609 -164.75504 665.85895
5140.0000 -171.88924 -164.28849 7.60075 2.33511 -164.26685 702.89637
5145.0000 -169.75992 -164.00260 5.75732 2.34697 -164.06729 695.10849
5150.0000 -171.62498 -164.89892 6.72606 2.32022 -164.51734 670.35592
5155.0000 -171.32785 -164.80576 6.52209 2.28551 -165.10128 675.49706
5160.0000 -170.38920 -164.33077 6.05843 2.35191 -163.98422 705.53585
5165.0000 -170.79683 -164.17450 6.62234 2.32815 -164.38385 678.92570
5170.0000 -169.10117 -162.97684 6.12433 2.37746 -163.55444 726.59658
5175.0000 -168.97111 -162.35969 6.61141 2.43638 -162.56314 761.47719
5180.0000 -170.39524 -165.10470 5.29054 2.39557 -163.24963 712.81522
5185.0000 -170.10856 -164.01325 6.09531 2.32190 -164.48910 684.97991
5190.0000 -171.32057 -164.44986 6.87071 2.33019 -164.34966 702.28599
5195.0000 -171.26793 -165.96675 5.30117 2.24295 -165.81721 640.90648
5200.0000 -172.42602 -166.89079 5.53522 2.18794 -166.74265 615.19638
5205.0000 -170.68322 -163.76136 6.92185 2.27124 -165.34122 663.19228
5210.0000 -170.25923 -164.51202 5.74721 2.35743 -163.89139 707.76547
5215.0000 -170.82767 -166.11028 4.71739 2.26149 -165.50536 612.98173
5220.0000 -169.90709 -164.07988 5.82722 2.27709 -165.24282 643.66003
5225.0000 -168.96753 -163.13633 5.83121 2.36832 -163.70806 679.88288
5230.0000 -170.24507 -163.39222 6.85285 2.40242 -163.13443 699.58929
5235.0000 -171.41949 -165.11902 6.30047 2.30483 -164.77620 670.96854
5240.0000 -171.62226 -166.39488 5.22739 2.24118 -165.84703 651.54278
5245.0000 -170.75133 -164.86739 5.88394 2.26030 -165.52532 655.29566
5250.0000 -170.74960 -164.33002 6.41958 2.30882 -164.70911 674.10098
FREEZING PROCESS: loop number 22 T-loop= 634.00000000000000
main_MD> interactions number 22 at Temperature= 634.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.34991 1.57910 0.32971
force_rgl> df(natom) -2.38457 0.23690 2.43505
5255.0000 -169.58133 -163.98140 5.59994 2.33518 -164.26559 676.44799
5260.0000 -171.49512 -164.84274 6.65239 2.32698 -164.40366 665.78367
5265.0000 -171.48352 -166.49075 4.99277 2.26464 -165.45240 667.52142
5270.0000 -171.35266 -165.30165 6.05100 2.22529 -166.11430 618.30516
5275.0000 -171.67950 -166.29666 5.38284 2.21705 -166.25287 589.83782
5280.0000 -170.54767 -164.70402 5.84365 2.23879 -165.88711 616.58511
5285.0000 -171.77345 -166.22254 5.55090 2.28253 -165.15131 649.19697
5290.0000 -171.12690 -166.50996 4.61694 2.22169 -166.17482 613.48611
5295.0000 -170.83489 -166.25518 4.57972 2.23333 -165.97901 619.49946
5300.0000 -171.37276 -165.04916 6.32360 2.22540 -166.11251 607.90390
5305.0000 -170.90744 -164.70999 6.19745 2.31564 -164.59433 665.55315
5310.0000 -172.43208 -166.98729 5.44479 2.20471 -166.46053 613.41773
5315.0000 -171.66846 -166.54985 5.11861 2.18213 -166.84042 576.55451
5320.0000 -172.09743 -166.09656 6.00087 2.19599 -166.60715 595.97117
5325.0000 -171.55674 -166.66538 4.89136 2.20549 -166.44737 618.67291
5330.0000 -170.97082 -164.55333 6.41749 2.26327 -165.47542 653.36770
5335.0000 -171.70640 -166.33248 5.37392 2.26268 -165.48521 644.72660
5340.0000 -171.80040 -166.65258 5.14782 2.21062 -166.36110 604.03555
5345.0000 -171.56123 -165.53401 6.02722 2.23290 -165.98632 614.05400
5350.0000 -171.27610 -165.41801 5.85809 2.24681 -165.75231 607.80711
5355.0000 -171.39974 -167.01640 4.38334 2.17890 -166.89475 564.43331
5360.0000 -170.93426 -165.50513 5.42913 2.19767 -166.57900 569.86198
5365.0000 -171.64226 -166.43995 5.20230 2.22783 -166.07161 607.34670
5370.0000 -172.03462 -166.86160 5.17302 2.22070 -166.19151 635.47901
5375.0000 -173.00195 -167.06803 5.93392 2.18805 -166.74084 602.93104
5380.0000 -171.38529 -166.13563 5.24966 2.19934 -166.55087 600.71213
5385.0000 -171.35016 -165.59306 5.75710 2.23821 -165.89690 619.50713
5390.0000 -170.69767 -164.46342 6.23425 2.28096 -165.17777 623.50824
5395.0000 -170.72697 -165.51475 5.21222 2.30627 -164.75200 655.36583
5400.0000 -171.92889 -166.79933 5.12956 2.20500 -166.45561 598.19302
5405.0000 -170.58215 -165.31179 5.27036 2.27723 -165.24054 645.43399
5410.0000 -170.79879 -164.75215 6.04664 2.30121 -164.83703 657.06530
5415.0000 -169.75840 -164.08673 5.67167 2.32235 -164.48141 674.49270
5420.0000 -171.91168 -165.57852 6.33316 2.28451 -165.11799 651.94209
5425.0000 -170.31065 -165.55035 4.76031 2.24658 -165.75609 630.79277
5430.0000 -172.30236 -164.57121 7.73114 2.22864 -166.05797 640.26044
5435.0000 -170.74795 -165.55501 5.19293 2.30783 -164.72573 658.66710
5440.0000 -171.34656 -166.15931 5.18725 2.22316 -166.15008 626.21859
5445.0000 -171.43071 -164.75462 6.67609 2.29296 -164.97588 667.79759
5450.0000 -171.89458 -166.40414 5.49045 2.23636 -165.92805 618.10967
5455.0000 -171.69533 -166.24216 5.45318 2.21925 -166.21582 585.05143
5460.0000 -171.57578 -166.05998 5.51580 2.22247 -166.16171 591.07220
5465.0000 -170.28041 -164.05341 6.22700 2.26135 -165.50760 633.51743
5470.0000 -169.86647 -164.18733 5.67913 2.35450 -163.94068 692.11853
5475.0000 -170.84706 -163.56165 7.28541 2.32918 -164.36655 684.75815
5480.0000 -170.47157 -163.58138 6.89020 2.35459 -163.93906 707.78874
5485.0000 -170.29969 -164.51616 5.78353 2.34183 -164.15383 719.20774
5490.0000 -171.11264 -165.89480 5.21784 2.30087 -164.84281 642.89907
5495.0000 -171.30317 -165.12127 6.18189 2.28662 -165.08251 635.63930
5500.0000 -171.64566 -165.95754 5.68812 2.28658 -165.08323 624.71313
FREEZING PROCESS: loop number 23 T-loop= 609.00000000000000
main_MD> interactions number 23 at Temperature= 609.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.54655 -1.78797 4.18241
force_rgl> df(natom) -1.08215 2.71047 1.28257
5505.0000 -171.40930 -166.33012 5.07917 2.23664 -165.92334 605.63431
5510.0000 -171.08241 -165.43263 5.64977 2.22711 -166.08373 607.54183
5515.0000 -171.49456 -166.21090 5.28366 2.28425 -165.12243 663.39971
5520.0000 -171.84023 -166.47147 5.36876 2.21606 -166.26965 595.32285
5525.0000 -171.68863 -166.97313 4.71550 2.19520 -166.62043 597.46641
5530.0000 -171.94375 -166.42328 5.52047 2.19197 -166.67489 589.82266
5535.0000 -171.18198 -166.37037 4.81161 2.22490 -166.12090 592.32482
5540.0000 -172.05232 -165.83383 6.21849 2.26776 -165.39983 647.11687
5545.0000 -172.35545 -166.28660 6.06885 2.22223 -166.16572 614.80729
5550.0000 -171.54956 -166.90864 4.64091 2.14772 -167.41919 591.38565
5555.0000 -172.59071 -167.60550 4.98521 2.17549 -166.95208 586.69327
5560.0000 -171.65023 -167.44952 4.20071 2.14388 -167.48384 557.64720
5565.0000 -171.27017 -166.03881 5.23136 2.19519 -166.62073 586.09699
5570.0000 -171.46786 -166.18360 5.28426 2.21242 -166.33084 592.84668
5575.0000 -170.83320 -164.67142 6.16178 2.25169 -165.67021 625.03942
5580.0000 -171.69559 -165.85754 5.83805 2.27858 -165.21773 627.15747
5585.0000 -171.48450 -165.96846 5.51604 2.23993 -165.86807 612.40980
5590.0000 -170.45450 -165.45168 5.00281 2.25019 -165.69539 603.99883
5595.0000 -171.27182 -166.09058 5.18124 2.27362 -165.30120 629.39545
5600.0000 -170.60899 -165.14769 5.46130 2.20906 -166.38730 591.15761
5605.0000 -171.56425 -166.39361 5.17064 2.22529 -166.11434 609.25455
5610.0000 -170.03293 -165.15140 4.88153 2.24459 -165.78959 600.67306
5615.0000 -170.56929 -165.31545 5.25384 2.24573 -165.77039 578.75936
5620.0000 -171.36632 -165.42282 5.94350 2.27034 -165.35638 597.17802
5625.0000 -170.75753 -165.48171 5.27582 2.25613 -165.59554 623.76298
5630.0000 -171.74945 -165.79234 5.95711 2.26082 -165.51662 620.84158
5635.0000 -171.39055 -165.85869 5.53186 2.23021 -166.03146 602.27817
5640.0000 -172.34051 -166.68427 5.65624 2.19204 -166.67359 604.13434
5645.0000 -171.78936 -166.94743 4.84193 2.19112 -166.68914 572.24074
5650.0000 -171.20458 -165.92027 5.28431 2.18548 -166.78405 550.28432
5655.0000 -170.28473 -165.31757 4.96715 2.24126 -165.84563 605.21270
5660.0000 -169.94339 -164.74402 5.19937 2.31547 -164.59713 654.83631
5665.0000 -170.67398 -164.96253 5.71145 2.30156 -164.83121 637.85262
5670.0000 -171.60268 -166.06900 5.53368 2.26190 -165.49833 645.86114
5675.0000 -171.64462 -166.47429 5.17033 2.21045 -166.36393 614.85256
5680.0000 -171.17513 -165.61472 5.56041 2.22606 -166.10126 618.40489
5685.0000 -171.71712 -165.32318 6.39394 2.25159 -165.67180 624.75233
5690.0000 -171.12991 -166.01953 5.11038 2.31166 -164.66133 657.31660
5695.0000 -171.27958 -165.87437 5.40520 2.24516 -165.78003 605.53298
5700.0000 -170.86278 -165.19486 5.66792 2.26153 -165.50460 630.31011
5705.0000 -170.17269 -164.87122 5.30147 2.28877 -165.04647 654.50173
5710.0000 -171.08506 -165.37619 5.70887 2.28744 -165.06870 640.20943
5715.0000 -171.22773 -166.25483 4.97290 2.21071 -166.35955 597.19155
5720.0000 -172.81131 -166.74433 6.06698 2.20113 -166.52073 587.70631
5725.0000 -172.06185 -166.55891 5.50293 2.15922 -167.22581 581.11528
5730.0000 -173.02768 -167.62911 5.39858 2.14112 -167.53024 573.80185
5735.0000 -172.72589 -167.19878 5.52712 2.13894 -167.56698 570.81649
5740.0000 -172.96096 -167.59567 5.36529 2.14662 -167.43772 573.04089
5745.0000 -172.74428 -167.67974 5.06454 2.14616 -167.44543 574.58142
5750.0000 -172.65863 -168.47123 4.18739 2.11290 -168.00501 566.34999
FREEZING PROCESS: loop number 24 T-loop= 584.00000000000000
main_MD> interactions number 24 at Temperature= 584.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.97250 -0.48991 0.20536
force_rgl> df(natom) -1.11245 1.32847 -4.11821
5755.0000 -173.65386 -168.62467 5.02920 2.07974 -168.56278 549.41943
5760.0000 -172.90694 -168.02505 4.88188 2.10298 -168.17186 575.82595
5765.0000 -171.08278 -165.88742 5.19535 2.18824 -166.73764 604.80734
5770.0000 -172.23570 -167.59429 4.64142 2.16053 -167.20375 560.74272
5775.0000 -172.45931 -167.67445 4.78486 2.12056 -167.87623 544.71964
5780.0000 -172.93646 -167.86488 5.07157 2.12708 -167.76650 543.62478
5785.0000 -173.61924 -168.21839 5.40085 2.10849 -168.07919 529.71869
5790.0000 -172.44950 -167.69327 4.75623 2.09755 -168.26319 527.37488
5795.0000 -172.10452 -167.92165 4.18287 2.10058 -168.21232 542.46276
5800.0000 -173.74331 -168.97562 4.76768 2.09288 -168.34189 549.06414
5805.0000 -172.13413 -167.51426 4.61987 2.06774 -168.76467 530.00930
5810.0000 -172.26030 -166.68205 5.57825 2.14767 -167.42003 576.07101
5815.0000 -171.61362 -165.64323 5.97039 2.21393 -166.30537 608.64531
5820.0000 -171.94023 -167.20653 4.73370 2.23907 -165.88241 656.32592
5825.0000 -172.40378 -166.16235 6.24143 2.21262 -166.32752 614.94617
5830.0000 -172.38943 -167.86799 4.52144 2.15034 -167.37512 571.81133
5835.0000 -171.69965 -166.81735 4.88230 2.15007 -167.37965 566.40989
5840.0000 -171.60270 -166.81332 4.78938 2.19422 -166.63706 587.21013
5845.0000 -172.76638 -167.91534 4.85104 2.14473 -167.46950 549.46276
5850.0000 -171.84833 -166.42659 5.42174 2.14083 -167.53520 545.84907
5855.0000 -170.82588 -165.68358 5.14230 2.22562 -166.10882 586.53953
5860.0000 -170.56296 -165.66115 4.90182 2.24510 -165.78111 602.00405
5865.0000 -171.65453 -166.24719 5.40734 2.25818 -165.56091 639.74460
5870.0000 -173.12356 -167.99187 5.13169 2.17815 -166.90731 596.75754
5875.0000 -171.89186 -167.95012 3.94174 2.11068 -168.04238 563.09908
5880.0000 -173.49978 -168.84604 4.65374 2.07875 -168.57959 534.77003
5885.0000 -173.47330 -168.65031 4.82299 2.06806 -168.75928 526.64532
5890.0000 -172.84945 -167.85598 4.99347 2.10684 -168.10699 541.32663
5895.0000 -172.05067 -167.40199 4.64868 2.16893 -167.06241 569.01133
5900.0000 -171.80243 -166.21264 5.58978 2.18314 -166.82339 581.54248
5905.0000 -173.08606 -167.76556 5.32050 2.17770 -166.91482 595.82081
5910.0000 -172.08992 -166.51878 5.57114 2.15105 -167.36316 563.07797
5915.0000 -170.64809 -165.53073 5.11735 2.26095 -165.51444 635.87257
5920.0000 -170.34736 -164.18555 6.16180 2.28179 -165.16378 634.00860
5925.0000 -171.00778 -165.75156 5.25623 2.28898 -165.04290 646.86967
5930.0000 -172.62591 -166.76706 5.85885 2.23940 -165.87699 610.59777
5935.0000 -171.62930 -165.86338 5.76592 2.21846 -166.22915 626.85837
5940.0000 -170.48078 -165.41194 5.06884 2.23999 -165.86700 635.32951
5945.0000 -172.07644 -166.56880 5.50764 2.24482 -165.78580 624.23807
5950.0000 -172.33383 -166.68370 5.65013 2.20722 -166.41829 589.62994
5955.0000 -171.99249 -166.74278 5.24971 2.15927 -167.22498 556.48115
5960.0000 -172.04614 -167.27426 4.77188 2.15307 -167.32926 581.19697
5965.0000 -172.13698 -166.61995 5.51703 2.17179 -167.01429 588.22210
5970.0000 -171.43865 -166.91069 4.52796 2.19980 -166.54309 603.47199
5975.0000 -172.36995 -166.83207 5.53787 2.16000 -167.21263 560.93164
5980.0000 -172.26379 -167.19513 5.06866 2.18020 -166.87281 601.21565
5985.0000 -171.39311 -165.77274 5.62037 2.17392 -166.97856 578.37837
5990.0000 -172.21455 -167.40176 4.81280 2.20213 -166.50386 611.50873
5995.0000 -172.95693 -167.48224 5.47469 2.15473 -167.30128 591.48256
6000.0000 -172.61753 -167.33849 5.27904 2.16130 -167.19087 587.53876
FREEZING PROCESS: loop number 25 T-loop= 559.00000000000000
main_MD> interactions number 25 at Temperature= 559.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.42811 -0.31380 2.15696
force_rgl> df(natom) 0.91255 -1.01806 -1.54944
6005.0000 -171.24986 -166.85089 4.39897 2.14985 -167.38333 570.98775
6010.0000 -171.09028 -165.36646 5.72382 2.20349 -166.48103 600.07065
6015.0000 -171.42599 -166.72431 4.70169 2.22552 -166.11043 624.42153
6020.0000 -171.62828 -166.14057 5.48771 2.21380 -166.30757 619.36733
6025.0000 -172.23538 -166.92390 5.31149 2.20552 -166.44682 616.83169
6030.0000 -172.77077 -167.74106 5.02971 2.15156 -167.35457 571.04168
6035.0000 -173.24347 -168.08702 5.15645 2.08444 -168.48380 547.70730
6040.0000 -172.01895 -167.07239 4.94657 2.11287 -168.00552 560.18639
6045.0000 -172.37788 -166.99054 5.38734 2.14803 -167.41405 556.12221
6050.0000 -171.57107 -166.68150 4.88957 2.18665 -166.76431 572.21191
6055.0000 -171.94461 -166.24182 5.70279 2.18879 -166.72833 559.27056
6060.0000 -171.27535 -166.50172 4.77363 2.18343 -166.81845 584.40596
6065.0000 -172.47377 -167.07079 5.40298 2.17308 -166.99270 566.25247
6070.0000 -172.13188 -167.34448 4.78739 2.15666 -167.26879 554.64068
6075.0000 -172.49373 -166.92307 5.57067 2.14769 -167.41975 565.43297
6080.0000 -171.85368 -166.88893 4.96475 2.15631 -167.27477 557.51981
6085.0000 -172.42848 -167.73669 4.69179 2.16648 -167.10363 565.68763
6090.0000 -172.32396 -167.63585 4.68811 2.11999 -167.88577 541.68779
6095.0000 -172.55714 -167.79325 4.76390 2.12709 -167.76633 536.69816
6100.0000 -173.29427 -168.93542 4.35885 2.10703 -168.10375 534.98035
6105.0000 -172.23955 -167.51358 4.72597 2.09592 -168.29070 525.28371
6110.0000 -171.71214 -166.75288 4.95926 2.14009 -167.54767 557.30639
6115.0000 -172.05721 -167.33375 4.72345 2.17504 -166.95960 585.22124
6120.0000 -172.97382 -168.67798 4.29584 2.10186 -168.19067 520.23834
6125.0000 -174.38996 -168.96610 5.42386 2.09151 -168.36493 527.34909
6130.0000 -173.92089 -168.64450 5.27640 2.05337 -169.00651 516.66857
6135.0000 -173.32745 -167.64259 5.68487 2.10950 -168.06224 546.13634
6140.0000 -173.68012 -168.66342 5.01670 2.11099 -168.03712 560.56510
6145.0000 -174.06464 -169.03581 5.02883 2.07532 -168.63729 541.18173
6150.0000 -173.29079 -168.39891 4.89188 2.08053 -168.54958 543.54256
6155.0000 -172.24515 -168.22194 4.02321 2.10196 -168.18910 548.37884
6160.0000 -172.76079 -167.10697 5.65382 2.13482 -167.63629 553.04916
6165.0000 -172.80906 -167.93013 4.87892 2.14124 -167.52827 548.21869
6170.0000 -172.27089 -166.76081 5.51008 2.17544 -166.95293 572.49760
6175.0000 -172.64412 -168.08317 4.56095 2.16578 -167.11535 556.21020
6180.0000 -173.06341 -168.57384 4.48958 2.08162 -168.53127 507.92098
6185.0000 -172.78635 -168.29008 4.49627 2.13439 -167.64348 544.97069
6190.0000 -173.27841 -167.69944 5.57897 2.10274 -168.17597 514.15036
6195.0000 -172.57282 -167.56392 5.00890 2.13409 -167.64854 550.41237
6200.0000 -170.62119 -165.44355 5.17764 2.19689 -166.59204 609.44916
6205.0000 -172.21528 -167.52252 4.69276 2.17585 -166.94610 604.57466
6210.0000 -172.40096 -167.05075 5.35021 2.16440 -167.13870 605.74620
6215.0000 -172.13617 -166.29580 5.84037 2.16872 -167.06597 571.55773
6220.0000 -171.20999 -165.69441 5.51558 2.21185 -166.34036 600.56903
6225.0000 -171.98106 -167.11743 4.86363 2.18037 -166.86998 563.57632
6230.0000 -172.09294 -167.29984 4.79310 2.16468 -167.13399 575.20185
6235.0000 -173.24531 -168.37287 4.87244 2.12427 -167.81381 549.57011
6240.0000 -173.12467 -167.82108 5.30359 2.11892 -167.90379 531.41876
6245.0000 -172.85093 -168.50951 4.34142 2.12921 -167.73065 554.25454
6250.0000 -172.97491 -168.08138 4.89353 2.07919 -168.57210 504.56162
FREEZING PROCESS: loop number 26 T-loop= 534.00000000000000
main_MD> interactions number 26 at Temperature= 534.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.66783 0.52625 -0.01849
force_rgl> df(natom) -1.63751 0.77023 -3.43577
6255.0000 -172.90336 -168.18491 4.71845 2.10993 -168.05500 524.89638
6260.0000 -173.06459 -168.50172 4.56288 2.14018 -167.54601 539.73755
6265.0000 -173.53785 -168.30740 5.23045 2.08784 -168.42663 519.95347
6270.0000 -172.54078 -167.71441 4.82637 2.09654 -168.28031 565.19986
6275.0000 -173.52490 -168.39372 5.13118 2.12229 -167.84707 584.56922
6280.0000 -172.66257 -168.45433 4.20823 2.08075 -168.54585 541.95402
6285.0000 -173.43099 -168.46837 4.96262 2.07124 -168.70587 533.57835
6290.0000 -173.11553 -168.73114 4.38439 2.08826 -168.41952 541.44496
6295.0000 -173.29433 -168.86424 4.43009 2.06274 -168.84885 502.41465
6300.0000 -172.82614 -168.81260 4.01353 2.09104 -168.37276 527.92493
6305.0000 -172.50876 -168.13135 4.37741 2.08249 -168.51657 509.21032
6310.0000 -172.94826 -169.15642 3.79184 2.08653 -168.44868 483.74783
6315.0000 -173.22363 -168.66214 4.56149 2.06112 -168.87616 478.01356
6320.0000 -171.93095 -168.17411 3.75684 2.08934 -168.40138 514.07165
6325.0000 -171.97699 -167.71495 4.26204 2.13571 -167.62123 558.97140
6330.0000 -172.24338 -167.88786 4.35552 2.11061 -168.04352 540.01312
6335.0000 -172.10837 -166.60167 5.50670 2.13665 -167.60542 570.63738
6340.0000 -172.73827 -168.44697 4.29130 2.14960 -167.38754 562.25811
6345.0000 -172.58941 -168.17490 4.41450 2.11580 -167.95625 526.13311
6350.0000 -173.22816 -167.73911 5.48905 2.11577 -167.95672 519.11498
6355.0000 -173.18072 -168.55188 4.62883 2.11551 -167.96107 527.52582
6360.0000 -172.22027 -168.20468 4.01558 2.07364 -168.66555 490.18336
6365.0000 -172.09542 -166.92676 5.16865 2.11093 -168.03822 528.21790
6370.0000 -172.87144 -167.38387 5.48757 2.16058 -167.20283 601.22460
6375.0000 -173.34059 -167.69663 5.64396 2.11760 -167.92598 594.26316
6380.0000 -172.73264 -167.70743 5.02521 2.14689 -167.43323 613.87286
6385.0000 -174.19793 -170.29407 3.90385 2.04860 -169.08673 493.45680
6390.0000 -173.28129 -168.54738 4.73391 2.04226 -169.19338 482.22376
6395.0000 -172.37696 -167.50477 4.87219 2.09685 -168.27509 527.45758
6400.0000 -171.52489 -166.91433 4.61055 2.17212 -167.00876 573.37384
6405.0000 -172.10410 -166.33177 5.77233 2.17856 -166.90036 574.71518
6410.0000 -173.12672 -167.71564 5.41108 2.19696 -166.59084 614.59653
6415.0000 -172.47167 -168.27986 4.19181 2.12528 -167.79672 548.93825
6420.0000 -173.25527 -168.85871 4.39656 2.06377 -168.83153 515.94135
6425.0000 -172.91431 -168.20642 4.70788 2.05916 -168.90903 517.96280
6430.0000 -173.06733 -168.28144 4.78589 2.08503 -168.47388 553.19149
6435.0000 -173.64890 -169.45621 4.19269 2.04703 -169.11321 507.67887
6440.0000 -172.71391 -168.11776 4.59616 2.07127 -168.70542 505.37424
6445.0000 -172.96568 -168.14796 4.81772 2.09754 -168.26344 501.96053
6450.0000 -173.08851 -168.32012 4.76839 2.06382 -168.83073 501.92211
6455.0000 -173.10168 -168.72628 4.37540 2.07998 -168.55879 503.12092
6460.0000 -173.01369 -167.99051 5.02318 2.11208 -168.01884 525.92941
6465.0000 -173.93127 -168.54811 5.38317 2.11863 -167.90870 546.14223
6470.0000 -172.45931 -167.38877 5.07054 2.10080 -168.20857 540.80305
6475.0000 -172.98856 -168.24349 4.74507 2.11829 -167.91429 561.96691
6480.0000 -173.20740 -167.84221 5.36519 2.11149 -168.02866 542.28377
6485.0000 -173.42014 -167.87236 5.54778 2.13990 -167.55073 560.35105
6490.0000 -172.78016 -167.92876 4.85140 2.13915 -167.56343 566.55831
6495.0000 -172.64306 -167.56263 5.08043 2.12904 -167.73356 549.13558
6500.0000 -172.95509 -167.31020 5.64489 2.15343 -167.32310 570.44127
FREEZING PROCESS: loop number 27 T-loop= 509.00000000000000
main_MD> interactions number 27 at Temperature= 509.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.00821 -1.20679 -1.59455
force_rgl> df(natom) 1.80153 -0.07669 -0.12441
6505.0000 -173.14127 -168.43326 4.70800 2.11167 -168.02563 528.84276
6510.0000 -172.72958 -167.69995 5.02963 2.09788 -168.25762 511.98645
6515.0000 -172.71903 -167.16596 5.55307 2.18355 -166.81655 561.87961
6520.0000 -172.42766 -167.70878 4.71888 2.13811 -167.58092 533.82464
6525.0000 -172.89989 -168.10556 4.79433 2.09164 -168.36269 513.13478
6530.0000 -173.60186 -168.52612 5.07574 2.11824 -167.91520 558.07471
6535.0000 -173.57799 -168.52778 5.05021 2.10990 -168.05553 526.22757
6540.0000 -173.86015 -169.15433 4.70582 2.05331 -169.00743 516.93336
6545.0000 -172.53723 -167.94493 4.59230 2.07367 -168.66494 515.15317
6550.0000 -172.93666 -168.11141 4.82525 2.09493 -168.30730 536.96038
6555.0000 -174.03100 -169.06626 4.96475 2.06944 -168.73616 540.76472
6560.0000 -173.64321 -168.40925 5.23396 2.08554 -168.46528 544.07859
6565.0000 -174.09580 -168.89777 5.19803 2.08994 -168.39119 563.91511
6570.0000 -173.10371 -169.23838 3.86533 2.04537 -169.14114 494.57540
6575.0000 -173.51107 -168.91364 4.59743 2.07454 -168.65027 521.32689
6580.0000 -172.66556 -168.35537 4.31019 2.07288 -168.67818 504.81558
6585.0000 -173.96523 -168.42645 5.53878 2.09405 -168.32216 508.35042
6590.0000 -173.12455 -168.31922 4.80533 2.08459 -168.48121 521.92498
6595.0000 -173.12867 -168.58014 4.54853 2.08752 -168.43197 514.32951
6600.0000 -172.85899 -168.16251 4.69648 2.06114 -168.87574 493.42244
6605.0000 -173.81570 -169.02428 4.79142 2.06087 -168.88032 489.68251
6610.0000 -172.43936 -167.91443 4.52493 2.07218 -168.69003 485.97611
6615.0000 -172.30463 -167.50857 4.79606 2.11044 -168.04637 518.49147
6620.0000 -173.82176 -169.21689 4.60487 2.12213 -167.84980 534.76144
6625.0000 -173.98990 -169.56791 4.42200 2.02041 -169.56104 467.95058
6630.0000 -173.64080 -169.10369 4.53711 2.04998 -169.06359 493.30430
6635.0000 -173.18739 -169.06892 4.11847 2.03894 -169.24916 481.36419
6640.0000 -172.86372 -168.48049 4.38322 2.07714 -168.60659 501.56553
6645.0000 -172.57898 -168.06366 4.51532 2.10865 -168.07658 536.78004
6650.0000 -174.05365 -169.24144 4.81221 2.08925 -168.40291 512.78967
6655.0000 -173.58754 -169.61686 3.97068 2.03276 -169.35316 461.12074
6660.0000 -173.31584 -169.27083 4.04500 2.03315 -169.34665 474.42154
6665.0000 -172.51589 -168.29510 4.22079 2.09870 -168.24390 535.90904
6670.0000 -172.24709 -167.71171 4.53538 2.09483 -168.30894 516.02788
6675.0000 -172.77252 -167.26825 5.50428 2.16105 -167.19491 566.04809
6680.0000 -172.95545 -167.61956 5.33589 2.14415 -167.47931 576.37816
6685.0000 -172.78681 -167.82959 4.95722 2.12197 -167.85250 542.86138
6690.0000 -172.73181 -168.15518 4.57663 2.14333 -167.49311 556.87781
6695.0000 -172.43663 -168.20721 4.22942 2.13807 -167.58161 579.73901
6700.0000 -173.69437 -169.51078 4.18359 2.06363 -168.83387 517.94396
6705.0000 -174.00777 -169.78592 4.22184 2.02748 -169.44197 479.76081
6710.0000 -174.52437 -169.47746 5.04691 2.01119 -169.71606 484.18131
6715.0000 -174.03827 -169.38426 4.65401 2.03624 -169.29470 520.16873
6720.0000 -174.20431 -169.63879 4.56552 2.03693 -169.28298 518.47421
6725.0000 -173.93055 -169.23202 4.69853 2.03495 -169.31639 516.54452
6730.0000 -173.90372 -168.98132 4.92240 2.03702 -169.28161 501.66952
6735.0000 -173.46294 -168.86555 4.59739 2.03990 -169.23303 506.98160
6740.0000 -173.84508 -169.40512 4.43996 2.02605 -169.46616 493.81281
6745.0000 -174.57790 -170.33384 4.24405 1.97976 -170.24483 467.88029
6750.0000 -174.34644 -170.14000 4.20644 1.97154 -170.38303 472.15140
FREEZING PROCESS: loop number 28 T-loop= 484.00000000000000
main_MD> interactions number 28 at Temperature= 484.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.32930 -3.36419 -2.36227
force_rgl> df(natom) -1.93106 0.77944 0.50742
6755.0000 -173.95014 -169.26483 4.68531 2.01363 -169.67505 499.94405
6760.0000 -173.77159 -169.24371 4.52788 2.04006 -169.23040 514.90723
6765.0000 -173.25332 -168.03284 5.22048 2.04422 -169.16038 517.54360
6770.0000 -172.60740 -169.12093 3.48647 2.03651 -169.29005 491.59139
6775.0000 -173.44853 -168.49396 4.95456 2.07207 -168.69187 523.28090
6780.0000 -172.60697 -168.29135 4.31562 2.07725 -168.60469 536.09731
6785.0000 -173.15150 -168.73192 4.41958 2.10403 -168.15423 557.74185
6790.0000 -174.20596 -170.47403 3.73193 2.01964 -169.57389 500.39968
6795.0000 -174.05108 -169.11761 4.93347 1.99131 -170.05049 475.88484
6800.0000 -174.16553 -169.97029 4.19524 2.01174 -169.70689 494.62977
6805.0000 -175.06503 -170.14207 4.92295 1.98721 -170.11949 484.76944
6810.0000 -173.78159 -169.01980 4.76180 2.01186 -169.70472 501.34129
6815.0000 -173.50055 -168.85214 4.64841 2.07068 -168.71533 539.42503
6820.0000 -174.19239 -169.83637 4.35603 2.02481 -169.48701 498.83109
6825.0000 -174.62219 -170.42614 4.19604 1.98089 -170.22581 458.46738
6830.0000 -174.27319 -169.47075 4.80244 1.98564 -170.14586 472.33475
6835.0000 -173.57519 -170.09835 3.47684 2.00840 -169.76304 484.07648
6840.0000 -174.04216 -169.97496 4.06720 2.00063 -169.89374 459.65483
6845.0000 -173.20441 -169.10437 4.10004 2.00946 -169.74510 462.28919
6850.0000 -174.69404 -170.12489 4.56914 2.02179 -169.53771 492.08013
6855.0000 -173.46044 -169.08469 4.37575 2.01174 -169.70673 469.93821
6860.0000 -173.64397 -169.10440 4.53957 2.04700 -169.11358 502.34753
6865.0000 -173.86823 -169.48876 4.37947 2.04105 -169.21380 491.93525
6870.0000 -174.34175 -170.49636 3.84539 2.00463 -169.82648 462.39138
6875.0000 -174.60282 -170.33236 4.27046 1.98356 -170.18095 460.14130
6880.0000 -173.73079 -169.52975 4.20104 1.98347 -170.18247 463.24394
6885.0000 -174.57671 -170.11960 4.45711 1.97526 -170.32050 447.17410
6890.0000 -173.91139 -168.98334 4.92805 2.03329 -169.34430 482.07376
6895.0000 -172.77926 -168.58339 4.19588 2.05827 -168.92406 474.43036
6900.0000 -173.45357 -168.55242 4.90115 2.06606 -168.79305 489.17984
6905.0000 -173.41415 -168.71894 4.69521 2.07955 -168.56598 510.46034
6910.0000 -173.51185 -169.19128 4.32056 2.03821 -169.26159 484.99281
6915.0000 -173.54226 -168.79596 4.74631 2.08205 -168.52406 520.66965
6920.0000 -173.14150 -169.32279 3.81870 2.02749 -169.44192 486.49611
6925.0000 -173.23824 -169.14028 4.09796 2.02311 -169.51557 466.39180
6930.0000 -174.29554 -170.29493 4.00061 2.00925 -169.74863 438.50658
6935.0000 -173.31716 -169.37102 3.94614 2.00580 -169.80672 451.09221
6940.0000 -173.32056 -169.26615 4.05442 2.04511 -169.14545 481.71810
6945.0000 -173.94845 -170.13379 3.81466 2.01522 -169.64826 446.64022
6950.0000 -174.04558 -170.20652 3.83906 1.98656 -170.13037 429.31651
6955.0000 -172.33554 -168.14212 4.19341 2.03842 -169.25791 471.24428
6960.0000 -174.78389 -169.77250 5.01138 2.04671 -169.11852 475.79644
6965.0000 -174.36090 -170.44561 3.91528 1.96556 -170.48372 446.59068
6970.0000 -174.16425 -170.10173 4.06252 1.98119 -170.22080 469.15913
6975.0000 -173.97319 -169.17210 4.80109 2.01544 -169.64462 517.19815
6980.0000 -174.60621 -170.00241 4.60379 2.00622 -169.79964 512.35860
6985.0000 -174.08211 -169.75398 4.32813 1.99455 -169.99603 502.75807
6990.0000 -174.62985 -170.16884 4.46101 2.00866 -169.75868 527.18632
6995.0000 -174.61049 -169.53107 5.07941 1.96859 -170.43266 482.54080
7000.0000 -174.61082 -170.53985 4.07097 1.99647 -169.96365 500.92408
FREEZING PROCESS: loop number 29 T-loop= 459.00000000000000
main_MD> interactions number 29 at Temperature= 459.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.96086 -0.00235 0.79466
force_rgl> df(natom) -2.04462 -1.38178 0.06580
7005.0000 -174.86800 -169.39879 5.46921 1.98879 -170.09290 518.83796
7010.0000 -174.48885 -170.46157 4.02728 1.96473 -170.49773 497.77246
7015.0000 -175.56907 -171.28152 4.28755 1.95659 -170.63456 495.21497
7020.0000 -175.53769 -171.52309 4.01460 1.90692 -171.47024 452.22369
7025.0000 -174.86946 -171.44638 3.42308 1.91544 -171.32686 463.64488
7030.0000 -175.19046 -171.45937 3.73108 1.90102 -171.56936 449.41485
7035.0000 -175.02114 -170.79374 4.22740 1.93342 -171.02431 479.96458
7040.0000 -175.76204 -171.80625 3.95579 1.91117 -171.39875 444.25088
7045.0000 -176.42851 -171.73766 4.69084 1.87345 -172.03319 431.45315
7050.0000 -176.05858 -171.96640 4.09218 1.88012 -171.92099 429.64701
7055.0000 -175.62635 -171.51424 4.11212 1.87707 -171.97226 430.99580
7060.0000 -174.75832 -170.87032 3.88800 1.92371 -171.18768 463.31271
7065.0000 -175.28495 -171.14639 4.13855 1.94638 -170.80637 489.59088
7070.0000 -175.27495 -171.16455 4.11040 1.94534 -170.82391 488.23688
7075.0000 -175.65800 -170.61529 5.04271 1.95111 -170.72674 491.22497
7080.0000 -175.41549 -170.86820 4.54728 1.94785 -170.78156 489.87861
7085.0000 -174.66029 -170.38151 4.27878 1.93581 -170.98422 464.79890
7090.0000 -175.45886 -171.38861 4.07025 1.94117 -170.89406 485.92449
7095.0000 -175.45289 -170.73689 4.71599 1.93087 -171.06722 477.70528
7100.0000 -175.54251 -171.04831 4.49420 1.92107 -171.23214 466.57294
7105.0000 -175.24209 -171.20147 4.04062 1.95593 -170.64568 487.36556
7110.0000 -175.31675 -171.66504 3.65170 1.92179 -171.21995 463.95527
7115.0000 -175.77629 -171.87536 3.90093 1.88836 -171.78248 441.19568
7120.0000 -174.53458 -170.64437 3.89021 1.92397 -171.18338 470.19485
7125.0000 -176.09060 -172.07242 4.01818 1.89390 -171.68925 442.34012
7130.0000 -175.94313 -172.38189 3.56125 1.87117 -172.07161 423.25627
7135.0000 -176.13198 -172.57044 3.56154 1.83942 -172.60566 402.82307
7140.0000 -175.60953 -170.94697 4.66256 1.89723 -171.63321 446.25918
7145.0000 -175.38460 -171.62134 3.76326 1.90687 -171.47096 454.95515
7150.0000 -175.66870 -171.96671 3.70199 1.87742 -171.96649 427.89436
7155.0000 -175.13123 -171.27436 3.85687 1.90686 -171.47119 454.94705
7160.0000 -175.89382 -172.20839 3.68543 1.88346 -171.86488 432.87760
7165.0000 -175.36271 -171.08303 4.27968 1.90975 -171.42257 454.57004
7170.0000 -175.65253 -171.58955 4.06298 1.89845 -171.61265 446.83078
7175.0000 -176.29664 -172.16347 4.13317 1.89032 -171.74943 439.93365
7180.0000 -175.75828 -171.94808 3.81020 1.86753 -172.13291 419.96148
7185.0000 -175.35070 -171.67115 3.67955 1.90183 -171.55578 448.26968
7190.0000 -175.04753 -171.58441 3.46312 1.91603 -171.31694 463.26302
7195.0000 -175.23038 -171.36527 3.86511 1.90380 -171.52269 451.39033
7200.0000 -175.56264 -171.44886 4.11378 1.92149 -171.22512 465.86854
7205.0000 -175.46893 -171.49022 3.97870 1.89221 -171.71765 437.13459
7210.0000 -174.83657 -171.09631 3.74026 1.90047 -171.57865 435.63695
7215.0000 -176.11373 -172.09048 4.02324 1.90831 -171.44673 451.90954
7220.0000 -176.25356 -171.72808 4.52548 1.90020 -171.58316 445.48195
7225.0000 -175.82053 -171.19303 4.62750 1.88805 -171.78766 437.65314
7230.0000 -176.06322 -171.78265 4.28056 1.90349 -171.52796 452.48423
7235.0000 -176.50610 -171.71684 4.78927 1.88984 -171.75750 439.62107
7240.0000 -175.89964 -171.69838 4.20126 1.90873 -171.43970 462.16075
7245.0000 -175.45038 -171.04764 4.40274 1.90243 -171.54570 450.73631
7250.0000 -175.24448 -171.46208 3.78240 1.94344 -170.85580 490.53195
FREEZING PROCESS: loop number 30 T-loop= 434.00000000000000
main_MD> interactions number 30 at Temperature= 434.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.42229 1.32170 0.44327
force_rgl> df(natom) 0.22278 -1.73232 1.20895
7255.0000 -175.85248 -171.17881 4.67367 1.92090 -171.23508 461.75375
7260.0000 -176.10328 -171.77486 4.32843 1.90537 -171.49626 452.30336
7265.0000 -176.24706 -171.97817 4.26888 1.87577 -171.99430 422.15136
7270.0000 -176.35042 -172.87527 3.47515 1.86283 -172.21190 416.11678
7275.0000 -175.28975 -171.44483 3.84492 1.86634 -172.15277 422.56096
7280.0000 -175.66568 -171.54794 4.11774 1.91636 -171.31136 467.60762
7285.0000 -175.71192 -172.01820 3.69372 1.91028 -171.41366 460.23691
7290.0000 -175.63680 -171.86001 3.77679 1.89726 -171.63271 447.82435
7295.0000 -176.10941 -171.73665 4.37276 1.89572 -171.65862 443.04272
7300.0000 -175.64458 -172.16530 3.47928 1.87044 -172.08389 427.51164
7305.0000 -175.53324 -171.58245 3.95079 1.91316 -171.36514 454.10468
7310.0000 -175.20753 -171.18048 4.02705 1.89186 -171.72348 440.41162
7315.0000 -175.43707 -171.12932 4.30774 1.92943 -171.09149 473.10864
7320.0000 -175.78838 -171.58383 4.20455 1.91151 -171.39289 457.48276
7325.0000 -175.85681 -171.56484 4.29198 1.92187 -171.21875 472.57870
7330.0000 -175.62819 -171.55785 4.07034 1.90741 -171.46201 458.18757
7335.0000 -175.02696 -171.07446 3.95250 1.92692 -171.13373 469.38865
7340.0000 -175.30038 -170.72320 4.57719 1.91025 -171.41418 457.67335
7345.0000 -175.94812 -172.24127 3.70685 1.88221 -171.88593 427.73739
7350.0000 -176.42686 -173.06096 3.36590 1.85344 -172.36981 411.03400
7355.0000 -175.85275 -172.30119 3.55156 1.83829 -172.62467 395.99977
7360.0000 -175.75355 -172.30254 3.45100 1.84495 -172.51265 399.73609
7365.0000 -176.28794 -172.21684 4.07110 1.86280 -172.21242 418.59094
7370.0000 -176.05373 -171.83704 4.21669 1.88542 -171.83188 435.52690
7375.0000 -176.39304 -172.35276 4.04029 1.86874 -172.11250 423.94910
7380.0000 -175.98375 -171.66760 4.31615 1.87886 -171.94222 433.53589
7385.0000 -175.22701 -171.44382 3.78318 1.91718 -171.29762 460.66844
7390.0000 -174.93460 -171.27492 3.65969 1.93362 -171.02099 479.72066
7395.0000 -175.76033 -171.97018 3.79015 1.90438 -171.51288 449.85648
7400.0000 -175.51099 -171.11498 4.39601 1.89332 -171.69890 442.96729
7405.0000 -175.83867 -171.81592 4.02275 1.88549 -171.83072 434.38804
7410.0000 -175.58713 -172.03540 3.55173 1.88197 -171.88987 430.82735
7415.0000 -175.54686 -171.67590 3.87096 1.89937 -171.59712 449.67449
7420.0000 -176.19466 -171.97829 4.21637 1.88895 -171.77248 439.91691
7425.0000 -175.50978 -171.87852 3.63126 1.87009 -172.08979 433.00042
7430.0000 -175.41452 -170.62549 4.78903 1.93014 -171.07954 475.44400
7435.0000 -175.97116 -172.82686 3.14430 1.91268 -171.37323 459.57334
7440.0000 -176.17487 -172.40436 3.77051 1.86250 -172.21749 422.22987
7445.0000 -175.89574 -171.99751 3.89823 1.87213 -172.05551 425.02781
7450.0000 -175.67836 -171.77982 3.89854 1.88272 -171.87730 438.25839
7455.0000 -175.05345 -170.49696 4.55649 1.91558 -171.32452 458.32922
7460.0000 -175.44443 -171.01696 4.42747 1.92037 -171.24398 460.83671
7465.0000 -175.69223 -171.32699 4.36524 1.92996 -171.08263 468.30041
7470.0000 -175.60320 -171.29903 4.30417 1.89922 -171.59979 450.97914
7475.0000 -174.76340 -170.79968 3.96372 1.92897 -171.09927 472.17875
7480.0000 -175.55224 -171.00379 4.54845 1.92828 -171.11091 472.65492
7485.0000 -175.11127 -171.13237 3.97890 1.93968 -170.91900 473.78985
7490.0000 -175.56310 -171.62626 3.93684 1.93096 -171.06571 466.60693
7495.0000 -176.03912 -171.49739 4.54173 1.91945 -171.25932 460.09725
7500.0000 -176.17169 -172.45215 3.71954 1.88488 -171.84093 432.81858
FREEZING PROCESS: loop number 31 T-loop= 409.00000000000000
main_MD> interactions number 31 at Temperature= 409.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.79904 -0.46819 -0.94619
force_rgl> df(natom) -1.61383 0.22657 2.47319
7505.0000 -176.24340 -172.42005 3.82335 1.86027 -172.25496 411.63399
7510.0000 -175.83352 -172.17500 3.65852 1.86284 -172.21181 419.53979
7515.0000 -176.49290 -172.72009 3.77281 1.84433 -172.52313 399.91441
7520.0000 -176.52984 -173.28702 3.24281 1.80685 -173.15361 377.14570
7525.0000 -176.50535 -172.52526 3.98009 1.81244 -173.05964 377.06919
7530.0000 -175.98346 -172.74580 3.23766 1.84092 -172.58056 403.75121
7535.0000 -176.42943 -173.02196 3.40747 1.84491 -172.51343 401.64236
7540.0000 -176.65688 -172.63205 4.02482 1.84655 -172.48575 405.18086
7545.0000 -176.42856 -173.38880 3.03976 1.84294 -172.54652 398.25360
7550.0000 -176.48938 -173.45539 3.03400 1.77598 -173.67296 342.27015
7555.0000 -176.49829 -172.23414 4.26416 1.84542 -172.50476 404.77523
7560.0000 -175.70401 -172.12753 3.57648 1.89374 -171.69194 443.75329
7565.0000 -175.92734 -172.51719 3.41015 1.85527 -172.33915 410.95698
7570.0000 -176.03750 -172.76904 3.26846 1.85918 -172.27329 414.86058
7575.0000 -176.02944 -172.21714 3.81229 1.83907 -172.61169 390.58335
7580.0000 -176.01268 -172.11753 3.89515 1.86157 -172.23314 414.37259
7585.0000 -176.18689 -172.13454 4.05234 1.87087 -172.07657 428.12167
7590.0000 -175.73863 -172.31972 3.41892 1.86680 -172.14517 421.44581
7595.0000 -176.20930 -172.20699 4.00231 1.84321 -172.54204 397.38097
7600.0000 -176.77591 -173.46536 3.31055 1.82970 -172.76924 389.11221
7605.0000 -176.52967 -173.01987 3.50980 1.80073 -173.25652 365.38732
7610.0000 -175.78045 -171.77360 4.00685 1.83216 -172.72784 390.67102
7615.0000 -175.71266 -171.92858 3.78408 1.88422 -171.85205 434.91621
7620.0000 -176.77138 -172.58533 4.18605 1.84463 -172.51811 401.63411
7625.0000 -175.90827 -172.12860 3.77967 1.85098 -172.41122 412.80417
7630.0000 -176.03883 -172.44841 3.59042 1.84548 -172.50377 406.16494
7635.0000 -177.07332 -173.97283 3.10050 1.81841 -172.95921 382.19292
7640.0000 -176.57114 -172.66787 3.90327 1.79872 -173.29037 362.60013
7645.0000 -176.24400 -172.24557 3.99843 1.83453 -172.68805 391.82108
7650.0000 -175.30188 -171.57792 3.72396 1.87534 -172.00139 431.29381
7655.0000 -175.05248 -171.12784 3.92464 1.88008 -171.92169 433.66154
7660.0000 -176.17477 -172.45279 3.72198 1.86531 -172.17023 417.85253
7665.0000 -175.23107 -171.92644 3.30463 1.85014 -172.42535 407.13389
7670.0000 -175.75284 -172.01352 3.73931 1.88168 -171.89479 435.32838
7675.0000 -175.91413 -172.47549 3.43864 1.86246 -172.21807 416.71942
7680.0000 -175.65856 -172.10703 3.55152 1.87365 -172.02991 427.80218
7685.0000 -176.12064 -172.35026 3.77039 1.85714 -172.30771 415.05937
7690.0000 -175.91681 -172.58187 3.33494 1.81787 -172.96820 380.40435
7695.0000 -176.29167 -173.02792 3.26375 1.84553 -172.50301 402.70273
7700.0000 -175.46799 -172.15291 3.31508 1.84496 -172.51260 396.71315
7705.0000 -175.94813 -172.04748 3.90065 1.87586 -171.99278 424.48535
7710.0000 -175.85439 -172.01769 3.83670 1.86146 -172.23502 418.66663
7715.0000 -176.13775 -172.57688 3.56086 1.85459 -172.35045 413.86490
7720.0000 -176.21355 -172.44938 3.76417 1.82604 -172.83085 388.01372
7725.0000 -175.90741 -172.06414 3.84326 1.86549 -172.16720 418.38960
7730.0000 -176.10734 -172.59456 3.51278 1.85954 -172.26732 416.42926
7735.0000 -174.98389 -171.38618 3.59771 1.86329 -172.20412 415.72430
7740.0000 -175.64508 -171.45894 4.18614 1.90747 -171.46087 450.29687
7745.0000 -175.33082 -171.40444 3.92637 1.89721 -171.63349 444.41877
7750.0000 -176.20383 -172.19689 4.00694 1.89995 -171.58750 446.13634
FREEZING PROCESS: loop number 32 T-loop= 384.00000000000000
main_MD> interactions number 32 at Temperature= 384.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.62922 -1.04457 -3.39228
force_rgl> df(natom) -0.00500 2.10558 0.88463
7755.0000 -176.27486 -173.08721 3.18764 1.83011 -172.76234 389.28663
7760.0000 -175.96011 -172.38017 3.57993 1.82121 -172.91205 383.40272
7765.0000 -176.88421 -173.73498 3.14923 1.82752 -172.80586 383.98178
7770.0000 -176.72649 -173.14396 3.58253 1.80991 -173.10221 371.35663
7775.0000 -175.73365 -172.50851 3.22514 1.82897 -172.78150 389.75215
7780.0000 -176.48360 -173.01181 3.47179 1.83674 -172.65083 394.97172
7785.0000 -176.38591 -173.17941 3.20650 1.82739 -172.80804 389.93705
7790.0000 -175.68331 -172.22659 3.45672 1.82922 -172.77726 387.05814
7795.0000 -175.52843 -172.10260 3.42583 1.85121 -172.40742 404.07969
7800.0000 -176.02030 -172.66087 3.35942 1.85464 -172.34975 409.80164
7805.0000 -175.72973 -171.38868 4.34106 1.87561 -171.99688 416.46668
7810.0000 -177.13263 -173.98084 3.15179 1.81085 -173.08627 367.75917
7815.0000 -176.79973 -173.37213 3.42760 1.78525 -173.51698 351.69294
7820.0000 -176.58658 -173.11464 3.47194 1.80528 -173.18008 374.02599
7825.0000 -175.86201 -172.44241 3.41961 1.83975 -172.60020 400.98121
7830.0000 -176.83094 -173.68262 3.14832 1.81442 -173.02634 376.59062
7835.0000 -175.96764 -172.76162 3.20601 1.78394 -173.53904 352.02362
7840.0000 -176.51583 -172.97611 3.53972 1.82812 -172.79590 388.37063
7845.0000 -176.61663 -173.88115 2.73548 1.79039 -173.43063 358.51899
7850.0000 -176.84776 -173.10588 3.74188 1.79986 -173.27127 367.38448
7855.0000 -176.42049 -172.92190 3.49859 1.82436 -172.85907 393.42386
7860.0000 -176.94496 -173.44931 3.49565 1.79004 -173.43652 354.43128
7865.0000 -176.14788 -172.74055 3.40733 1.81073 -173.08837 371.89839
7870.0000 -176.35211 -172.40612 3.94599 1.85637 -172.32065 412.81979
7875.0000 -176.52165 -172.76316 3.75850 1.85774 -172.29748 417.55282
7880.0000 -176.73791 -173.39831 3.33959 1.81531 -173.01127 375.47421
7885.0000 -176.48065 -173.10566 3.37499 1.80462 -173.19112 369.57429
7890.0000 -175.92300 -172.70550 3.21750 1.83943 -172.60548 395.42485
7895.0000 -176.53270 -172.83968 3.69302 1.84235 -172.55648 400.46971
7900.0000 -175.97274 -172.15901 3.81373 1.84926 -172.44022 405.93787
7905.0000 -176.37654 -172.59079 3.78575 1.85172 -172.39877 404.10789
7910.0000 -175.83111 -172.31337 3.51773 1.83352 -172.70502 392.73421
7915.0000 -177.13543 -174.12897 3.00646 1.82593 -172.83258 386.87733
7920.0000 -176.42097 -173.05884 3.36214 1.78177 -173.57563 349.42160
7925.0000 -176.69036 -173.82601 2.86435 1.79520 -173.34959 363.81493
7930.0000 -176.77202 -173.37938 3.39264 1.80967 -173.10618 376.43206
7935.0000 -175.83275 -172.39916 3.43359 1.80486 -173.18715 369.84710
7940.0000 -175.86738 -172.63476 3.23261 1.85452 -172.35169 407.66159
7945.0000 -176.30995 -172.68301 3.62694 1.82620 -172.82815 387.14718
7950.0000 -177.01939 -173.62408 3.39530 1.80901 -173.11725 373.28061
7955.0000 -176.06270 -173.03172 3.03098 1.81441 -173.02644 376.90975
7960.0000 -177.27422 -173.17875 4.09547 1.79444 -173.36249 361.16873
7965.0000 -176.31777 -172.88728 3.43049 1.82492 -172.84974 388.87521
7970.0000 -176.20352 -173.22998 2.97354 1.81358 -173.04040 375.32799
7975.0000 -176.61438 -173.55742 3.05696 1.80532 -173.17946 373.42474
7980.0000 -176.04810 -173.15201 2.89609 1.76977 -173.77744 339.55006
7985.0000 -176.39751 -172.58858 3.80892 1.84671 -172.48306 408.51589
7990.0000 -175.87668 -172.23741 3.63927 1.85452 -172.35170 413.84726
7995.0000 -176.43665 -173.31611 3.12053 1.81339 -173.04368 378.58352
8000.0000 -176.04920 -172.38747 3.66173 1.83485 -172.68268 394.41197
FREEZING PROCESS: loop number 33 T-loop= 359.00000000000000
main_MD> interactions number 33 at Temperature= 359.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.62456 -0.46623 -0.50398
force_rgl> df(natom) -1.43195 -2.04939 -1.18819
8005.0000 -175.91087 -172.51336 3.39751 1.82784 -172.80046 389.15040
8010.0000 -176.85248 -173.63163 3.22085 1.79715 -173.31675 361.23257
8015.0000 -177.08158 -174.39188 2.68970 1.76249 -173.89992 332.07810
8020.0000 -176.71520 -174.32979 2.38541 1.75568 -174.01442 327.68601
8025.0000 -176.94309 -174.17013 2.77297 1.73591 -174.34707 309.81293
8030.0000 -176.39254 -172.51614 3.87641 1.78944 -173.44649 354.94010
8035.0000 -176.82782 -173.42803 3.39980 1.83646 -172.65556 396.71116
8040.0000 -176.77327 -173.51615 3.25712 1.76825 -173.80295 340.40549
8045.0000 -176.67690 -173.83763 2.83926 1.78135 -173.58258 348.80789
8050.0000 -176.56269 -172.72066 3.84202 1.79844 -173.29514 360.58277
8055.0000 -176.21581 -173.18320 3.03261 1.82988 -172.76619 392.22766
8060.0000 -176.94930 -174.05122 2.89807 1.77876 -173.62621 344.91177
8065.0000 -176.61706 -173.28986 3.32721 1.77486 -173.69182 346.46830
8070.0000 -176.39254 -172.86413 3.52840 1.80067 -173.25759 365.33438
8075.0000 -176.55274 -173.10717 3.44558 1.81450 -173.02491 379.01981
8080.0000 -176.80704 -173.54855 3.25850 1.79665 -173.32528 364.04707
8085.0000 -176.23206 -172.75232 3.47974 1.79452 -173.36099 363.88094
8090.0000 -176.67875 -172.93941 3.73934 1.83511 -172.67831 397.06097
8095.0000 -176.85962 -173.13750 3.72212 1.80639 -173.16137 371.70291
8100.0000 -176.62045 -173.54760 3.07286 1.77565 -173.67855 342.60400
8105.0000 -176.35132 -173.54180 2.80952 1.79086 -173.42264 352.36248
8110.0000 -177.31480 -174.18829 3.12651 1.77078 -173.76041 341.26221
8115.0000 -176.77084 -173.43951 3.33132 1.77115 -173.75415 337.51138
8120.0000 -176.95740 -173.84420 3.11320 1.77046 -173.76580 337.67648
8125.0000 -176.80085 -173.51140 3.28944 1.78178 -173.57539 348.96162
8130.0000 -176.79768 -173.11114 3.68654 1.78660 -173.49426 354.06925
8135.0000 -176.03906 -173.21413 2.82493 1.81258 -173.05734 377.93698
8140.0000 -176.33602 -173.24928 3.08674 1.81048 -173.09252 372.95689
8145.0000 -176.95105 -173.91114 3.03991 1.76501 -173.85753 335.19640
8150.0000 -176.87765 -173.81246 3.06520 1.76397 -173.87509 334.16751
8155.0000 -176.22009 -172.98880 3.23129 1.80393 -173.20269 367.13098
8160.0000 -176.34253 -173.31558 3.02695 1.79575 -173.34039 364.61887
8165.0000 -177.08729 -173.56742 3.51987 1.76426 -173.87015 333.82876
8170.0000 -176.24504 -172.88646 3.35858 1.82618 -172.82849 386.68198
8175.0000 -177.01432 -174.12425 2.89007 1.78966 -173.44288 357.73715
8180.0000 -177.36099 -174.09575 3.26524 1.74471 -174.19910 317.97707
8185.0000 -176.84747 -173.08183 3.76564 1.79627 -173.33171 365.66352
8190.0000 -176.42925 -172.86658 3.56266 1.84417 -172.52578 400.75368
8195.0000 -176.90714 -173.76219 3.14495 1.78943 -173.44677 351.50666
8200.0000 -177.07796 -173.98167 3.09629 1.75717 -173.98944 327.13676
8205.0000 -176.59114 -173.39201 3.19913 1.78342 -173.54784 352.18817
8210.0000 -176.41732 -173.50166 2.91566 1.79173 -173.40797 354.89459
8215.0000 -176.82761 -173.23791 3.58970 1.79231 -173.39817 362.54086
8220.0000 -176.29865 -173.03752 3.26113 1.81326 -173.04583 378.73658
8225.0000 -176.84882 -173.74176 3.10706 1.79441 -173.36292 364.09253
8230.0000 -176.86214 -173.46647 3.39567 1.77073 -173.76137 336.70736
8235.0000 -176.91688 -173.53627 3.38061 1.77798 -173.63926 349.23862
8240.0000 -176.64268 -173.27318 3.36949 1.79923 -173.28182 365.81539
8245.0000 -176.88365 -174.10061 2.78304 1.78741 -173.48076 356.04175
8250.0000 -176.47531 -172.99997 3.47534 1.78927 -173.44941 354.82637
FREEZING PROCESS: loop number 34 T-loop= 334.00000000000000
main_MD> interactions number 34 at Temperature= 334.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.89002 1.15626 -0.85147
force_rgl> df(natom) -4.43100 0.27891 0.27340
8255.0000 -176.39117 -173.28964 3.10153 1.80651 -173.15941 369.26484
8260.0000 -176.67027 -173.51977 3.15050 1.78411 -173.53628 351.72966
8265.0000 -176.49677 -173.39742 3.09935 1.77725 -173.65158 343.84241
8270.0000 -176.86080 -174.03525 2.82555 1.75368 -174.04807 322.78552
8275.0000 -176.93459 -173.99952 2.93507 1.76837 -173.80102 337.76367
8280.0000 -176.66995 -173.07544 3.59451 1.77633 -173.66702 345.16390
8285.0000 -176.39805 -173.35238 3.04567 1.80899 -173.11763 373.36308
8290.0000 -177.52837 -175.01193 2.51644 1.76707 -173.82283 341.04635
8295.0000 -177.12500 -174.92877 2.19623 1.70052 -174.94238 279.05158
8300.0000 -176.71642 -174.40992 2.30650 1.72616 -174.51101 299.76514
8305.0000 -176.69838 -173.84440 2.85399 1.72714 -174.49455 301.10240
8310.0000 -176.70054 -174.26574 2.43480 1.75964 -173.94791 330.26180
8315.0000 -176.59384 -173.58893 3.00491 1.76593 -173.84198 336.26830
8320.0000 -177.19331 -174.00675 3.18656 1.77314 -173.72080 339.89408
8325.0000 -176.69677 -173.88126 2.81551 1.75323 -174.05565 325.54775
8330.0000 -176.74827 -173.81099 2.93728 1.77068 -173.76213 338.30305
8335.0000 -176.95093 -173.85450 3.09643 1.75060 -174.09991 321.70685
8340.0000 -176.65776 -173.32751 3.33025 1.76531 -173.85244 331.82665
8345.0000 -176.66351 -173.63867 3.02484 1.78857 -173.46121 353.24416
8350.0000 -176.56091 -173.83479 2.72612 1.76107 -173.92377 330.72886
8355.0000 -177.14106 -173.94676 3.19429 1.76390 -173.87619 331.75988
8360.0000 -177.28574 -174.07254 3.21320 1.76133 -173.91943 331.31762
8365.0000 -176.85340 -173.88171 2.97169 1.75011 -174.10820 322.79832
8370.0000 -176.51723 -173.32036 3.19688 1.78217 -173.56888 351.37835
8375.0000 -176.35522 -173.40408 2.95114 1.79606 -173.33517 363.95128
8380.0000 -176.83217 -173.98203 2.85014 1.76835 -173.80127 335.55090
8385.0000 -176.44437 -173.64802 2.79635 1.76577 -173.84465 332.78625
8390.0000 -176.77000 -173.32543 3.44457 1.79075 -173.42452 355.90770
8395.0000 -176.63821 -173.46087 3.17734 1.79037 -173.43087 356.17125
8400.0000 -177.43029 -174.30103 3.12925 1.75635 -174.00321 327.07094
8405.0000 -177.38402 -173.68855 3.69547 1.75366 -174.04852 324.94092
8410.0000 -176.57047 -174.23671 2.33375 1.76750 -173.81561 337.29705
8415.0000 -176.99940 -173.85907 3.14033 1.74091 -174.26295 314.47870
8420.0000 -176.34119 -173.68144 2.65975 1.76558 -173.84796 332.65896
8425.0000 -176.82306 -174.51882 2.30424 1.76053 -173.93295 330.62481
8430.0000 -177.12902 -174.31621 2.81281 1.73836 -174.30584 311.52828
8435.0000 -177.23139 -174.32653 2.90486 1.75392 -174.04402 326.38940
8440.0000 -176.90925 -173.85381 3.05544 1.73841 -174.30504 315.91553
8445.0000 -176.52695 -173.38532 3.14163 1.78034 -173.59961 352.10428
8450.0000 -176.32904 -173.16571 3.16333 1.80040 -173.26216 365.23702
8455.0000 -176.77149 -173.38915 3.38234 1.81059 -173.09071 369.59574
8460.0000 -177.19922 -173.98624 3.21299 1.76342 -173.88428 332.69476
8465.0000 -176.94352 -174.51096 2.43256 1.74492 -174.19550 320.67967
8470.0000 -177.02297 -174.58989 2.43308 1.74243 -174.23741 312.60756
8475.0000 -177.11854 -173.76807 3.35047 1.74805 -174.14284 318.10361
8480.0000 -177.19720 -174.24653 2.95068 1.75459 -174.03288 327.63088
8485.0000 -176.92808 -174.60851 2.31957 1.73541 -174.35549 311.92434
8490.0000 -176.90347 -174.14732 2.75615 1.73647 -174.33766 310.67594
8495.0000 -177.19224 -173.98315 3.20909 1.75428 -174.03801 322.29539
8500.0000 -176.66477 -174.05293 2.61185 1.76124 -173.92100 333.83566
FREEZING PROCESS: loop number 35 T-loop= 309.00000000000000
main_MD> interactions number 35 at Temperature= 309.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.98522 1.51459 -0.14948
force_rgl> df(natom) -0.07862 -1.05196 1.68512
8505.0000 -177.37074 -174.55990 2.81084 1.72278 -174.56790 297.96422
8510.0000 -177.64071 -174.59596 3.04475 1.73079 -174.43316 306.27181
8515.0000 -176.73045 -174.22079 2.50966 1.72255 -174.57186 294.66185
8520.0000 -177.20416 -174.45822 2.74594 1.73951 -174.28653 311.83196
8525.0000 -177.52807 -174.77658 2.75150 1.73227 -174.40828 306.47162
8530.0000 -176.93886 -174.05638 2.88248 1.73501 -174.36219 306.71444
8535.0000 -177.43154 -174.79806 2.63347 1.73036 -174.44049 302.43248
8540.0000 -176.53242 -174.13578 2.39664 1.72815 -174.47756 301.36415
8545.0000 -177.12885 -174.13276 2.99609 1.74322 -174.22404 320.04850
8550.0000 -177.29055 -174.78298 2.50757 1.73179 -174.41639 308.51600
8555.0000 -177.26629 -174.40220 2.86409 1.72715 -174.49449 302.24231
8560.0000 -177.00173 -174.14000 2.86173 1.75266 -174.06532 323.38797
8565.0000 -176.60811 -173.43351 3.17460 1.77539 -173.68293 341.33838
8570.0000 -177.11862 -173.83845 3.28018 1.77215 -173.73736 340.09271
8575.0000 -176.30138 -174.00685 2.29453 1.75949 -173.95033 327.89586
8580.0000 -177.16658 -174.20999 2.95659 1.73204 -174.41218 305.53396
8585.0000 -176.76547 -173.98282 2.78265 1.74667 -174.16603 318.67038
8590.0000 -176.84249 -173.89860 2.94389 1.76950 -173.78198 338.80491
8595.0000 -176.72445 -174.14946 2.57499 1.75994 -173.94279 327.73769
8600.0000 -176.89123 -174.79751 2.09372 1.72952 -174.45452 302.10582
8605.0000 -177.22983 -174.63856 2.59127 1.72999 -174.44673 303.50907
8610.0000 -177.28485 -174.55036 2.73450 1.73191 -174.41437 306.01277
8615.0000 -176.61831 -173.96099 2.65732 1.72359 -174.55429 300.30407
8620.0000 -177.13322 -174.60051 2.53271 1.73503 -174.36190 312.33203
8625.0000 -177.17556 -174.01826 3.15730 1.74738 -174.15416 318.57101
8630.0000 -176.67441 -173.98140 2.69302 1.76445 -173.86685 334.38963
8635.0000 -176.43679 -173.19649 3.24030 1.79139 -173.41368 357.13459
8640.0000 -177.02404 -174.15060 2.87344 1.78286 -173.55715 348.62053
8645.0000 -177.49231 -174.34614 3.14617 1.73924 -174.29099 310.66882
8650.0000 -177.19588 -174.78164 2.41424 1.71954 -174.62245 295.20649
8655.0000 -176.96128 -173.92851 3.03277 1.74118 -174.25839 314.15580
8660.0000 -176.66740 -173.87105 2.79635 1.74121 -174.25785 314.15456
8665.0000 -176.95562 -173.98002 2.97560 1.73985 -174.28074 310.57856
8670.0000 -177.11852 -174.73644 2.38209 1.74336 -174.22176 317.07176
8675.0000 -177.32795 -175.01013 2.31782 1.69092 -175.10384 268.71283
8680.0000 -176.95993 -174.01544 2.94448 1.72619 -174.51057 301.27716
8685.0000 -177.17722 -174.34191 2.83532 1.74224 -174.24053 314.40444
8690.0000 -176.84152 -174.02952 2.81200 1.73556 -174.35298 309.44269
8695.0000 -176.83393 -174.17426 2.65967 1.74868 -174.13221 319.33419
8700.0000 -177.11687 -174.04242 3.07444 1.76172 -173.91292 336.47583
8705.0000 -177.31289 -174.50276 2.81012 1.72117 -174.59498 295.77178
8710.0000 -176.84060 -174.30720 2.53340 1.74429 -174.20606 314.90797
8715.0000 -177.16637 -174.51577 2.65060 1.72469 -174.53580 299.55388
8720.0000 -177.00179 -174.46636 2.53542 1.73745 -174.32111 312.27564
8725.0000 -177.11629 -174.62346 2.49283 1.72004 -174.61406 294.05162
8730.0000 -176.76951 -174.42164 2.34786 1.70540 -174.86039 281.50253
8735.0000 -176.91307 -174.30748 2.60560 1.74330 -174.22275 315.28931
8740.0000 -176.99535 -174.18894 2.80641 1.72387 -174.54957 298.57917
8745.0000 -177.27711 -174.57637 2.70074 1.73886 -174.29741 311.51718
8750.0000 -176.92276 -174.23770 2.68506 1.74191 -174.24607 310.68701
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 16 [min], 24.3267633 [s].
main_MD> Deallocating global variables
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