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nanoparticlesims/growth_Melting_Silver_ICO_4091/freezeSims/run_72/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_72.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 = 72 ntipo2 = 0
read_input> Finish reading input
main_MD> Allocating global variables
main_MD> Number of outputs that will be created: 1650
main_MD> Size of nv and nvoiz: 72 7200
main_MD> Size of nv and nvoiz: 72 7200
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 = 72
main_MD> Consider changing parameter nsiz in module_parameters.f90 for performance
main_MD> collvar_wanted = F
main_MD> INPUT AND POTENTIAL FILE READING IS DONE
main_MD> THERMALIZATION IS STARTING
init> 0.14887381412578232 3.8914044846893127E-002 -6.9154874674153807E-002 initial drift of cluster / NP1 for coalescence
init> 0.31743773098478956 0.33788624220762375 0.26834419055656678 scaling for velocity /for coalescence NP1
init.f90 > facguy = 3.6027307683292324E-003
preparo> IN BIGVOI : LIMIT 1.2247448652052084 1.2247448652052084 1.2247448652052084
preparo> END t=0 TIME STEP
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.33716 -0.52326 -1.57518
force_rgl> df(natom) -2.20957 0.16485 -2.37948
preparo> THERMALIZATION PROCESS AT 1126.6062247617747
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -162.63145928824287 9.3282462083437121 -171.95970549658657 6.1072370191286136E-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 33
FREEZING PROCESS: loop number 1 T-loop= 1101.0000000000000
main_MD> interactions number 1 at Temperature= 1101.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.52176 -1.38223 -0.11718
force_rgl> df(natom) 0.79961 1.56630 1.70047
5.0000 -172.11284 -161.65683 10.45602 2.88847 -162.40935 1059.08447
10.0000 -172.03543 -161.63538 10.40005 2.94111 -161.49816 1042.26014
15.0000 -171.43191 -161.38883 10.04308 2.93859 -161.54191 1055.98720
20.0000 -169.37793 -159.52368 9.85425 3.06074 -159.42781 1132.88823
25.0000 -170.92256 -161.45538 9.46718 3.00340 -160.42017 1079.02766
30.0000 -169.00616 -159.16663 9.83953 3.01385 -160.23939 1135.97350
35.0000 -170.06724 -159.23070 10.83654 3.10957 -158.58275 1171.25862
40.0000 -171.12212 -160.53037 10.59174 2.93976 -161.52152 1080.89293
45.0000 -170.30948 -161.22537 9.08412 2.98516 -160.73579 1088.25549
50.0000 -171.33252 -161.41782 9.91470 2.95817 -161.20292 1081.28665
55.0000 -172.77364 -162.46500 10.30864 2.93299 -161.63882 1062.16921
60.0000 -170.62722 -159.88390 10.74332 3.04022 -159.78289 1152.65110
65.0000 -170.97425 -160.46469 10.50956 3.08642 -158.98334 1175.08029
70.0000 -169.51347 -154.01762 15.49585 3.15200 -157.84829 1214.95801
75.0000 -169.77139 -158.90101 10.87038 3.23047 -156.49026 1259.38832
80.0000 -170.93127 -159.70991 11.22136 3.09551 -158.82597 1179.06591
85.0000 -172.44928 -160.99664 11.45264 2.99601 -160.54812 1150.38331
90.0000 -168.61022 -158.80950 9.80072 3.05407 -159.54316 1167.95942
95.0000 -170.12833 -160.24929 9.87904 3.07222 -159.22902 1148.99203
100.0000 -170.29814 -161.01005 9.28809 2.94756 -161.38655 1055.49636
105.0000 -170.43660 -159.91712 10.51948 3.02591 -160.03063 1108.49990
110.0000 -168.15579 -159.38870 8.76709 3.02166 -160.10415 1124.39992
115.0000 -172.18093 -160.29212 11.88881 3.00647 -160.36702 1126.69075
120.0000 -171.27793 -161.21129 10.06665 3.02699 -160.01184 1134.60254
125.0000 -169.89178 -159.16578 10.72600 2.98995 -160.65291 1103.04753
130.0000 -170.76165 -159.86776 10.89389 3.06063 -159.42976 1134.71155
135.0000 -172.63124 -162.26723 10.36402 2.99732 -160.52547 1111.77195
140.0000 -171.23909 -162.42605 8.81304 2.91371 -161.97237 1047.15681
145.0000 -173.25037 -161.55450 11.69586 2.88004 -162.55515 1031.28153
150.0000 -170.61926 -160.66245 9.95681 2.94107 -161.49893 1054.48111
155.0000 -172.35268 -162.41024 9.94244 2.91538 -161.94349 1061.59823
160.0000 -171.04705 -159.71499 11.33206 2.93468 -161.60946 1100.50792
165.0000 -170.72036 -160.40578 10.31458 3.05222 -159.57528 1140.54862
170.0000 -168.99584 -158.62407 10.37177 3.05940 -159.45099 1147.88016
175.0000 -170.54722 -160.68683 9.86039 3.04223 -159.74808 1091.40488
180.0000 -168.84773 -158.57824 10.26949 3.03021 -159.95622 1114.76403
185.0000 -169.96049 -159.38447 10.57602 2.99841 -160.50652 1064.56187
190.0000 -171.90888 -161.87090 10.03798 3.02001 -160.13269 1133.62515
195.0000 -172.75246 -162.54636 10.20610 2.86510 -162.81380 1041.78627
200.0000 -170.98953 -160.51299 10.47654 2.98253 -160.78141 1102.40466
205.0000 -173.07865 -165.56546 7.51318 2.81891 -163.61319 1007.96627
210.0000 -174.23061 -162.78910 11.44151 2.78085 -164.27190 981.61625
215.0000 -170.39636 -161.39534 9.00102 2.86622 -162.79431 1029.76777
220.0000 -170.83503 -160.41459 10.42044 2.93650 -161.57807 1044.42308
225.0000 -171.06516 -161.56251 9.50265 2.97841 -160.85264 1099.06713
230.0000 -171.25285 -159.48587 11.76699 3.05961 -159.44734 1145.06542
235.0000 -172.87126 -161.41087 11.46039 2.95260 -161.29931 1088.14351
240.0000 -170.92838 -160.01815 10.91023 3.02059 -160.12264 1127.37774
245.0000 -170.07754 -160.89718 9.18036 2.99749 -160.52238 1094.57890
250.0000 -169.68193 -159.37225 10.30968 3.03679 -159.84228 1105.15770
FREEZING PROCESS: loop number 2 T-loop= 1076.0000000000000
main_MD> interactions number 2 at Temperature= 1076.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.82011 -3.66009 -0.76820
force_rgl> df(natom) 0.44963 -0.98719 -1.72814
255.0000 -171.06589 -158.20969 12.85620 3.10309 -158.69485 1164.46832
260.0000 -169.72099 -159.71541 10.00558 3.04075 -159.77376 1141.99680
265.0000 -170.02478 -158.92999 11.09479 3.04150 -159.76075 1114.79850
270.0000 -170.91776 -160.12764 10.79011 3.04520 -159.69666 1118.91512
275.0000 -170.16859 -160.99501 9.17358 3.00125 -160.45739 1069.47532
280.0000 -171.17130 -161.38663 9.78466 2.97825 -160.85543 1071.88662
285.0000 -171.76742 -159.50609 12.26133 2.95806 -161.20488 1096.61189
290.0000 -171.25575 -160.60738 10.64837 3.06426 -159.36687 1142.83876
295.0000 -171.07173 -162.41652 8.65521 2.94460 -161.43785 1058.61597
300.0000 -173.12541 -162.71898 10.40643 2.88484 -162.47211 1038.45327
305.0000 -171.23192 -160.75181 10.48011 2.92223 -161.82505 1072.65783
310.0000 -172.13394 -162.00664 10.12730 2.98369 -160.76135 1091.98937
315.0000 -170.18607 -159.00070 11.18537 2.99992 -160.48037 1117.88414
320.0000 -171.07324 -161.57581 9.49743 2.94211 -161.48091 1045.37609
325.0000 -170.35429 -159.12882 11.22547 2.98887 -160.67165 1094.38557
330.0000 -170.15914 -160.59846 9.56068 3.10698 -158.62754 1186.51682
335.0000 -169.53801 -158.93427 10.60374 2.99508 -160.56409 1108.63918
340.0000 -170.80194 -159.31845 11.48349 3.11438 -158.49948 1169.20406
345.0000 -172.52709 -162.90314 9.62395 2.99836 -160.50731 1131.05424
350.0000 -171.11751 -160.66437 10.45314 2.94248 -161.47444 1070.87275
355.0000 -168.66607 -157.75575 10.91032 3.03803 -159.82087 1119.53020
360.0000 -170.03253 -158.83469 11.19784 3.16493 -157.62465 1194.51276
365.0000 -171.17353 -162.26096 8.91257 2.98549 -160.73007 1130.08456
370.0000 -171.88471 -162.37972 9.50499 2.87885 -162.57567 1018.94279
375.0000 -171.08642 -161.17442 9.91200 2.94129 -161.49505 1097.13036
380.0000 -171.68422 -163.05218 8.63204 2.91941 -161.87379 1071.72734
385.0000 -170.05648 -161.31380 8.74268 2.87392 -162.66103 1024.44039
390.0000 -170.39906 -160.29036 10.10870 3.00320 -160.42369 1089.91100
395.0000 -170.13528 -159.30921 10.82608 3.04779 -159.65185 1129.38196
400.0000 -171.82172 -159.51796 12.30376 3.07932 -159.10615 1145.86688
405.0000 -170.75125 -160.10363 10.64762 3.03491 -159.87491 1137.94840
410.0000 -171.71017 -161.40010 10.31006 2.99574 -160.55283 1124.91891
415.0000 -170.52027 -161.85675 8.66352 3.00243 -160.43701 1059.69833
420.0000 -170.58972 -162.74651 7.84321 2.82093 -163.57821 978.34224
425.0000 -170.08990 -159.93673 10.15317 3.02871 -159.98218 1146.87233
430.0000 -172.01778 -160.51336 11.50441 3.02764 -160.00070 1138.27632
435.0000 -171.88205 -162.07615 9.80590 2.95697 -161.22375 1086.83495
440.0000 -173.80960 -164.44309 9.36651 2.88335 -162.49794 1029.74453
445.0000 -172.86549 -163.28042 9.58507 2.78456 -164.20766 949.29427
450.0000 -171.13859 -160.83915 10.29944 2.87005 -162.72805 1037.22629
455.0000 -170.49223 -162.48797 8.00426 2.97649 -160.88595 1054.47280
460.0000 -171.69329 -161.94806 9.74523 2.92009 -161.86200 1041.26090
465.0000 -171.30070 -160.73305 10.56765 2.95300 -161.29250 1076.88870
470.0000 -170.63461 -159.51955 11.11506 3.05551 -159.51833 1155.61868
475.0000 -171.85705 -162.41299 9.44406 2.93471 -161.60905 1078.15041
480.0000 -172.87813 -163.13150 9.74662 2.87618 -162.62198 1021.02983
485.0000 -172.08436 -162.97521 9.10915 2.92678 -161.74625 1058.25002
490.0000 -171.11424 -160.87179 10.24245 2.88876 -162.40417 1048.96885
495.0000 -170.89501 -160.00094 10.89407 2.98157 -160.79797 1115.74555
500.0000 -168.63115 -157.98110 10.65005 3.07409 -159.19674 1175.57367
FREEZING PROCESS: loop number 3 T-loop= 1051.0000000000000
main_MD> interactions number 3 at Temperature= 1051.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.04379 6.81626 -1.14350
force_rgl> df(natom) -2.89792 1.35015 2.61432
505.0000 -169.14281 -157.83330 11.30950 3.08575 -158.99502 1176.17506
510.0000 -170.23064 -159.44452 10.78613 3.13896 -158.07410 1203.77406
515.0000 -172.57845 -162.02295 10.55550 2.97003 -160.99762 1111.61485
520.0000 -172.07315 -161.31599 10.75717 2.93324 -161.63447 1046.42612
525.0000 -172.72190 -163.44335 9.27856 2.85784 -162.93944 1004.30863
530.0000 -172.34656 -163.22366 9.12291 2.82677 -163.47716 987.42335
535.0000 -172.60753 -164.44401 8.16352 2.75009 -164.80412 939.17425
540.0000 -172.11289 -164.14924 7.96365 2.80304 -163.88787 976.65091
545.0000 -173.70850 -163.93190 9.77659 2.80806 -163.80097 1014.64707
550.0000 -172.07892 -164.10201 7.97691 2.78307 -164.23346 951.76386
555.0000 -174.39903 -164.20685 10.19217 2.79280 -164.06507 971.81742
560.0000 -171.42556 -163.68128 7.74429 2.84588 -163.14643 985.18579
565.0000 -171.69709 -164.15131 7.54578 2.81857 -163.61894 983.79749
570.0000 -171.86113 -163.07545 8.78568 2.87140 -162.70465 1007.21393
575.0000 -173.56443 -162.77202 10.79241 2.89173 -162.35290 1021.63803
580.0000 -168.96177 -159.71564 9.24614 2.95977 -161.17527 1104.06566
585.0000 -171.35096 -162.13334 9.21762 2.92462 -161.78370 1060.25368
590.0000 -171.01344 -161.03894 9.97450 2.90418 -162.13740 1032.77066
595.0000 -171.14317 -161.16684 9.97634 3.02828 -159.98965 1153.29623
600.0000 -171.10502 -160.94675 10.15827 2.94539 -161.42422 1047.55170
605.0000 -170.01380 -160.28932 9.72447 2.98390 -160.75769 1073.35624
610.0000 -169.84771 -158.44211 11.40559 3.03572 -159.86089 1100.16093
615.0000 -174.21159 -164.90777 9.30382 2.89702 -162.26127 1035.26111
620.0000 -172.11086 -162.27060 9.84026 2.83880 -163.26886 993.43192
625.0000 -170.97982 -160.98196 9.99786 2.88515 -162.46672 1061.17268
630.0000 -171.97573 -159.94744 12.02829 2.99562 -160.55483 1105.25419
635.0000 -171.50394 -161.17066 10.33328 2.99741 -160.52377 1124.36328
640.0000 -170.64777 -158.82318 11.82458 3.00489 -160.39431 1121.24274
645.0000 -171.47947 -160.75763 10.72184 3.01288 -160.25617 1114.33284
650.0000 -172.40200 -163.01667 9.38533 2.86201 -162.86721 1026.61262
655.0000 -172.59027 -163.78638 8.80389 2.84329 -163.19112 963.47405
660.0000 -173.48007 -163.33703 10.14303 2.80256 -163.89605 973.73738
665.0000 -170.10580 -161.69235 8.41345 2.85807 -162.93535 1026.16880
670.0000 -170.79190 -161.30203 9.48988 2.99225 -160.61317 1101.54168
675.0000 -171.87404 -161.32900 10.54503 2.99833 -160.50791 1129.43199
680.0000 -170.15192 -158.38187 11.77005 3.09218 -158.88363 1220.04486
685.0000 -171.40779 -160.81886 10.58892 2.97458 -160.91892 1065.90679
690.0000 -170.60881 -160.82767 9.78115 2.92818 -161.72196 1066.44287
695.0000 -172.38093 -160.87471 11.50622 2.97945 -160.83466 1073.68897
700.0000 -168.04714 -159.16417 8.88298 3.04706 -159.66458 1113.47488
705.0000 -169.10735 -159.11244 9.99491 3.13435 -158.15390 1160.36926
710.0000 -168.63182 -158.18651 10.44531 3.04935 -159.62487 1123.88237
715.0000 -173.58747 -163.18377 10.40370 2.95189 -161.31159 1099.58798
720.0000 -171.01739 -162.48772 8.52967 2.84250 -163.20486 999.71669
725.0000 -171.23406 -162.94162 8.29244 2.82397 -163.52551 978.47933
730.0000 -172.82608 -162.30151 10.52457 2.91130 -162.01421 1051.66769
735.0000 -171.96017 -162.95161 9.00856 2.85410 -163.00419 1039.65469
740.0000 -174.49989 -164.73074 9.76915 2.84306 -163.19513 1018.44474
745.0000 -173.21605 -161.38797 11.82808 2.82115 -163.57437 1002.43671
750.0000 -170.48225 -160.86672 9.61553 2.94668 -161.40187 1085.49504
FREEZING PROCESS: loop number 4 T-loop= 1026.0000000000000
main_MD> interactions number 4 at Temperature= 1026.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.79272 0.82147 -1.30702
force_rgl> df(natom) 3.40969 -0.74081 -3.05100
755.0000 -172.25549 -162.10710 10.14839 2.95236 -161.30358 1091.65041
760.0000 -171.04073 -162.37349 8.66724 2.87890 -162.57491 1023.96532
765.0000 -171.69247 -162.91796 8.77451 2.84641 -163.13724 1010.46705
770.0000 -169.79361 -158.14658 11.64703 2.99692 -160.53230 1100.33221
775.0000 -171.49195 -161.60121 9.89075 3.03622 -159.85210 1159.91083
780.0000 -173.44100 -162.38059 11.06040 3.00198 -160.44473 1100.51849
785.0000 -171.04822 -161.10244 9.94578 2.99990 -160.48075 1102.42838
790.0000 -171.82298 -162.26291 9.56007 2.94621 -161.40996 1077.80369
795.0000 -170.17680 -160.24774 9.92906 2.99149 -160.62622 1087.87266
800.0000 -171.11023 -160.89043 10.21980 2.93452 -161.61231 1032.88305
805.0000 -170.74071 -159.74914 10.99157 2.96109 -161.15237 1079.10767
810.0000 -170.71417 -160.51560 10.19857 2.98373 -160.76057 1091.25332
815.0000 -171.88675 -159.72369 12.16307 3.00217 -160.44154 1098.36100
820.0000 -173.03648 -163.10586 9.93062 2.98127 -160.80318 1128.71703
825.0000 -173.14372 -164.44571 8.69802 2.78743 -164.15793 957.52403
830.0000 -171.34390 -162.02660 9.31731 2.88601 -162.45184 1020.59209
835.0000 -172.32883 -161.60314 10.72569 2.93315 -161.63607 1073.79071
840.0000 -170.67356 -160.01065 10.66291 2.95621 -161.23697 1076.96681
845.0000 -170.41759 -159.25260 11.16499 3.04548 -159.69194 1097.97879
850.0000 -169.70048 -160.96746 8.73302 3.00524 -160.38824 1104.58326
855.0000 -170.58785 -161.34824 9.23962 3.02673 -160.01634 1106.54343
860.0000 -173.03826 -161.33479 11.70347 2.91431 -161.96208 1078.05830
865.0000 -171.63827 -161.41705 10.22123 2.93747 -161.56123 1074.95254
870.0000 -172.63281 -164.44134 8.19147 2.83708 -163.29862 992.98025
875.0000 -169.72193 -160.60618 9.11574 2.84790 -163.11146 1003.10183
880.0000 -171.80292 -161.75661 10.04631 3.00583 -160.37809 1101.90906
885.0000 -171.44893 -162.30349 9.14543 2.93256 -161.64616 1047.03908
890.0000 -169.78478 -158.78858 10.99620 3.05687 -159.49476 1119.07803
895.0000 -172.30518 -163.53075 8.77443 2.98792 -160.68804 1107.13697
900.0000 -170.97456 -160.69970 10.27486 2.91561 -161.93961 1113.36198
905.0000 -168.28669 -158.23455 10.05214 3.06248 -159.39771 1147.07772
910.0000 -172.09945 -162.13310 9.96636 3.02797 -159.99492 1122.57860
915.0000 -172.24383 -162.12737 10.11646 2.84675 -163.13124 1028.47518
920.0000 -172.09242 -162.19082 9.90160 2.91360 -161.97438 1037.72636
925.0000 -172.33307 -162.11142 10.22166 2.86912 -162.74413 1030.21940
930.0000 -171.61762 -162.28266 9.33496 2.88184 -162.52401 1051.51086
935.0000 -171.91630 -163.17830 8.73800 2.85767 -162.94230 1082.09175
940.0000 -174.76980 -165.89761 8.87219 2.77122 -164.43846 955.90948
945.0000 -171.04063 -162.06968 8.97095 2.78206 -164.25084 971.00015
950.0000 -174.56868 -165.88745 8.68123 2.75707 -164.68343 945.64067
955.0000 -174.12820 -164.81457 9.31363 2.77488 -164.37524 985.61658
960.0000 -173.54617 -164.39824 9.14793 2.77931 -164.29858 973.25964
965.0000 -173.58846 -165.32990 8.25856 2.80676 -163.82346 991.57671
970.0000 -174.13283 -164.59715 9.53567 2.77245 -164.41725 951.12796
975.0000 -171.66823 -161.75452 9.91371 2.81668 -163.65167 958.34593
980.0000 -171.76610 -162.28060 9.48550 2.83869 -163.27082 972.43808
985.0000 -171.89145 -162.54797 9.34348 2.91609 -161.93117 1088.22537
990.0000 -172.57461 -164.33476 8.23985 2.82622 -163.48663 971.95444
995.0000 -171.90473 -163.69312 8.21161 2.81778 -163.63262 976.02281
1000.0000 -171.15311 -160.54847 10.60464 2.88846 -162.40940 1057.25229
FREEZING PROCESS: loop number 5 T-loop= 1001.0000000000000
main_MD> interactions number 5 at Temperature= 1001.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.05701 1.83033 0.40822
force_rgl> df(natom) -0.46442 -0.73134 -0.78820
1005.0000 -170.70827 -160.58310 10.12517 2.99130 -160.62964 1077.74994
1010.0000 -170.90818 -160.24776 10.66043 3.01540 -160.21247 1137.06069
1015.0000 -171.08294 -161.07302 10.00992 3.01488 -160.22154 1115.78813
1020.0000 -171.06104 -163.44624 7.61480 2.94690 -161.39795 1065.78999
1025.0000 -171.55488 -162.24136 9.31351 2.79781 -163.97832 990.97116
1030.0000 -173.19303 -163.85224 9.34079 2.87939 -162.56640 1010.73745
1035.0000 -172.20045 -163.27935 8.92110 2.81221 -163.72914 973.80094
1040.0000 -172.16293 -163.27737 8.88556 2.85415 -163.00330 1009.15719
1045.0000 -172.84778 -164.55545 8.29233 2.83191 -163.38811 999.81399
1050.0000 -173.91964 -166.16367 7.75597 2.68637 -165.90693 893.67673
1055.0000 -173.98962 -165.46922 8.52040 2.65818 -166.39490 885.12331
1060.0000 -174.39356 -164.53249 9.86107 2.72062 -165.31418 916.42947
1065.0000 -172.85438 -163.66067 9.19371 2.78890 -164.13248 954.56940
1070.0000 -172.93861 -163.27233 9.66628 2.79338 -164.05501 942.81615
1075.0000 -171.61817 -161.17301 10.44516 2.85999 -162.90225 1017.38991
1080.0000 -173.04916 -162.70244 10.34672 2.89621 -162.27527 1047.62281
1085.0000 -172.63937 -164.66411 7.97526 2.83490 -163.33646 982.89214
1090.0000 -172.34458 -162.26076 10.08382 2.81265 -163.72140 978.36122
1095.0000 -174.71889 -165.32184 9.39705 2.83260 -163.37626 969.48152
1100.0000 -175.19815 -165.24269 9.95546 2.72745 -165.19604 910.57193
1105.0000 -173.16669 -165.03649 8.13020 2.75612 -164.69979 949.62723
1110.0000 -174.23359 -165.34043 8.89316 2.74297 -164.92744 955.28686
1115.0000 -172.90167 -162.59427 10.30740 2.85133 -163.05204 1005.06889
1120.0000 -173.28310 -165.09201 8.19108 2.80535 -163.84789 974.40372
1125.0000 -170.81235 -161.54888 9.26347 2.84244 -163.20588 963.31649
1130.0000 -172.17549 -163.14730 9.02819 2.92761 -161.73184 1069.98170
1135.0000 -173.72923 -165.22849 8.50074 2.82383 -163.52805 998.99799
1140.0000 -171.26611 -162.12518 9.14093 2.88536 -162.46312 1020.24047
1145.0000 -170.26727 -159.73145 10.53582 3.01689 -160.18676 1096.10216
1150.0000 -172.27776 -161.76350 10.51426 2.99614 -160.54590 1099.58699
1155.0000 -170.39746 -160.24712 10.15035 3.01694 -160.18576 1100.76831
1160.0000 -172.57990 -163.44934 9.13056 2.98434 -160.75010 1086.15990
1165.0000 -171.53791 -163.06870 8.46922 2.86765 -162.76964 981.95095
1170.0000 -173.81654 -163.95889 9.85765 2.78662 -164.17199 950.12938
1175.0000 -173.06151 -163.26060 9.80091 2.77759 -164.32834 929.68129
1180.0000 -170.80260 -161.62667 9.17594 2.88075 -162.54280 1012.38964
1185.0000 -172.07805 -163.34895 8.72910 2.92211 -161.82703 1050.89266
1190.0000 -171.92339 -164.42538 7.49801 2.80630 -163.83141 973.92587
1195.0000 -173.42367 -164.04605 9.37761 2.80822 -163.79820 965.31431
1200.0000 -173.33219 -163.23212 10.10007 2.80770 -163.80719 961.11778
1205.0000 -173.85501 -164.98872 8.86629 2.81441 -163.69096 966.93015
1210.0000 -173.44722 -163.46611 9.98111 2.77118 -164.43925 949.90080
1215.0000 -171.42754 -162.16828 9.25927 2.85967 -162.90778 988.37256
1220.0000 -173.02182 -163.72827 9.29355 2.89150 -162.35689 1041.83551
1225.0000 -171.86086 -162.59532 9.26554 2.83690 -163.30176 1024.60488
1230.0000 -172.36719 -164.59749 7.76970 2.82906 -163.43746 986.35585
1235.0000 -171.89677 -162.35862 9.53815 2.85834 -162.93067 1002.54215
1240.0000 -168.98951 -159.57912 9.41039 2.95511 -161.25589 1055.69723
1245.0000 -170.21740 -159.85416 10.36324 3.05311 -159.55981 1127.87102
1250.0000 -171.17405 -160.07129 11.10276 3.00323 -160.42318 1092.95928
FREEZING PROCESS: loop number 6 T-loop= 976.00000000000000
main_MD> interactions number 6 at Temperature= 976.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.76774 2.40359 1.07944
force_rgl> df(natom) 3.02340 1.00447 1.14495
1255.0000 -173.60527 -163.14754 10.45773 2.90419 -162.13717 1082.30553
1260.0000 -173.35472 -165.05303 8.30169 2.82076 -163.58113 1026.72995
1265.0000 -173.40179 -162.29238 11.10940 2.84840 -163.10269 1036.67000
1270.0000 -174.02981 -165.68396 8.34585 2.79574 -164.01421 942.24691
1275.0000 -173.58952 -164.84591 8.74361 2.72689 -165.20577 948.11456
1280.0000 -173.46866 -165.85287 7.61580 2.71080 -165.48421 924.89121
1285.0000 -172.86046 -164.67464 8.18582 2.72001 -165.32479 909.50927
1290.0000 -174.23359 -166.28718 7.94641 2.74503 -164.89174 889.67373
1295.0000 -172.72099 -164.45350 8.26749 2.70568 -165.57276 892.95075
1300.0000 -172.96906 -165.05277 7.91629 2.76941 -164.46979 941.70841
1305.0000 -173.24814 -163.46499 9.78315 2.77972 -164.29134 960.65128
1310.0000 -171.46509 -163.55571 7.90937 2.81071 -163.75507 970.51591
1315.0000 -173.30893 -164.86501 8.44393 2.77932 -164.29840 962.97887
1320.0000 -170.43138 -162.05078 8.38060 2.80220 -163.90232 959.79525
1325.0000 -172.41508 -163.23023 9.18485 2.86307 -162.84879 997.76344
1330.0000 -173.68552 -164.49618 9.18934 2.77542 -164.36577 949.48028
1335.0000 -174.54620 -163.52353 11.02267 2.79898 -163.95803 978.05585
1340.0000 -173.98534 -165.42824 8.55710 2.75377 -164.74059 962.34876
1345.0000 -172.94750 -164.70211 8.24539 2.68479 -165.93440 912.39008
1350.0000 -172.77261 -165.36909 7.40353 2.74993 -164.80698 952.20285
1355.0000 -172.88962 -164.56831 8.32131 2.72229 -165.28526 911.03186
1360.0000 -172.08962 -162.63609 9.45353 2.79412 -164.04225 979.62469
1365.0000 -173.48591 -165.19382 8.29209 2.86276 -162.85424 1030.95002
1370.0000 -174.66650 -166.87574 7.79076 2.68331 -165.95989 897.81424
1375.0000 -174.64784 -166.53814 8.10970 2.64655 -166.59612 890.34879
1380.0000 -173.84673 -163.96042 9.88631 2.75234 -164.76530 966.25378
1385.0000 -175.46449 -168.39988 7.06461 2.65643 -166.42520 871.87296
1390.0000 -174.96159 -165.23657 9.72502 2.63722 -166.75765 854.84877
1395.0000 -171.81118 -161.89583 9.91535 2.77379 -164.39408 944.49280
1400.0000 -173.72143 -163.95843 9.76301 2.83103 -163.40335 1020.02986
1405.0000 -173.07758 -162.69053 10.38705 2.86447 -162.82456 1009.43492
1410.0000 -172.41850 -164.73294 7.68556 2.87562 -162.63167 1008.78609
1415.0000 -172.82572 -163.76722 9.05851 2.75963 -164.63917 944.66840
1420.0000 -171.37824 -161.14214 10.23611 2.89391 -162.31515 1047.99508
1425.0000 -173.76825 -163.64894 10.11931 2.84999 -163.07530 1015.12391
1430.0000 -173.66545 -164.07639 9.58906 2.81845 -163.62112 1008.26068
1435.0000 -172.45127 -163.89453 8.55673 2.83005 -163.42033 1021.23740
1440.0000 -172.15120 -164.60555 7.54566 2.79051 -164.10470 972.79083
1445.0000 -173.51921 -164.65468 8.86453 2.77663 -164.34480 966.06931
1450.0000 -173.10913 -163.48676 9.62236 2.83769 -163.28806 1008.95481
1455.0000 -172.01862 -162.30265 9.71597 2.82308 -163.54099 963.26216
1460.0000 -172.69563 -164.55578 8.13985 2.86319 -162.84670 1001.73096
1465.0000 -174.45244 -166.75589 7.69655 2.72028 -165.32005 918.82789
1470.0000 -175.26453 -166.16206 9.10247 2.64585 -166.60826 867.78842
1475.0000 -171.97946 -161.54622 10.43324 2.78524 -164.19579 936.06873
1480.0000 -171.19768 -162.38692 8.81076 2.91445 -161.95969 1050.23393
1485.0000 -172.49231 -161.94095 10.55136 2.85955 -162.90978 1005.68152
1490.0000 -173.01457 -163.20934 9.80523 2.88954 -162.39082 1012.09480
1495.0000 -174.54896 -165.50267 9.04629 2.78570 -164.18799 967.99559
1500.0000 -172.33562 -161.71318 10.62244 2.75363 -164.74293 952.64254
FREEZING PROCESS: loop number 7 T-loop= 951.00000000000000
main_MD> interactions number 7 at Temperature= 951.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.93211 3.18710 -1.26129
force_rgl> df(natom) -0.42700 0.93216 -0.54893
1505.0000 -170.50245 -159.94267 10.55979 2.98960 -160.65892 1077.04607
1510.0000 -171.93656 -164.02618 7.91038 2.92652 -161.75065 1052.40779
1515.0000 -173.32291 -164.03831 9.28460 2.80260 -163.89536 938.51789
1520.0000 -174.67858 -163.29545 11.38313 2.85984 -162.90472 1014.14258
1525.0000 -173.62761 -164.08066 9.54694 2.77408 -164.38898 936.78352
1530.0000 -172.98766 -163.49590 9.49176 2.81425 -163.69384 997.18326
1535.0000 -172.72451 -163.42061 9.30390 2.80990 -163.76905 980.12196
1540.0000 -172.62803 -163.88884 8.73918 2.79629 -164.00466 985.04758
1545.0000 -174.42829 -164.81864 9.60965 2.79984 -163.94313 973.44350
1550.0000 -173.96083 -165.70399 8.25684 2.68815 -165.87624 879.85072
1555.0000 -174.01077 -166.90969 7.10108 2.65171 -166.50689 896.36942
1560.0000 -173.92718 -165.87586 8.05132 2.66823 -166.22093 890.45378
1565.0000 -173.51317 -164.85421 8.65896 2.69917 -165.68542 932.11475
1570.0000 -174.35275 -167.02453 7.32822 2.69352 -165.78333 930.71724
1575.0000 -173.04642 -165.36796 7.67846 2.67011 -166.18849 856.83445
1580.0000 -173.57388 -164.90951 8.66437 2.67678 -166.07301 907.74378
1585.0000 -174.03389 -165.87184 8.16206 2.70670 -165.55523 921.72027
1590.0000 -173.73661 -165.46800 8.26862 2.70786 -165.53511 905.47048
1595.0000 -174.72592 -164.59661 10.12931 2.74692 -164.85907 910.53193
1600.0000 -174.38181 -165.44461 8.93720 2.72526 -165.23401 895.90878
1605.0000 -174.13254 -165.01249 9.12005 2.74837 -164.83405 934.58415
1610.0000 -172.62965 -164.75315 7.87650 2.76401 -164.56330 955.06744
1615.0000 -171.98177 -162.65753 9.32424 2.83812 -163.28068 991.74180
1620.0000 -171.40995 -162.61184 8.79810 2.83137 -163.39747 1013.97431
1625.0000 -172.87030 -164.99433 7.87597 2.81362 -163.70464 1004.21444
1630.0000 -173.76684 -165.76877 7.99808 2.73818 -165.01032 924.48761
1635.0000 -173.79712 -166.17545 7.62167 2.68348 -165.95711 868.66890
1640.0000 -173.18239 -166.14486 7.03753 2.66443 -166.28669 891.72538
1645.0000 -174.89519 -166.05271 8.84248 2.70783 -165.53555 890.46017
1650.0000 -175.59403 -165.89029 9.70374 2.64790 -166.57273 883.91492
1655.0000 -174.56783 -164.60193 9.96590 2.73779 -165.01702 937.87248
1660.0000 -174.87339 -165.85070 9.02269 2.71898 -165.34263 938.07922
1665.0000 -174.30063 -166.71490 7.58572 2.73056 -165.14217 938.18026
1670.0000 -174.41289 -165.90175 8.51114 2.63002 -166.88232 856.54256
1675.0000 -173.43019 -165.18985 8.24035 2.74389 -164.91155 905.95360
1680.0000 -172.39916 -163.51810 8.88107 2.77094 -164.44342 920.10535
1685.0000 -173.04999 -163.75589 9.29410 2.78148 -164.26102 967.14335
1690.0000 -172.92870 -164.55978 8.36892 2.78813 -164.14583 987.28177
1695.0000 -171.30279 -162.43023 8.87256 2.82286 -163.54482 996.61832
1700.0000 -171.39023 -162.95053 8.43970 2.82414 -163.52259 977.61403
1705.0000 -171.72776 -162.08602 9.64173 2.84819 -163.10642 990.57250
1710.0000 -174.76074 -166.13082 8.62992 2.78087 -164.27157 944.18905
1715.0000 -174.41225 -163.48838 10.92387 2.74798 -164.84066 945.76292
1720.0000 -172.49024 -162.27064 10.21960 2.83742 -163.29271 992.08668
1725.0000 -173.93979 -165.69999 8.23980 2.85495 -162.98934 995.07384
1730.0000 -173.40414 -163.77509 9.62905 2.73870 -165.00126 915.56739
1735.0000 -173.58857 -165.95798 7.63059 2.72649 -165.21258 902.75576
1740.0000 -173.53566 -164.90177 8.63389 2.69039 -165.83752 913.81668
1745.0000 -174.85348 -164.81375 10.03973 2.79839 -163.96820 974.08414
1750.0000 -175.00460 -166.53123 8.47336 2.73058 -165.14178 945.41748
FREEZING PROCESS: loop number 8 T-loop= 926.00000000000000
main_MD> interactions number 8 at Temperature= 926.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.38921 -2.54727 -4.05334
force_rgl> df(natom) 0.79130 2.16096 0.78811
1755.0000 -174.87802 -166.35197 8.52605 2.66430 -166.28900 886.56626
1760.0000 -174.71143 -166.66300 8.04843 2.67320 -166.13498 900.65161
1765.0000 -174.65908 -165.83562 8.82346 2.63208 -166.84653 879.99412
1770.0000 -174.82358 -165.23452 9.58906 2.71704 -165.37622 928.23944
1775.0000 -174.04236 -167.03493 7.00743 2.65897 -166.38124 887.42776
1780.0000 -174.45708 -167.81108 6.64600 2.63429 -166.80839 856.53521
1785.0000 -172.62779 -165.14104 7.48675 2.68845 -165.87105 913.43573
1790.0000 -174.30689 -165.05079 9.25609 2.76894 -164.47796 967.37838
1795.0000 -173.62424 -165.89023 7.73400 2.77338 -164.40106 947.48040
1800.0000 -174.54428 -167.03824 7.50604 2.65704 -166.41455 861.08789
1805.0000 -174.88910 -165.60680 9.28230 2.70247 -165.62830 919.85655
1810.0000 -171.90512 -163.39760 8.50752 2.72674 -165.20827 899.29264
1815.0000 -173.66557 -164.67438 8.99119 2.79830 -163.96979 966.63838
1820.0000 -173.48878 -166.91881 6.56997 2.70130 -165.64854 884.16798
1825.0000 -173.86243 -164.54099 9.32143 2.69696 -165.72364 895.91553
1830.0000 -173.00309 -165.72432 7.27877 2.75194 -164.77216 955.63983
1835.0000 -173.49206 -166.40451 7.08755 2.69398 -165.77523 884.70456
1840.0000 -173.19105 -164.34258 8.84847 2.72533 -165.23265 925.04523
1845.0000 -174.00653 -164.92656 9.07996 2.77270 -164.41294 939.29585
1850.0000 -174.00336 -164.11485 9.88851 2.80371 -163.87624 995.68743
1855.0000 -175.41407 -166.61493 8.79914 2.71697 -165.37743 897.15990
1860.0000 -173.91181 -165.52119 8.39063 2.67366 -166.12690 874.64355
1865.0000 -174.08628 -166.37274 7.71354 2.73794 -165.01455 940.11791
1870.0000 -173.51042 -166.04491 7.46552 2.68254 -165.97334 881.91381
1875.0000 -174.30875 -164.84861 9.46014 2.70675 -165.55424 896.85270
1880.0000 -173.68849 -163.44501 10.24348 2.86834 -162.75772 1043.65416
1885.0000 -172.75304 -164.28525 8.46780 2.83309 -163.36777 1013.89434
1890.0000 -173.70667 -164.39245 9.31422 2.76756 -164.50192 953.70924
1895.0000 -175.34785 -165.42352 9.92433 2.69482 -165.76084 902.64277
1900.0000 -173.10148 -164.74739 8.35409 2.73802 -165.01309 955.93610
1905.0000 -173.30845 -165.25518 8.05327 2.73159 -165.12433 936.24921
1910.0000 -175.13449 -166.17169 8.96280 2.76795 -164.49515 979.98085
1915.0000 -174.47189 -165.81590 8.65599 2.68007 -166.01599 922.81790
1920.0000 -176.19684 -167.88327 8.31356 2.57724 -167.79567 817.32969
1925.0000 -176.03591 -166.93185 9.10406 2.61006 -167.22764 832.34971
1930.0000 -174.33504 -165.98016 8.35489 2.62633 -166.94620 829.35963
1935.0000 -173.91137 -164.58023 9.33114 2.67735 -166.06308 857.17053
1940.0000 -173.05160 -164.49825 8.55335 2.74792 -164.84178 946.07632
1945.0000 -174.98528 -166.31011 8.67517 2.74659 -164.86483 943.35423
1950.0000 -174.61234 -165.73489 8.87745 2.71466 -165.41738 933.41623
1955.0000 -171.88343 -165.04543 6.83800 2.70008 -165.66966 933.63403
1960.0000 -172.78963 -165.78542 7.00421 2.71152 -165.47175 930.39121
1965.0000 -173.27014 -165.65746 7.61268 2.68932 -165.85593 923.15548
1970.0000 -174.49484 -166.80580 7.68904 2.67909 -166.03303 894.77880
1975.0000 -176.14144 -168.64315 7.49829 2.59251 -167.53152 831.07255
1980.0000 -173.48155 -164.32488 9.15667 2.68729 -165.89105 879.97356
1985.0000 -172.63277 -164.08367 8.54910 2.81350 -163.70678 970.92180
1990.0000 -175.62370 -166.73756 8.88615 2.74569 -164.88034 933.90222
1995.0000 -174.30885 -165.87171 8.43715 2.66703 -166.24178 893.96759
2000.0000 -174.89936 -164.80426 10.09510 2.71205 -165.46248 900.60454
FREEZING PROCESS: loop number 9 T-loop= 901.00000000000000
main_MD> interactions number 9 at Temperature= 901.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.65421 -1.71895 -0.03976
force_rgl> df(natom) -0.57490 -1.88136 -1.19772
2005.0000 -176.11228 -167.66249 8.44979 2.62761 -166.92396 887.04918
2010.0000 -175.34275 -165.94266 9.40009 2.67245 -166.14797 889.28341
2015.0000 -175.02776 -165.42823 9.59953 2.65826 -166.39348 884.96644
2020.0000 -173.11365 -166.21142 6.90224 2.68594 -165.91439 891.88357
2025.0000 -174.12888 -167.07268 7.05620 2.63459 -166.80309 843.03171
2030.0000 -175.65696 -166.88412 8.77284 2.61286 -167.17931 882.26878
2035.0000 -175.49912 -168.51589 6.98323 2.58044 -167.74032 841.01928
2040.0000 -174.81011 -165.75955 9.05056 2.59839 -167.42967 846.14322
2045.0000 -175.31696 -165.89489 9.42207 2.69477 -165.76158 906.92568
2050.0000 -175.83970 -166.78652 9.05318 2.64041 -166.70237 876.97591
2055.0000 -173.27656 -164.90227 8.37430 2.69976 -165.67527 917.07860
2060.0000 -173.17832 -165.06371 8.11460 2.71573 -165.39893 905.12409
2065.0000 -173.03040 -164.22213 8.80827 2.75687 -164.68692 943.48348
2070.0000 -172.24413 -164.42453 7.81960 2.73887 -164.99833 893.96851
2075.0000 -174.12469 -165.73616 8.38853 2.71739 -165.37022 880.12006
2080.0000 -175.05409 -167.16182 7.89227 2.64017 -166.70653 884.95689
2085.0000 -173.12392 -163.52858 9.59534 2.66962 -166.19693 866.03684
2090.0000 -173.59601 -164.96699 8.62902 2.75772 -164.67212 968.66835
2095.0000 -175.77848 -167.77523 8.00325 2.66512 -166.27471 876.78104
2100.0000 -174.59769 -166.87549 7.72219 2.61055 -167.21930 849.56850
2105.0000 -174.69157 -166.06155 8.63002 2.66137 -166.33971 858.19467
2110.0000 -175.11458 -167.11876 7.99583 2.69493 -165.75878 916.15031
2115.0000 -174.86192 -164.56987 10.29206 2.68080 -166.00348 888.67068
2120.0000 -174.10701 -165.21168 8.89533 2.75811 -164.66535 953.01881
2125.0000 -173.13595 -163.82128 9.31467 2.82481 -163.51100 1004.42465
2130.0000 -174.91998 -165.63504 9.28494 2.76961 -164.46637 949.70769
2135.0000 -174.42941 -166.94585 7.48356 2.71772 -165.36436 925.06470
2140.0000 -173.67669 -165.68584 7.99085 2.62605 -166.95096 846.55270
2145.0000 -174.47605 -166.12413 8.35192 2.67976 -166.02137 876.69343
2150.0000 -173.92454 -166.81217 7.11238 2.62910 -166.89820 844.95028
2155.0000 -174.37148 -165.89378 8.47770 2.63986 -166.71188 868.83690
2160.0000 -173.82579 -165.48475 8.34104 2.74710 -164.85587 965.42255
2165.0000 -174.06537 -166.23665 7.82872 2.70096 -165.65458 888.21684
2170.0000 -173.84767 -165.96327 7.88440 2.67924 -166.03040 893.45816
2175.0000 -175.37471 -167.20294 8.17177 2.63992 -166.71094 880.77603
2180.0000 -175.54151 -167.16232 8.37919 2.64877 -166.55768 855.86170
2185.0000 -174.00665 -165.23672 8.76993 2.68401 -165.94790 881.46220
2190.0000 -173.04786 -165.61614 7.43172 2.72640 -165.21424 920.79451
2195.0000 -175.66778 -166.53193 9.13585 2.67324 -166.13433 872.86937
2200.0000 -174.05494 -165.78333 8.27160 2.68147 -165.99178 896.42682
2205.0000 -173.71181 -166.22185 7.48997 2.71219 -165.46019 920.52699
2210.0000 -172.86720 -164.87878 7.98842 2.67830 -166.04676 879.10729
2215.0000 -172.50162 -163.95898 8.54265 2.79792 -163.97641 956.09406
2220.0000 -171.45246 -162.48328 8.96918 2.85466 -162.99448 991.70822
2225.0000 -173.04416 -163.62009 9.42407 2.87465 -162.64850 1032.80275
2230.0000 -174.54313 -166.53640 8.00673 2.73884 -164.99888 943.37762
2235.0000 -173.85436 -165.48747 8.36689 2.68632 -165.90780 912.75933
2240.0000 -173.35735 -164.83849 8.51885 2.72706 -165.20275 939.62571
2245.0000 -172.46165 -164.25419 8.20746 2.76574 -164.53330 953.94839
2250.0000 -173.96474 -163.43311 10.53163 2.77686 -164.34098 947.59714
FREEZING PROCESS: loop number 10 T-loop= 876.00000000000000
main_MD> interactions number 10 at Temperature= 876.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.68037 0.96712 2.79131
force_rgl> df(natom) -0.32621 -0.83101 0.11892
2255.0000 -174.83325 -166.26944 8.56382 2.71408 -165.42747 903.80829
2260.0000 -174.37872 -165.61212 8.76660 2.68907 -165.86034 898.26160
2265.0000 -173.91012 -165.58327 8.32685 2.72025 -165.32070 921.10206
2270.0000 -173.40214 -165.80157 7.60057 2.69294 -165.79337 907.69525
2275.0000 -174.52191 -166.25446 8.26745 2.70408 -165.60044 925.03203
2280.0000 -174.24976 -166.56907 7.68069 2.67381 -166.12445 908.05839
2285.0000 -173.79378 -166.07101 7.72277 2.64924 -166.54953 886.75948
2290.0000 -175.24872 -167.44631 7.80241 2.64974 -166.54091 850.15983
2295.0000 -174.84012 -165.54158 9.29854 2.67485 -166.10640 892.16632
2300.0000 -175.47032 -167.53454 7.93578 2.70512 -165.58255 909.69337
2305.0000 -176.30201 -168.61307 7.68893 2.53184 -168.58142 817.85629
2310.0000 -175.75764 -168.61286 7.14478 2.53679 -168.49580 808.23974
2315.0000 -175.40923 -167.15403 8.25520 2.57737 -167.79350 818.91530
2320.0000 -175.32413 -167.65626 7.66787 2.56804 -167.95490 828.61654
2325.0000 -176.44081 -168.92035 7.52046 2.60170 -167.37235 864.02471
2330.0000 -174.44667 -166.59970 7.84697 2.62077 -167.04228 840.79216
2335.0000 -173.86428 -164.35152 9.51276 2.68502 -165.93034 894.62702
2340.0000 -173.21403 -165.10812 8.10592 2.81361 -163.70487 972.90877
2345.0000 -175.42549 -167.59255 7.83294 2.71024 -165.49384 923.39655
2350.0000 -174.50197 -166.70821 7.79375 2.64412 -166.63825 876.23561
2355.0000 -175.44530 -166.17926 9.26604 2.63441 -166.80621 869.25780
2360.0000 -175.41294 -166.76551 8.64743 2.63069 -166.87059 863.16546
2365.0000 -173.97524 -166.14991 7.82534 2.62281 -167.00712 876.53547
2370.0000 -175.49666 -167.47826 8.01840 2.67435 -166.11511 893.75645
2375.0000 -174.12100 -166.15537 7.96563 2.65001 -166.53631 888.09453
2380.0000 -174.24605 -166.71661 7.52944 2.67984 -166.02010 905.00217
2385.0000 -174.77640 -166.06241 8.71399 2.65034 -166.53062 867.65630
2390.0000 -173.63924 -165.28094 8.35830 2.67237 -166.14938 872.28414
2395.0000 -175.35387 -167.02984 8.32402 2.66415 -166.29149 904.85673
2400.0000 -172.67826 -164.81675 7.86150 2.64281 -166.66084 863.05800
2405.0000 -175.14911 -166.05168 9.09743 2.73480 -165.06891 951.02691
2410.0000 -174.22581 -166.77530 7.45051 2.63980 -166.71295 870.44696
2415.0000 -175.97265 -166.84237 9.13028 2.62917 -166.89697 863.15136
2420.0000 -173.09595 -164.61484 8.48111 2.70261 -165.62602 897.65723
2425.0000 -173.91896 -165.28329 8.63567 2.71230 -165.45820 880.52217
2430.0000 -175.03336 -166.68383 8.34953 2.63107 -166.86407 857.31205
2435.0000 -174.66749 -166.81895 7.84854 2.65761 -166.40476 873.02287
2440.0000 -174.39290 -167.88794 6.50496 2.59667 -167.45942 810.63561
2445.0000 -175.08296 -168.14737 6.93559 2.60683 -167.28354 872.86459
2450.0000 -175.45223 -166.06446 9.38777 2.61385 -167.16219 870.14777
2455.0000 -175.54215 -167.42006 8.12208 2.65549 -166.44144 898.72715
2460.0000 -173.13216 -164.53218 8.59998 2.65201 -166.50163 898.80384
2465.0000 -175.14613 -168.01201 7.13412 2.62907 -166.89867 857.54251
2470.0000 -175.83227 -167.41905 8.41322 2.58369 -167.68402 843.52563
2475.0000 -176.31142 -168.54107 7.77035 2.55641 -168.15615 825.28452
2480.0000 -175.49482 -169.35202 6.14280 2.48401 -169.40932 779.01068
2485.0000 -175.36292 -167.40662 7.95631 2.57314 -167.86669 822.37617
2490.0000 -174.93653 -167.08103 7.85549 2.60613 -167.29573 850.58953
2495.0000 -173.06546 -165.57540 7.49006 2.69756 -165.71341 888.09182
2500.0000 -173.98477 -165.66167 8.32310 2.73543 -165.05788 916.47908
FREEZING PROCESS: loop number 11 T-loop= 851.00000000000000
main_MD> interactions number 11 at Temperature= 851.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.06503 -1.93456 3.65708
force_rgl> df(natom) -2.67287 1.47624 3.96752
2505.0000 -175.60373 -167.39450 8.20923 2.61659 -167.11473 856.95419
2510.0000 -175.87449 -168.10017 7.77432 2.60181 -167.37043 831.00664
2515.0000 -172.83561 -166.40283 6.43278 2.59491 -167.48994 832.99149
2520.0000 -176.39712 -167.90499 8.49213 2.60991 -167.23034 842.34757
2525.0000 -177.15258 -169.96845 7.18413 2.50284 -169.08328 776.44084
2530.0000 -176.34618 -169.57805 6.76813 2.43935 -170.18214 735.92118
2535.0000 -174.61627 -168.18409 6.43218 2.50871 -168.98177 792.69419
2540.0000 -176.15429 -167.15044 9.00385 2.61284 -167.17960 832.91032
2545.0000 -175.31219 -167.24154 8.07065 2.61081 -167.21476 853.98278
2550.0000 -173.87501 -166.26706 7.60795 2.64416 -166.63757 852.80972
2555.0000 -174.45618 -166.93079 7.52539 2.60501 -167.31509 867.02070
2560.0000 -176.20565 -169.00153 7.20412 2.57967 -167.75367 842.63873
2565.0000 -176.54835 -169.19711 7.35123 2.49250 -169.26228 768.44210
2570.0000 -175.23618 -166.71493 8.52125 2.62626 -166.94739 875.76698
2575.0000 -174.80729 -166.37405 8.43324 2.64721 -166.58481 872.55244
2580.0000 -173.45357 -166.33697 7.11660 2.64415 -166.63764 828.99563
2585.0000 -175.08381 -165.85335 9.23046 2.67136 -166.16685 894.62959
2590.0000 -175.06667 -166.64062 8.42605 2.69779 -165.70936 906.87554
2595.0000 -175.28112 -167.33927 7.94185 2.61726 -167.10311 843.39805
2600.0000 -174.76342 -166.30331 8.46011 2.65265 -166.49063 857.04674
2605.0000 -176.01715 -169.37232 6.64483 2.59075 -167.56189 819.05757
2610.0000 -176.58926 -169.39216 7.19710 2.51091 -168.94368 785.46448
2615.0000 -175.60968 -167.61362 7.99606 2.53072 -168.60089 795.64581
2620.0000 -174.87269 -166.94133 7.93136 2.60281 -167.35310 862.63311
2625.0000 -174.02258 -165.83980 8.18278 2.65317 -166.48151 899.56483
2630.0000 -174.98067 -166.23062 8.75005 2.64712 -166.58637 890.06013
2635.0000 -176.15014 -165.68445 10.46569 2.69961 -165.67785 914.40379
2640.0000 -175.23921 -168.31682 6.92239 2.61706 -167.10662 855.93872
2645.0000 -174.84954 -167.15221 7.69733 2.52492 -168.70114 802.70804
2650.0000 -173.81964 -166.05924 7.76040 2.63725 -166.75708 861.23123
2655.0000 -174.35394 -166.37890 7.97504 2.67685 -166.07170 900.07262
2660.0000 -176.49101 -168.61438 7.87663 2.61000 -167.22867 858.12012
2665.0000 -176.20372 -167.82260 8.38112 2.55102 -168.24959 804.72419
2670.0000 -174.83051 -168.05532 6.77518 2.60694 -167.28165 865.32893
2675.0000 -175.05324 -166.67452 8.37872 2.63063 -166.87163 875.25917
2680.0000 -175.93652 -168.46053 7.47598 2.62103 -167.03785 852.62248
2685.0000 -173.76593 -166.59104 7.17489 2.61360 -167.16641 845.75463
2690.0000 -173.54356 -165.99185 7.55171 2.70712 -165.54782 894.40972
2695.0000 -173.63050 -164.90006 8.73044 2.72704 -165.20319 952.41947
2700.0000 -173.51128 -165.46649 8.04479 2.73041 -165.14481 907.15838
2705.0000 -175.27236 -165.62304 9.64931 2.72065 -165.31380 931.51820
2710.0000 -173.68204 -166.31466 7.36738 2.69855 -165.69627 875.79041
2715.0000 -174.53165 -166.26938 8.26226 2.64743 -166.58100 833.31357
2720.0000 -175.72726 -166.69036 9.03690 2.65270 -166.48971 874.87496
2725.0000 -175.41488 -167.12444 8.29044 2.59494 -167.48941 811.95076
2730.0000 -174.30573 -164.25043 10.05531 2.71958 -165.33219 907.78590
2735.0000 -174.36648 -166.47092 7.89556 2.74010 -164.97704 927.17814
2740.0000 -174.72116 -166.98154 7.73962 2.66510 -166.27514 870.20785
2745.0000 -173.26816 -165.47889 7.78927 2.65212 -166.49979 863.00308
2750.0000 -176.38807 -168.47657 7.91150 2.63514 -166.79364 862.98481
FREEZING PROCESS: loop number 12 T-loop= 826.00000000000000
main_MD> interactions number 12 at Temperature= 826.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.42052 -3.42665 -3.17663
force_rgl> df(natom) -2.36096 -1.26578 1.87627
2755.0000 -175.93660 -168.76686 7.16974 2.52028 -168.78146 821.83476
2760.0000 -176.49740 -168.17370 8.32370 2.49242 -169.26376 763.75342
2765.0000 -176.81795 -169.27767 7.54028 2.51799 -168.82111 811.90125
2770.0000 -175.35469 -168.15976 7.19493 2.56049 -168.08557 824.91103
2775.0000 -176.14292 -168.20122 7.94169 2.53202 -168.57842 779.06832
2780.0000 -176.24555 -168.29479 7.95076 2.54483 -168.35666 825.85519
2785.0000 -176.25290 -168.97149 7.28140 2.57259 -167.87626 837.44822
2790.0000 -178.12914 -170.95532 7.17382 2.47072 -169.63920 753.67482
2795.0000 -175.95748 -168.75469 7.20278 2.50882 -168.97981 798.07650
2800.0000 -175.71367 -167.68512 8.02855 2.53791 -168.47637 793.91789
2805.0000 -175.91739 -168.78579 7.13160 2.58076 -167.73478 791.82982
2810.0000 -174.08383 -166.87785 7.20597 2.61537 -167.13575 832.44262
2815.0000 -175.13982 -167.55763 7.58219 2.61864 -167.07917 848.30747
2820.0000 -174.03357 -166.96233 7.07124 2.60330 -167.34478 862.34691
2825.0000 -175.79667 -168.80795 6.98872 2.55943 -168.10402 808.25656
2830.0000 -176.42387 -169.48552 6.93835 2.48791 -169.34183 757.24933
2835.0000 -177.52934 -169.73706 7.79228 2.45331 -169.94053 785.35243
2840.0000 -176.07878 -168.48925 7.58953 2.47544 -169.55766 772.04460
2845.0000 -176.41361 -169.20941 7.20419 2.52476 -168.70396 806.05943
2850.0000 -176.21183 -166.93705 9.27479 2.56269 -168.04748 796.00090
2855.0000 -176.06204 -167.79103 8.27101 2.59551 -167.47949 844.74567
2860.0000 -175.54728 -168.14747 7.39981 2.55637 -168.15689 801.27201
2865.0000 -174.94363 -167.72902 7.21461 2.57789 -167.78455 818.04113
2870.0000 -176.17734 -167.27023 8.90711 2.61731 -167.10223 853.03670
2875.0000 -175.77771 -167.68325 8.09446 2.59755 -167.44426 816.21181
2880.0000 -173.87857 -165.74142 8.13715 2.66345 -166.30362 883.94090
2885.0000 -174.90995 -167.07931 7.83064 2.61938 -167.06634 863.76239
2890.0000 -174.42120 -165.27935 9.14185 2.72427 -165.25107 951.21267
2895.0000 -174.36802 -165.81692 8.55109 2.69924 -165.68432 900.25539
2900.0000 -176.80882 -169.77090 7.03792 2.56151 -168.06800 827.66941
2905.0000 -174.64632 -166.69113 7.95519 2.52148 -168.76084 773.48364
2910.0000 -173.92609 -165.12208 8.80401 2.74763 -164.84680 936.18334
2915.0000 -174.58431 -166.43807 8.14623 2.68066 -166.00576 880.05301
2920.0000 -175.01683 -168.01995 6.99689 2.62181 -167.02443 865.83369
2925.0000 -176.04463 -169.25338 6.79125 2.49134 -169.28245 746.80866
2930.0000 -175.96926 -168.52427 7.44499 2.45275 -169.95026 718.21541
2935.0000 -176.38806 -169.28082 7.10723 2.50546 -169.03805 785.06379
2940.0000 -175.94782 -168.21195 7.73587 2.48255 -169.43448 761.37913
2945.0000 -175.06828 -166.92894 8.13934 2.56900 -167.93827 841.72341
2950.0000 -175.57239 -167.94344 7.62895 2.58445 -167.67102 842.14123
2955.0000 -175.18357 -168.49738 6.68620 2.51711 -168.83642 801.59473
2960.0000 -176.19338 -169.16142 7.03196 2.57867 -167.77090 833.41765
2965.0000 -176.79669 -169.22346 7.57323 2.51503 -168.87239 794.97249
2970.0000 -176.92662 -169.04007 7.88655 2.49238 -169.26436 758.84208
2975.0000 -176.27734 -166.25061 10.02673 2.53498 -168.52719 822.08679
2980.0000 -172.93117 -164.84992 8.08124 2.71144 -165.47308 905.79306
2985.0000 -174.22961 -167.49046 6.73916 2.65290 -166.48631 874.62613
2990.0000 -174.75841 -167.12596 7.63245 2.60814 -167.26095 840.71189
2995.0000 -174.02711 -167.51157 6.51554 2.62911 -166.89799 861.16488
3000.0000 -175.96826 -167.83148 8.13678 2.53899 -168.45773 782.76946
FREEZING PROCESS: loop number 13 T-loop= 801.00000000000000
main_MD> interactions number 13 at Temperature= 801.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.76493 -3.32560 1.61475
force_rgl> df(natom) -1.53728 1.15601 0.56598
3005.0000 -175.59020 -167.88719 7.70301 2.55867 -168.11713 779.47852
3010.0000 -175.47447 -167.82326 7.65121 2.60152 -167.37550 874.72625
3015.0000 -174.74457 -168.27268 6.47190 2.58348 -167.68765 858.59868
3020.0000 -176.29268 -168.84265 7.45002 2.50417 -169.06042 760.79788
3025.0000 -175.60891 -169.02622 6.58269 2.50399 -169.06352 787.67850
3030.0000 -175.41045 -168.32500 7.08546 2.51813 -168.81874 797.14856
3035.0000 -177.16050 -170.68687 6.47364 2.48516 -169.38941 762.77961
3040.0000 -176.06161 -168.18478 7.87684 2.46253 -169.78101 744.39172
3045.0000 -176.20898 -168.71627 7.49271 2.55460 -168.18750 814.38116
3050.0000 -175.33378 -167.89731 7.43647 2.50648 -169.02029 764.72938
3055.0000 -176.14715 -168.04482 8.10233 2.62137 -167.03196 850.26021
3060.0000 -176.62647 -169.64444 6.98203 2.55893 -168.11261 799.07851
3065.0000 -177.85375 -170.70108 7.15267 2.39998 -170.86357 711.47771
3070.0000 -176.36819 -169.69501 6.67318 2.47503 -169.56463 799.92175
3075.0000 -176.21613 -168.60851 7.60762 2.50414 -169.06088 780.67348
3080.0000 -174.05375 -166.40740 7.64635 2.58384 -167.68157 818.98337
3085.0000 -172.92802 -164.49974 8.42828 2.72088 -165.30977 892.47813
3090.0000 -176.29328 -168.13313 8.16015 2.65857 -166.38812 887.07771
3095.0000 -175.94712 -169.20862 6.73849 2.49981 -169.13576 797.19119
3100.0000 -177.22535 -170.16775 7.05759 2.44099 -170.15372 724.49907
3105.0000 -175.81063 -167.61290 8.19772 2.51985 -168.78892 791.43360
3110.0000 -175.75711 -168.24753 7.50958 2.55643 -168.15580 810.28856
3115.0000 -174.92020 -168.93510 5.98510 2.53710 -168.49039 805.09905
3120.0000 -176.04529 -167.80125 8.24404 2.52637 -168.67616 786.13874
3125.0000 -174.81239 -168.21086 6.60153 2.57938 -167.75868 829.36018
3130.0000 -175.29217 -168.42012 6.87205 2.53225 -168.57436 778.53695
3135.0000 -176.78057 -169.38711 7.39346 2.48790 -169.34196 763.23687
3140.0000 -176.01424 -167.79828 8.21595 2.51425 -168.88589 804.26275
3145.0000 -177.59093 -169.41880 8.17212 2.53745 -168.48444 794.71045
3150.0000 -175.68147 -168.27604 7.40543 2.47317 -169.59678 747.74091
3155.0000 -177.02417 -170.24813 6.77604 2.47975 -169.48300 779.22356
3160.0000 -175.88405 -169.53655 6.34749 2.47936 -169.48973 754.59277
3165.0000 -175.20688 -167.75289 7.45399 2.54460 -168.36071 805.18958
3170.0000 -174.83878 -166.60185 8.23693 2.63299 -166.83091 869.26946
3175.0000 -176.03912 -168.01689 8.02222 2.65040 -166.52953 900.45417
3180.0000 -176.70506 -169.06962 7.63544 2.52973 -168.61793 783.57312
3185.0000 -176.90401 -170.15038 6.75363 2.50755 -169.00184 762.35847
3190.0000 -176.69453 -169.56216 7.13238 2.47005 -169.65088 763.34359
3195.0000 -176.29383 -169.71932 6.57450 2.44309 -170.11744 721.57942
3200.0000 -176.37678 -169.31277 7.06401 2.49066 -169.29411 766.55666
3205.0000 -176.80921 -169.83502 6.97419 2.48199 -169.44423 788.04428
3210.0000 -177.69309 -170.27338 7.41971 2.44198 -170.13670 734.40315
3215.0000 -176.97807 -170.27794 6.70014 2.47283 -169.60266 766.72601
3220.0000 -176.88762 -168.37808 8.50954 2.52428 -168.71226 791.79783
3225.0000 -175.80069 -168.04303 7.75766 2.54261 -168.39503 810.90483
3230.0000 -175.46393 -167.94367 7.52026 2.57639 -167.81046 831.20310
3235.0000 -177.36384 -169.94738 7.41646 2.47590 -169.54968 770.30693
3240.0000 -176.46308 -169.78685 6.67623 2.46140 -169.80049 748.17146
3245.0000 -176.86620 -168.18064 8.68556 2.50389 -169.06525 794.67554
3250.0000 -176.35556 -169.29611 7.05945 2.51673 -168.84305 791.94060
FREEZING PROCESS: loop number 14 T-loop= 776.00000000000000
main_MD> interactions number 14 at Temperature= 776.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 9.11059 -7.60711 1.57061
force_rgl> df(natom) -0.18855 -1.01786 3.39949
3255.0000 -177.09499 -169.78874 7.30625 2.46209 -169.78859 736.54400
3260.0000 -176.78766 -170.22257 6.56509 2.43013 -170.34181 723.46836
3265.0000 -175.56560 -169.13876 6.42684 2.46302 -169.77249 744.30000
3270.0000 -175.69242 -170.17590 5.51652 2.47193 -169.61828 737.92980
3275.0000 -176.43520 -170.52830 5.90691 2.41551 -170.59486 717.78547
3280.0000 -176.38602 -169.24563 7.14040 2.46247 -169.78197 739.94951
3285.0000 -177.22805 -168.71445 8.51360 2.49247 -169.26280 737.37024
3290.0000 -175.87062 -168.82394 7.04668 2.54629 -168.33131 806.60060
3295.0000 -175.94754 -168.80917 7.13837 2.48945 -169.31513 748.87841
3300.0000 -177.11883 -169.71547 7.40336 2.50682 -169.01441 768.04464
3305.0000 -177.81132 -169.86957 7.94175 2.48102 -169.46096 774.41435
3310.0000 -176.17470 -169.13733 7.03738 2.48353 -169.41748 769.44439
3315.0000 -177.32818 -168.48436 8.84382 2.50646 -169.02070 790.39010
3320.0000 -177.11124 -170.32721 6.78403 2.50602 -169.02839 795.33383
3325.0000 -175.85498 -168.69857 7.15640 2.50226 -169.09343 774.96239
3330.0000 -176.50909 -170.34502 6.16407 2.47750 -169.52191 741.86456
3335.0000 -177.31456 -169.54500 7.76956 2.45613 -169.89173 739.79553
3340.0000 -177.38136 -170.66770 6.71366 2.48755 -169.34793 777.86769
3345.0000 -176.18350 -169.64362 6.53988 2.46195 -169.79101 766.70916
3350.0000 -175.03883 -168.08717 6.95166 2.54045 -168.43241 807.55121
3355.0000 -176.39872 -169.45805 6.94066 2.56756 -167.96331 796.61046
3360.0000 -177.03194 -170.91993 6.11200 2.44691 -170.05141 743.03057
3365.0000 -177.59971 -171.48966 6.11005 2.36779 -171.42064 705.88420
3370.0000 -176.28208 -169.83778 6.44430 2.39820 -170.89432 729.50506
3375.0000 -177.77203 -171.89015 5.88188 2.36178 -171.52465 700.17767
3380.0000 -177.70565 -170.92990 6.77575 2.35237 -171.68756 691.46952
3385.0000 -176.66482 -168.71191 7.95291 2.44034 -170.16511 746.96299
3390.0000 -177.94304 -171.08101 6.86203 2.42632 -170.40764 748.77447
3395.0000 -177.01396 -170.89930 6.11465 2.37091 -171.36669 700.55897
3400.0000 -177.50942 -169.59995 7.90947 2.42009 -170.51551 719.05012
3405.0000 -177.15628 -168.82365 8.33262 2.50298 -169.08096 793.66458
3410.0000 -177.69782 -171.01667 6.68115 2.44136 -170.14735 746.46584
3415.0000 -177.53485 -170.46033 7.07452 2.40257 -170.81874 713.76246
3420.0000 -178.10003 -169.76412 8.33592 2.44996 -169.99862 738.28618
3425.0000 -176.95672 -170.24091 6.71581 2.41649 -170.57786 728.22109
3430.0000 -176.94410 -170.76608 6.17802 2.45456 -169.91889 751.26845
3435.0000 -176.21229 -169.28670 6.92558 2.45840 -169.85254 744.97745
3440.0000 -177.40015 -170.17934 7.22081 2.44770 -170.03766 751.22902
3445.0000 -177.76253 -170.15285 7.60968 2.43368 -170.28024 720.99207
3450.0000 -178.48310 -170.85444 7.62866 2.39010 -171.03447 733.24123
3455.0000 -178.22807 -171.34456 6.88351 2.38106 -171.19107 699.76059
3460.0000 -177.04281 -169.61205 7.43076 2.42320 -170.46176 732.89698
3465.0000 -176.04652 -169.80032 6.24620 2.45472 -169.91612 716.55804
3470.0000 -177.74700 -169.62307 8.12393 2.49757 -169.17464 765.70987
3475.0000 -176.19141 -168.53625 7.65516 2.53980 -168.44378 786.67158
3480.0000 -176.78927 -171.13864 5.65063 2.45113 -169.97838 747.41315
3485.0000 -177.32397 -169.84344 7.48053 2.41950 -170.52575 727.80411
3490.0000 -175.74996 -169.44864 6.30132 2.45295 -169.94682 718.42744
3495.0000 -175.73060 -169.50317 6.22742 2.45040 -169.99098 757.15239
3500.0000 -174.74882 -168.41394 6.33488 2.51944 -168.79612 779.10919
FREEZING PROCESS: loop number 15 T-loop= 751.00000000000000
main_MD> interactions number 15 at Temperature= 751.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.60490 -3.03237 -1.02170
force_rgl> df(natom) -3.13678 -1.02540 0.15273
3505.0000 -176.90325 -169.19801 7.70524 2.53166 -168.58460 775.80626
3510.0000 -176.16996 -168.01909 8.15086 2.48500 -169.39209 762.35489
3515.0000 -177.24502 -170.26537 6.97965 2.50198 -169.09818 791.44678
3520.0000 -178.17500 -170.63084 7.54416 2.40836 -170.71846 719.66804
3525.0000 -176.07019 -169.38318 6.68701 2.42595 -170.41405 743.91536
3530.0000 -177.33805 -170.00210 7.33595 2.50498 -169.04626 766.04041
3535.0000 -177.41075 -171.23243 6.17832 2.38976 -171.04050 706.95272
3540.0000 -176.57590 -170.64227 5.93364 2.39549 -170.94134 699.80547
3545.0000 -177.65276 -170.15987 7.49289 2.44804 -170.03171 737.63075
3550.0000 -178.80500 -172.12973 6.67528 2.38092 -171.19335 724.55791
3555.0000 -177.14302 -170.94455 6.19846 2.37510 -171.29415 712.19771
3560.0000 -176.38868 -169.93418 6.45449 2.47534 -169.55925 763.10837
3565.0000 -175.31982 -168.72916 6.59066 2.48802 -169.33989 761.11191
3570.0000 -177.03498 -168.78097 8.25400 2.52941 -168.62345 791.83069
3575.0000 -175.81028 -168.67559 7.13469 2.49470 -169.22431 782.49138
3580.0000 -176.45935 -169.72711 6.73224 2.48241 -169.43700 737.62215
3585.0000 -177.02997 -169.99326 7.03670 2.48651 -169.36590 780.54958
3590.0000 -176.16683 -169.34954 6.81729 2.44452 -170.09262 729.09669
3595.0000 -178.18234 -171.16882 7.01352 2.41180 -170.65891 744.83004
3600.0000 -177.22360 -169.46629 7.75731 2.42726 -170.39150 758.88983
3605.0000 -177.74466 -170.36860 7.37606 2.49076 -169.29250 785.46150
3610.0000 -177.63242 -170.42386 7.20856 2.46416 -169.75286 767.71936
3615.0000 -179.02846 -172.60949 6.41897 2.38743 -171.08068 707.78150
3620.0000 -177.74091 -170.47922 7.26170 2.36036 -171.54922 674.17954
3625.0000 -176.34122 -169.29541 7.04581 2.44766 -170.03829 736.98235
3630.0000 -176.18162 -170.10523 6.07639 2.50307 -169.07936 780.83012
3635.0000 -176.35301 -168.60708 7.74593 2.51862 -168.81022 815.13161
3640.0000 -175.14844 -167.50433 7.64410 2.58926 -167.58769 863.40781
3645.0000 -175.03739 -168.12642 6.91097 2.57199 -167.88659 827.76324
3650.0000 -175.43866 -168.68881 6.74984 2.50534 -169.04003 772.91850
3655.0000 -175.65180 -168.38338 7.26842 2.52086 -168.77147 781.58175
3660.0000 -176.08126 -167.91970 8.16156 2.54082 -168.42599 807.69079
3665.0000 -175.83314 -167.94552 7.88762 2.59742 -167.44652 821.22053
3670.0000 -174.34894 -167.79602 6.55292 2.56452 -168.01582 806.87642
3675.0000 -176.33394 -169.54643 6.78751 2.55091 -168.25149 807.49452
3680.0000 -177.32536 -170.62477 6.70059 2.44907 -170.01388 744.23658
3685.0000 -176.04412 -170.65215 5.39197 2.42660 -170.40278 719.44520
3690.0000 -176.08580 -169.41643 6.66937 2.44515 -170.08187 743.22573
3695.0000 -175.78702 -168.73533 7.05168 2.50719 -169.00810 754.20001
3700.0000 -175.91261 -168.10885 7.80376 2.52926 -168.62618 776.23720
3705.0000 -176.09760 -169.08704 7.01056 2.51015 -168.95677 791.20468
3710.0000 -177.19803 -170.83769 6.36034 2.44803 -170.03192 765.92723
3715.0000 -176.30202 -168.62735 7.67467 2.47520 -169.56180 747.67769
3720.0000 -177.24599 -169.06620 8.17979 2.49521 -169.21539 786.54623
3725.0000 -178.67277 -171.34323 7.32954 2.41214 -170.65316 740.46986
3730.0000 -178.75711 -172.44691 6.31021 2.35038 -171.72190 689.57424
3735.0000 -178.50016 -172.14936 6.35080 2.31927 -172.26036 654.62582
3740.0000 -176.37601 -170.34748 6.02853 2.37282 -171.33362 659.54417
3745.0000 -178.06621 -171.58200 6.48420 2.41205 -170.65468 728.91667
3750.0000 -176.17188 -170.59564 5.57624 2.39778 -170.90158 723.42587
FREEZING PROCESS: loop number 16 T-loop= 726.00000000000000
main_MD> interactions number 16 at Temperature= 726.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.07079 -2.80505 -2.92253
force_rgl> df(natom) -0.14161 4.83172 -2.65645
3755.0000 -177.81423 -171.18928 6.62495 2.39083 -171.02183 713.37263
3760.0000 -177.72255 -171.96944 5.75311 2.36786 -171.41952 696.15305
3765.0000 -177.25551 -169.86771 7.38780 2.36160 -171.52775 692.30314
3770.0000 -176.15970 -169.30357 6.85613 2.45819 -169.85613 756.04078
3775.0000 -178.72239 -170.98781 7.73457 2.41029 -170.68515 743.28861
3780.0000 -176.01010 -169.79517 6.21493 2.42013 -170.51488 734.84262
3785.0000 -177.66853 -171.01075 6.65777 2.39377 -170.97111 707.31218
3790.0000 -177.17415 -168.98030 8.19384 2.46211 -169.78830 749.84473
3795.0000 -176.10527 -169.36001 6.74526 2.48610 -169.37311 734.64788
3800.0000 -176.66921 -170.63753 6.03168 2.42992 -170.34532 696.05478
3805.0000 -177.70777 -170.65036 7.05741 2.38363 -171.14652 669.60644
3810.0000 -177.51606 -170.83484 6.68122 2.40003 -170.86276 719.53481
3815.0000 -177.64052 -171.18315 6.45737 2.37073 -171.36970 693.51125
3820.0000 -176.58758 -168.51465 8.07293 2.45325 -169.94166 745.00282
3825.0000 -176.19384 -169.41674 6.77709 2.51380 -168.89363 787.69611
3830.0000 -175.64214 -169.16301 6.47912 2.49675 -169.18882 768.84586
3835.0000 -175.79146 -168.46026 7.33120 2.54548 -168.34541 789.20458
3840.0000 -177.18093 -171.25023 5.93070 2.47105 -169.63363 748.20477
3845.0000 -176.20829 -169.30419 6.90410 2.41837 -170.54532 716.17530
3850.0000 -176.91086 -169.97931 6.93155 2.49451 -169.22748 766.61318
3855.0000 -176.33853 -169.73003 6.60851 2.46942 -169.66169 744.53397
3860.0000 -176.68764 -169.70734 6.98030 2.49761 -169.17388 751.58277
3865.0000 -176.33385 -169.52526 6.80858 2.45279 -169.94966 720.68961
3870.0000 -177.43688 -170.34535 7.09153 2.47379 -169.58612 773.80999
3875.0000 -177.34561 -170.87725 6.46836 2.45293 -169.94711 738.08911
3880.0000 -176.39715 -169.13466 7.26249 2.44263 -170.12539 739.48205
3885.0000 -177.12833 -169.09999 8.02834 2.49082 -169.29145 780.49999
3890.0000 -177.34514 -170.18136 7.16378 2.50591 -169.03028 782.97034
3895.0000 -177.33686 -169.50354 7.83333 2.43680 -170.22634 737.68424
3900.0000 -177.61102 -170.75410 6.85692 2.43420 -170.27127 739.15742
3905.0000 -176.36558 -169.30564 7.05994 2.42127 -170.49516 721.42431
3910.0000 -177.43836 -170.87060 6.56775 2.40975 -170.69449 732.65368
3915.0000 -177.88160 -171.22629 6.65531 2.37491 -171.29751 690.68403
3920.0000 -177.18175 -170.59356 6.58819 2.38481 -171.12610 706.46202
3925.0000 -179.05417 -173.12059 5.93358 2.33786 -171.93865 675.04371
3930.0000 -178.94847 -173.02500 5.92347 2.24577 -173.53244 616.97421
3935.0000 -177.68454 -170.82112 6.86342 2.31570 -172.32213 666.32751
3940.0000 -176.64164 -170.17597 6.46567 2.39577 -170.93636 717.72068
3945.0000 -177.89142 -169.36245 8.52897 2.43195 -170.31027 746.95503
3950.0000 -177.63664 -170.96214 6.67450 2.46506 -169.73717 749.03042
3955.0000 -177.27437 -171.10861 6.16576 2.40756 -170.73240 681.80956
3960.0000 -176.56450 -170.43797 6.12654 2.41317 -170.63533 692.59714
3965.0000 -177.42370 -171.03783 6.38588 2.43693 -170.22400 715.80125
3970.0000 -177.66824 -170.75963 6.90860 2.40087 -170.84823 710.61497
3975.0000 -177.67861 -170.70878 6.96983 2.38398 -171.14051 726.70439
3980.0000 -177.81134 -170.25358 7.55776 2.43746 -170.21487 758.97952
3985.0000 -177.22660 -169.97373 7.25287 2.44087 -170.15580 745.96473
3990.0000 -178.09778 -170.26021 7.83756 2.43919 -170.18495 735.72337
3995.0000 -176.45446 -169.76528 6.68918 2.46867 -169.67479 758.41707
4000.0000 -175.65437 -168.87250 6.78187 2.49410 -169.23458 750.04960
FREEZING PROCESS: loop number 17 T-loop= 701.00000000000000
main_MD> interactions number 17 at Temperature= 701.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.28449 0.43820 4.09644
force_rgl> df(natom) 1.72983 -4.30362 1.99398
4005.0000 -177.05308 -171.03182 6.02125 2.45991 -169.82637 763.53712
4010.0000 -176.72247 -169.70452 7.01795 2.45989 -169.82668 744.21306
4015.0000 -177.14565 -170.43869 6.70697 2.44070 -170.15887 722.17839
4020.0000 -177.22158 -169.33538 7.88619 2.42872 -170.36619 702.76789
4025.0000 -176.70152 -170.22965 6.47187 2.47827 -169.50859 756.64931
4030.0000 -176.57988 -169.56684 7.01304 2.44589 -170.06897 709.81958
4035.0000 -176.23800 -169.65978 6.57822 2.49501 -169.21883 744.37289
4040.0000 -177.40757 -171.14658 6.26099 2.40374 -170.79847 703.47496
4045.0000 -178.10361 -171.23170 6.87190 2.40929 -170.70248 720.73795
4050.0000 -176.94819 -170.50575 6.44244 2.41446 -170.61293 702.39666
4055.0000 -178.94404 -172.26406 6.67998 2.36119 -171.53482 666.91821
4060.0000 -179.09462 -172.44010 6.65453 2.31383 -172.35455 645.81507
4065.0000 -178.27013 -172.09624 6.17389 2.31493 -172.33554 640.53109
4070.0000 -177.90647 -171.36555 6.54092 2.32249 -172.20475 666.14743
4075.0000 -177.52370 -172.02958 5.49412 2.33824 -171.93208 675.12160
4080.0000 -178.19362 -172.79278 5.40084 2.32487 -172.16347 664.46591
4085.0000 -178.87076 -171.93359 6.93717 2.33776 -171.94048 667.52866
4090.0000 -178.53489 -171.93973 6.59517 2.35084 -171.71402 669.93607
4095.0000 -176.51655 -170.56515 5.95140 2.40186 -170.83102 718.84344
4100.0000 -178.70050 -170.41248 8.28803 2.39758 -170.90507 712.65747
4105.0000 -178.22302 -170.43736 7.78566 2.38708 -171.08686 712.75683
4110.0000 -176.10494 -170.12786 5.97709 2.42840 -170.37167 715.43586
4115.0000 -177.29066 -170.90524 6.38542 2.44146 -170.14572 728.37709
4120.0000 -176.66268 -170.04539 6.61729 2.40839 -170.71794 691.21552
4125.0000 -177.55890 -171.71911 5.83979 2.42067 -170.50548 712.01652
4130.0000 -178.87316 -171.72555 7.14762 2.34001 -171.90143 658.21430
4135.0000 -178.44668 -172.00927 6.43740 2.36543 -171.46150 703.12703
4140.0000 -178.38997 -171.23271 7.15726 2.34541 -171.80800 677.14221
4145.0000 -178.16876 -171.81993 6.34883 2.35460 -171.64900 702.16891
4150.0000 -177.79697 -171.68936 6.10761 2.36043 -171.54803 682.61292
4155.0000 -177.22817 -171.10881 6.11936 2.38737 -171.08184 708.19609
4160.0000 -179.05537 -172.46696 6.58842 2.35348 -171.66835 705.18725
4165.0000 -177.39409 -170.34060 7.05348 2.35508 -171.64063 716.31514
4170.0000 -176.89166 -170.48990 6.40176 2.41347 -170.63016 757.67627
4175.0000 -178.32488 -171.91023 6.41465 2.36670 -171.43959 690.22368
4180.0000 -178.23936 -171.20679 7.03257 2.37012 -171.38028 694.00889
4185.0000 -177.61288 -170.24845 7.36443 2.41594 -170.58737 717.11137
4190.0000 -176.64450 -168.78955 7.85495 2.46043 -169.81727 758.12725
4195.0000 -178.90985 -172.48603 6.42381 2.41327 -170.63361 745.94526
4200.0000 -179.15758 -173.49026 5.66732 2.29242 -172.72509 639.64128
4205.0000 -178.92433 -172.20535 6.71898 2.27086 -173.09820 605.98249
4210.0000 -178.65068 -172.23030 6.42037 2.29856 -172.61886 626.90228
4215.0000 -176.69674 -170.35927 6.33747 2.40287 -170.81361 700.86525
4220.0000 -177.32541 -171.11312 6.21230 2.42628 -170.40838 727.53553
4225.0000 -177.99099 -171.79339 6.19761 2.33507 -171.98690 669.16988
4230.0000 -177.27607 -169.49271 7.78336 2.44004 -170.17020 747.00457
4235.0000 -178.42647 -171.44235 6.98412 2.43084 -170.32941 713.46237
4240.0000 -178.09281 -172.03764 6.05518 2.34581 -171.80113 674.41352
4245.0000 -179.08232 -173.07428 6.00804 2.29902 -172.61087 647.42648
4250.0000 -177.13608 -170.03900 7.09708 2.34300 -171.84967 675.40215
FREEZING PROCESS: loop number 18 T-loop= 676.00000000000000
main_MD> interactions number 18 at Temperature= 676.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.77216 -0.52006 0.22161
force_rgl> df(natom) 2.32641 -1.06882 -0.42669
4255.0000 -176.93709 -170.13992 6.79717 2.42951 -170.35248 728.98320
4260.0000 -178.61538 -172.88536 5.73002 2.37129 -171.36010 700.44617
4265.0000 -179.34866 -174.45151 4.89715 2.25455 -173.38053 617.26702
4270.0000 -179.47603 -173.00458 6.47145 2.26701 -173.16487 627.57398
4275.0000 -178.54908 -172.47694 6.07214 2.29309 -172.71349 636.43365
4280.0000 -178.71668 -172.79163 5.92505 2.29029 -172.76191 647.32328
4285.0000 -176.46370 -170.25064 6.21306 2.36339 -171.49679 679.02584
4290.0000 -178.11527 -170.77251 7.34276 2.42183 -170.48536 718.14717
4295.0000 -179.14348 -171.17174 7.97174 2.35428 -171.65457 683.91920
4300.0000 -179.38940 -172.08893 7.30048 2.34031 -171.89624 675.31065
4305.0000 -178.07048 -171.36120 6.70928 2.31266 -172.37483 639.95385
4310.0000 -178.03804 -172.41614 5.62190 2.34840 -171.75630 675.66709
4315.0000 -178.42565 -172.00958 6.41607 2.29573 -172.66779 656.88010
4320.0000 -176.88161 -170.41153 6.47008 2.36979 -171.38607 685.02900
4325.0000 -178.73054 -172.67097 6.05957 2.36887 -171.40196 678.45988
4330.0000 -178.25182 -173.03952 5.21229 2.28308 -172.88673 638.05944
4335.0000 -179.38666 -173.10047 6.28619 2.32467 -172.16702 663.39204
4340.0000 -177.98596 -171.44657 6.53939 2.28221 -172.90179 626.88756
4345.0000 -178.24944 -171.72919 6.52024 2.38482 -171.12594 697.08156
4350.0000 -177.27438 -171.22141 6.05298 2.33624 -171.96663 688.79934
4355.0000 -179.15429 -172.19613 6.95816 2.33974 -171.90606 696.11285
4360.0000 -179.03933 -172.67428 6.36505 2.27765 -172.98074 640.62194
4365.0000 -179.70847 -173.18875 6.51972 2.23921 -173.64606 611.07906
4370.0000 -178.24728 -172.96480 5.28249 2.24209 -173.59614 612.90171
4375.0000 -178.56210 -173.08589 5.47621 2.30624 -172.48589 659.00486
4380.0000 -177.27914 -170.76549 6.51365 2.35831 -171.58466 692.53201
4385.0000 -178.55803 -172.03875 6.51929 2.37003 -171.38194 681.00481
4390.0000 -178.66590 -172.72520 5.94069 2.31847 -172.27433 660.02625
4395.0000 -177.61258 -171.12899 6.48359 2.31928 -172.26022 656.21896
4400.0000 -177.55744 -171.35382 6.20362 2.38990 -171.03798 722.77471
4405.0000 -178.82440 -171.93959 6.88481 2.36019 -171.55219 690.12034
4410.0000 -177.60281 -171.88586 5.71695 2.31683 -172.30266 675.55078
4415.0000 -177.43760 -170.78905 6.64855 2.38466 -171.12876 683.37778
4420.0000 -177.95555 -171.82209 6.13346 2.37789 -171.24589 686.38617
4425.0000 -180.18118 -173.19641 6.98477 2.29715 -172.64322 649.45691
4430.0000 -178.74712 -172.11356 6.63357 2.30093 -172.57777 656.84995
4435.0000 -177.73350 -171.65963 6.07387 2.33269 -172.02814 659.21283
4440.0000 -177.49554 -171.09776 6.39778 2.36527 -171.46421 699.76164
4445.0000 -177.89363 -171.24875 6.64489 2.36355 -171.49406 685.77608
4450.0000 -178.10788 -171.59027 6.51761 2.35391 -171.66087 671.36054
4455.0000 -176.42256 -169.24910 7.17346 2.38892 -171.05497 730.56313
4460.0000 -179.11526 -172.09582 7.01944 2.42089 -170.50164 741.29754
4465.0000 -178.26314 -172.37158 5.89156 2.34662 -171.78714 683.48070
4470.0000 -176.67848 -171.22160 5.45688 2.35901 -171.57268 674.53525
4475.0000 -177.52556 -171.68901 5.83655 2.36994 -171.38349 683.75842
4480.0000 -177.52946 -170.78239 6.74707 2.38832 -171.06540 696.94542
4485.0000 -177.83155 -171.86263 5.96893 2.33371 -172.01053 670.22398
4490.0000 -179.01502 -172.78690 6.22812 2.33235 -172.03404 674.31245
4495.0000 -180.03957 -173.74457 6.29500 2.24288 -173.58241 635.40076
4500.0000 -177.11077 -170.33741 6.77336 2.30056 -172.58416 672.45516
FREEZING PROCESS: loop number 19 T-loop= 651.00000000000000
main_MD> interactions number 19 at Temperature= 651.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.48766 4.29074 -1.32283
force_rgl> df(natom) 0.52729 -1.69106 0.01278
4505.0000 -178.48417 -172.33220 6.15198 2.37612 -171.27645 700.51276
4510.0000 -178.88709 -172.90072 5.98637 2.29925 -172.60691 631.88973
4515.0000 -177.75386 -171.92262 5.83124 2.30437 -172.51833 622.84305
4520.0000 -177.33465 -171.91426 5.42039 2.30608 -172.48864 612.83693
4525.0000 -179.25230 -172.94260 6.30970 2.31240 -172.37930 638.82373
4530.0000 -178.32940 -171.68707 6.64232 2.32161 -172.21983 654.29686
4535.0000 -177.80871 -172.13574 5.67297 2.34968 -171.73418 686.61497
4540.0000 -177.70257 -171.66171 6.04086 2.29189 -172.73427 634.10009
4545.0000 -178.47020 -172.44177 6.02843 2.31752 -172.29068 665.33689
4550.0000 -179.36831 -173.74273 5.62557 2.28876 -172.78839 614.81671
4555.0000 -178.32415 -173.09891 5.22524 2.25214 -173.42230 608.97751
4560.0000 -179.07667 -173.17922 5.89745 2.22672 -173.86211 605.64667
4565.0000 -180.19971 -174.74615 5.45356 2.19522 -174.40741 593.53194
4570.0000 -178.53536 -173.06780 5.46755 2.24698 -173.51161 616.57846
4575.0000 -178.73177 -172.08470 6.64708 2.27925 -172.95310 635.01865
4580.0000 -176.89654 -170.95746 5.93908 2.32916 -172.08923 665.59856
4585.0000 -177.80440 -171.26339 6.54101 2.36547 -171.46077 658.08297
4590.0000 -177.75494 -172.38509 5.36985 2.31878 -172.26885 649.59668
4595.0000 -178.46278 -172.50971 5.95307 2.31019 -172.41755 643.72585
4600.0000 -179.26102 -173.51391 5.74711 2.25940 -173.29661 606.16228
4605.0000 -179.64110 -174.74315 4.89795 2.18348 -174.61057 551.48722
4610.0000 -178.78532 -172.87613 5.90919 2.25461 -173.37954 620.53766
4615.0000 -180.11556 -174.42294 5.69262 2.21081 -174.13754 614.05210
4620.0000 -179.29060 -173.35521 5.93539 2.21785 -174.01576 637.55526
4625.0000 -180.54861 -174.39721 6.15140 2.24072 -173.61989 624.30643
4630.0000 -179.56486 -173.64249 5.92238 2.20228 -174.28507 590.61152
4635.0000 -178.76669 -172.29385 6.47284 2.32484 -172.16394 696.99388
4640.0000 -178.73263 -172.67301 6.05962 2.31297 -172.36940 659.93271
4645.0000 -177.22013 -171.10083 6.11930 2.34301 -171.84956 682.59463
4650.0000 -177.98370 -171.80744 6.17625 2.35911 -171.57090 702.41865
4655.0000 -177.72490 -171.79233 5.93256 2.33548 -171.97985 661.87619
4660.0000 -179.46808 -173.63281 5.83528 2.31326 -172.36443 642.22813
4665.0000 -178.71247 -173.48739 5.22508 2.24913 -173.47430 634.57123
4670.0000 -179.39089 -173.42454 5.96635 2.22965 -173.81142 615.11773
4675.0000 -179.62231 -174.29595 5.32636 2.24913 -173.47437 636.78637
4680.0000 -179.71701 -173.63480 6.08221 2.22427 -173.90449 610.37001
4685.0000 -179.79172 -174.19174 5.59998 2.20808 -174.18481 603.15626
4690.0000 -179.12939 -173.95410 5.17529 2.21015 -174.14898 605.25843
4695.0000 -178.34028 -172.22902 6.11126 2.24073 -173.61962 633.69047
4700.0000 -180.13040 -174.77090 5.35951 2.25605 -173.35448 633.01412
4705.0000 -178.96857 -174.15002 4.81855 2.20502 -174.23768 583.96617
4710.0000 -179.29419 -173.20773 6.08646 2.27025 -173.10876 610.51545
4715.0000 -179.07614 -173.87173 5.20441 2.24481 -173.54903 614.46471
4720.0000 -179.29926 -173.97732 5.32193 2.20192 -174.29134 604.55178
4725.0000 -179.12840 -173.27992 5.84848 2.24199 -173.59782 617.32971
4730.0000 -179.04883 -172.81434 6.23448 2.27767 -172.98034 632.90266
4735.0000 -178.06707 -172.20116 5.86591 2.32340 -172.18898 657.74009
4740.0000 -178.66906 -171.96504 6.70402 2.33502 -171.98783 658.69733
4745.0000 -177.50365 -171.18501 6.31863 2.33858 -171.92624 694.85459
4750.0000 -179.41200 -174.01105 5.40095 2.32408 -172.17721 671.12124
FREEZING PROCESS: loop number 20 T-loop= 626.00000000000000
main_MD> interactions number 20 at Temperature= 626.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.60069 -1.59549 -1.60581
force_rgl> df(natom) -0.66333 -1.05384 -2.05257
4755.0000 -179.09540 -173.76570 5.32970 2.20311 -174.27085 568.07472
4760.0000 -178.66166 -173.44659 5.21507 2.26018 -173.28309 616.91645
4765.0000 -179.02555 -172.11086 6.91469 2.27946 -172.94944 624.63155
4770.0000 -179.11239 -173.07963 6.03276 2.28416 -172.86812 633.60290
4775.0000 -177.99967 -171.10424 6.89543 2.33350 -172.01418 663.85124
4780.0000 -178.29109 -172.08667 6.20442 2.33158 -172.04738 673.51737
4785.0000 -179.04944 -172.48345 6.56598 2.30035 -172.58792 656.11387
4790.0000 -178.93009 -172.88205 6.04804 2.29500 -172.68038 652.59391
4795.0000 -178.62077 -173.45109 5.16968 2.26893 -173.13166 624.87662
4800.0000 -178.99389 -173.65397 5.33992 2.25949 -173.29510 606.33907
4805.0000 -179.34083 -173.35289 5.98793 2.25429 -173.38505 608.58064
4810.0000 -179.14743 -173.51498 5.63245 2.28408 -172.86936 659.82072
4815.0000 -178.80582 -173.00004 5.80578 2.25129 -173.43687 601.11562
4820.0000 -178.99336 -173.30537 5.68799 2.27460 -173.03348 639.29414
4825.0000 -177.96210 -172.17130 5.79081 2.28723 -172.81487 608.46710
4830.0000 -179.21066 -173.57051 5.64015 2.33051 -172.06593 655.64181
4835.0000 -180.42255 -174.59187 5.83068 2.22502 -173.89167 620.56647
4840.0000 -179.42920 -173.74030 5.68890 2.18986 -174.50002 606.12360
4845.0000 -179.62951 -173.67329 5.95622 2.20397 -174.25599 619.22878
4850.0000 -179.86985 -173.72913 6.14073 2.25623 -173.35142 649.11412
4855.0000 -180.00855 -175.07688 4.93167 2.21274 -174.10411 616.68853
4860.0000 -180.13317 -174.99633 5.13685 2.14718 -175.23873 552.77260
4865.0000 -178.74796 -173.07861 5.66936 2.19279 -174.44947 579.93365
4870.0000 -178.81295 -173.12299 5.68996 2.29452 -172.68874 636.11316
4875.0000 -177.87138 -172.07803 5.79335 2.28585 -172.83877 610.22126
4880.0000 -178.13484 -171.88350 6.25134 2.32713 -172.12445 663.01471
4885.0000 -178.26654 -171.23980 7.02673 2.34217 -171.86401 710.35897
4890.0000 -178.53567 -172.95845 5.57722 2.27761 -172.98142 659.27644
4895.0000 -178.45458 -172.48202 5.97256 2.28327 -172.88342 651.51798
4900.0000 -179.34255 -173.78220 5.56035 2.24170 -173.60284 601.10540
4905.0000 -178.98163 -173.15218 5.82945 2.22083 -173.96419 623.41557
4910.0000 -179.81062 -175.45396 4.35666 2.20491 -174.23970 590.36127
4915.0000 -179.07143 -173.33470 5.73673 2.17845 -174.69755 562.87660
4920.0000 -179.42241 -173.88131 5.54110 2.24691 -173.51267 620.56615
4925.0000 -181.05017 -175.20825 5.84192 2.18166 -174.64203 579.21442
4930.0000 -180.70213 -174.20956 6.49257 2.17068 -174.83211 587.84212
4935.0000 -179.79077 -172.17494 7.61583 2.24882 -173.47963 636.84964
4940.0000 -179.36967 -173.50670 5.86297 2.25684 -173.34091 643.94413
4945.0000 -178.26531 -173.36650 4.89880 2.25305 -173.40649 634.26798
4950.0000 -178.37189 -173.12154 5.25035 2.25768 -173.32632 630.12501
4955.0000 -178.53558 -173.01371 5.52187 2.24520 -173.54232 614.50757
4960.0000 -178.00112 -172.70751 5.29361 2.29532 -172.67499 635.20683
4965.0000 -179.00700 -173.55728 5.44972 2.30215 -172.55668 651.34834
4970.0000 -178.74758 -173.98995 4.75763 2.21791 -174.01460 583.95507
4975.0000 -179.51566 -173.83181 5.68385 2.20267 -174.27838 569.04661
4980.0000 -178.68452 -172.74865 5.93588 2.24867 -173.48234 611.73002
4985.0000 -179.24079 -172.37792 6.86287 2.25668 -173.34358 636.81837
4990.0000 -178.01336 -172.04164 5.97172 2.28322 -172.88425 656.15401
4995.0000 -178.13604 -172.37998 5.75606 2.29648 -172.65486 668.83194
5000.0000 -177.68140 -170.76089 6.92051 2.34682 -171.78353 669.49527
FREEZING PROCESS: loop number 21 T-loop= 601.00000000000000
main_MD> interactions number 21 at Temperature= 601.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.48896 1.04585 0.80589
force_rgl> df(natom) 3.97046 0.15401 0.12007
5005.0000 -179.22363 -171.19918 8.02446 2.34582 -171.80097 684.78943
5010.0000 -179.40725 -173.69252 5.71473 2.27459 -173.03374 642.71948
5015.0000 -179.92511 -174.33945 5.58566 2.20114 -174.30482 565.28749
5020.0000 -179.35732 -173.69510 5.66222 2.25902 -173.30319 617.39572
5025.0000 -180.52104 -174.49426 6.02678 2.22009 -173.97690 584.50589
5030.0000 -179.50759 -175.20044 4.30714 2.18661 -174.55639 570.49328
5035.0000 -180.71871 -174.96993 5.74877 2.13517 -175.44662 537.19573
5040.0000 -179.92939 -175.00703 4.92235 2.16268 -174.97043 595.35892
5045.0000 -180.66412 -175.05685 5.60727 2.16571 -174.91802 613.87942
5050.0000 -179.66354 -174.97919 4.68435 2.20120 -174.30389 627.67734
5055.0000 -180.44936 -174.18017 6.26919 2.18338 -174.61231 583.31455
5060.0000 -180.21280 -174.37798 5.83482 2.18694 -174.55057 588.41111
5065.0000 -179.76213 -173.67235 6.08978 2.21375 -174.08664 599.88571
5070.0000 -178.79028 -172.88503 5.90525 2.29182 -172.73553 637.46604
5075.0000 -179.23993 -173.92656 5.31337 2.29411 -172.69587 645.54615
5080.0000 -180.34646 -174.71330 5.63315 2.18863 -174.52148 577.11902
5085.0000 -180.14046 -174.93831 5.20216 2.17633 -174.73432 568.79649
5090.0000 -180.42137 -174.86329 5.55808 2.18885 -174.51763 592.35553
5095.0000 -180.48774 -175.07466 5.41307 2.17150 -174.81790 559.77678
5100.0000 -180.04792 -175.06119 4.98673 2.15116 -175.16980 559.48423
5105.0000 -180.09483 -174.05651 6.03832 2.19315 -174.44323 567.58233
5110.0000 -179.75136 -173.73635 6.01500 2.22251 -173.93496 599.20353
5115.0000 -180.12488 -174.32440 5.80048 2.24373 -173.56781 624.04732
5120.0000 -179.88761 -174.70761 5.18000 2.19683 -174.37948 577.48156
5125.0000 -179.53074 -172.76690 6.76384 2.20872 -174.17362 574.84252
5130.0000 -179.94262 -175.27951 4.66310 2.25697 -173.33857 617.17238
5135.0000 -179.49069 -174.11629 5.37440 2.18251 -174.62740 568.39507
5140.0000 -179.23501 -174.24108 4.99393 2.20638 -174.21413 576.05072
5145.0000 -180.08481 -174.03701 6.04780 2.21648 -174.03937 595.44115
5150.0000 -179.81098 -174.01326 5.79771 2.22633 -173.86891 626.19271
5155.0000 -178.62532 -172.86862 5.75670 2.24094 -173.61613 628.10334
5160.0000 -178.66527 -174.02344 4.64183 2.27877 -172.96135 644.18552
5165.0000 -179.18220 -173.40491 5.77730 2.21471 -174.07006 583.51632
5170.0000 -179.02768 -173.45434 5.57334 2.22752 -173.84839 622.95794
5175.0000 -180.73924 -175.74409 4.99516 2.16443 -174.94025 574.37697
5180.0000 -180.47494 -175.21456 5.26039 2.13459 -175.45673 553.07008
5185.0000 -179.77978 -174.71698 5.06280 2.16369 -174.95295 543.72352
5190.0000 -179.53181 -175.11730 4.41451 2.16480 -174.93382 536.21137
5195.0000 -179.35059 -173.77765 5.57293 2.19457 -174.41860 576.03054
5200.0000 -179.90407 -174.44841 5.45567 2.19770 -174.36447 556.64151
5205.0000 -179.77793 -173.33676 6.44117 2.18458 -174.59151 590.57109
5210.0000 -179.05843 -172.97045 6.08798 2.26276 -173.23851 635.53590
5215.0000 -179.93592 -173.46465 6.47127 2.27017 -173.11020 617.65705
5220.0000 -179.02995 -173.31362 5.71633 2.24986 -173.46161 614.08802
5225.0000 -180.09546 -174.18887 5.90660 2.26835 -173.14166 628.65600
5230.0000 -179.93134 -174.47457 5.45677 2.19718 -174.37346 592.05512
5235.0000 -180.31896 -174.49674 5.82222 2.19731 -174.37119 596.12201
5240.0000 -180.23727 -173.42517 6.81210 2.24930 -173.47131 654.36321
5245.0000 -179.08261 -172.11930 6.96331 2.24235 -173.59161 611.18493
5250.0000 -178.70626 -172.95781 5.74845 2.25822 -173.31705 622.01691
FREEZING PROCESS: loop number 22 T-loop= 576.00000000000000
main_MD> interactions number 22 at Temperature= 576.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.87568 -1.41598 0.53316
force_rgl> df(natom) -0.86739 1.42713 2.26027
5255.0000 -179.97764 -174.26091 5.71672 2.23751 -173.67539 610.52597
5260.0000 -180.06666 -174.58602 5.48064 2.16445 -174.93983 547.97413
5265.0000 -178.84422 -173.97324 4.87099 2.20231 -174.28467 568.21737
5270.0000 -180.03976 -174.65146 5.38829 2.21282 -174.10274 591.15114
5275.0000 -180.38667 -175.07100 5.31567 2.16383 -174.95061 582.13426
5280.0000 -181.15818 -175.66510 5.49308 2.09843 -176.08242 527.26781
5285.0000 -181.27124 -176.22063 5.05061 2.12014 -175.70671 533.21696
5290.0000 -179.46107 -174.14911 5.31196 2.13288 -175.48620 549.49357
5295.0000 -179.29572 -174.76254 4.53318 2.18017 -174.66779 566.37635
5300.0000 -179.07042 -173.52315 5.54727 2.22062 -173.96775 579.87086
5305.0000 -179.13732 -174.22400 4.91332 2.25751 -173.32921 621.57030
5310.0000 -179.74947 -174.42325 5.32622 2.18840 -174.52533 575.98060
5315.0000 -177.62402 -172.17543 5.44859 2.25180 -173.42813 614.24203
5320.0000 -179.91061 -173.94653 5.96408 2.27205 -173.07759 635.05090
5325.0000 -178.81677 -173.78259 5.03418 2.22300 -173.92660 578.56061
5330.0000 -179.37247 -173.24424 6.12823 2.23116 -173.78527 578.26263
5335.0000 -178.49328 -172.34333 6.14995 2.24660 -173.51815 595.44679
5340.0000 -179.64053 -173.92293 5.71760 2.26687 -173.16723 615.83282
5345.0000 -179.35966 -173.86404 5.49561 2.27079 -173.09951 645.93715
5350.0000 -178.63000 -172.85401 5.77599 2.25866 -173.30934 619.11124
5355.0000 -178.82578 -173.64622 5.17957 2.27656 -172.99957 642.63737
5360.0000 -179.45830 -174.29078 5.16753 2.20222 -174.28613 586.75196
5365.0000 -179.64310 -174.01922 5.62388 2.19022 -174.49395 585.58540
5370.0000 -179.92908 -173.90435 6.02474 2.21797 -174.01358 623.25830
5375.0000 -181.52775 -175.17989 6.34786 2.17924 -174.68392 596.83627
5380.0000 -181.05579 -175.10864 5.94715 2.17995 -174.67157 587.51318
5385.0000 -180.68776 -174.76472 5.92304 2.15659 -175.07586 580.69526
5390.0000 -180.57574 -175.34077 5.23497 2.15992 -175.01832 566.45935
5395.0000 -179.30801 -174.37554 4.93246 2.17078 -174.83032 547.68906
5400.0000 -180.36730 -173.33974 7.02757 2.20963 -174.15796 602.06254
5405.0000 -179.77564 -173.96139 5.81425 2.23863 -173.65606 616.40496
5410.0000 -180.79381 -175.01880 5.77501 2.15561 -175.09288 564.69767
5415.0000 -179.81463 -174.68218 5.13245 2.16930 -174.85598 545.83192
5420.0000 -177.39547 -172.10397 5.29150 2.25431 -173.38470 597.22096
5425.0000 -178.78180 -173.35403 5.42776 2.31107 -172.40229 652.16543
5430.0000 -179.39941 -174.33200 5.06741 2.24083 -173.61791 602.63315
5435.0000 -180.48929 -174.42016 6.06912 2.18634 -174.56108 551.52848
5440.0000 -180.68348 -175.41280 5.27068 2.18486 -174.58663 581.34500
5445.0000 -180.15106 -174.65809 5.49297 2.13315 -175.48154 533.01062
5450.0000 -179.49031 -174.06164 5.42867 2.18760 -174.53927 570.42434
5455.0000 -179.64342 -173.78932 5.85410 2.21918 -173.99270 588.23120
5460.0000 -179.86441 -174.18420 5.68020 2.21206 -174.11583 583.84195
5465.0000 -180.70914 -174.99526 5.71388 2.18995 -174.49849 564.34780
5470.0000 -180.89370 -174.87404 6.01966 2.15313 -175.13586 548.39378
5475.0000 -180.10818 -175.02727 5.08092 2.14816 -175.22187 558.80518
5480.0000 -180.06849 -174.00372 6.06477 2.19998 -174.32504 580.21920
5485.0000 -181.77899 -176.01102 5.76797 2.16759 -174.88556 589.90170
5490.0000 -180.58490 -175.07325 5.51165 2.12578 -175.60913 560.93607
5495.0000 -180.81033 -175.87867 4.93166 2.13054 -175.52669 556.31478
5500.0000 -179.76739 -174.82284 4.94456 2.12408 -175.63863 544.23093
FREEZING PROCESS: loop number 23 T-loop= 551.00000000000000
main_MD> interactions number 23 at Temperature= 551.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.03648 -2.22426 0.96961
force_rgl> df(natom) -2.04531 5.70050 5.10680
5505.0000 -181.41174 -176.41747 4.99427 2.14788 -175.22659 561.90526
5510.0000 -180.93679 -176.47088 4.46591 2.08032 -176.39597 506.50353
5515.0000 -180.83801 -175.35062 5.48739 2.11625 -175.77414 523.34249
5520.0000 -180.43731 -175.00380 5.43351 2.16650 -174.90432 562.04501
5525.0000 -179.95955 -175.15280 4.80675 2.13759 -175.40471 527.84987
5530.0000 -181.21135 -175.58413 5.62723 2.11022 -175.87843 530.28609
5535.0000 -181.56438 -176.41758 5.14680 2.09133 -176.20531 540.68910
5540.0000 -181.28444 -175.45705 5.82739 2.09549 -176.13345 528.87646
5545.0000 -180.42675 -174.46401 5.96274 2.12355 -175.64775 541.00167
5550.0000 -180.27590 -175.17637 5.09953 2.17560 -174.74690 558.62305
5555.0000 -180.92134 -175.54453 5.37681 2.15262 -175.14458 545.03239
5560.0000 -178.58615 -173.08899 5.49716 2.20193 -174.29116 578.48549
5565.0000 -178.98483 -173.32911 5.65573 2.28186 -172.90790 650.26129
5570.0000 -180.91668 -175.18178 5.73489 2.20609 -174.21920 596.39510
5575.0000 -180.65246 -176.30288 4.34958 2.13163 -175.50794 547.39336
5580.0000 -179.57577 -174.80925 4.76651 2.11020 -175.87878 515.76763
5585.0000 -180.23497 -174.88060 5.35437 2.17150 -174.81783 564.31653
5590.0000 -180.80325 -174.75525 6.04800 2.19058 -174.48768 568.18567
5595.0000 -178.92556 -174.21781 4.70775 2.15348 -175.12979 542.52870
5600.0000 -178.71436 -172.73413 5.98023 2.26933 -173.12477 624.29629
5605.0000 -179.17521 -173.73476 5.44044 2.25732 -173.33253 611.44278
5610.0000 -180.28119 -174.81724 5.46395 2.23951 -173.64077 596.40698
5615.0000 -179.60399 -174.27486 5.32913 2.20133 -174.30155 582.22590
5620.0000 -179.62015 -173.50650 6.11366 2.18981 -174.50098 572.70176
5625.0000 -179.34449 -173.89417 5.45031 2.23697 -173.68486 609.98624
5630.0000 -180.86972 -176.59408 4.27564 2.15894 -175.03531 572.59730
5635.0000 -181.32132 -175.97008 5.35123 2.13523 -175.44552 541.43868
5640.0000 -180.29029 -175.49541 4.79488 2.12389 -175.64192 545.88020
5645.0000 -180.89769 -175.66572 5.23197 2.10949 -175.89103 529.50459
5650.0000 -180.93465 -176.15347 4.78118 2.10820 -175.91338 549.45874
5655.0000 -181.24578 -175.93278 5.31299 2.10243 -176.01323 558.56022
5660.0000 -179.72953 -175.11330 4.61623 2.14315 -175.30848 553.36512
5665.0000 -180.17942 -175.23151 4.94791 2.13823 -175.39369 544.98428
5670.0000 -181.26573 -176.68457 4.58116 2.09398 -176.15944 520.57796
5675.0000 -181.02104 -175.72381 5.29724 2.08418 -176.32915 504.26457
5680.0000 -180.22836 -175.09221 5.13615 2.11512 -175.79370 524.64885
5685.0000 -179.08111 -173.58096 5.50015 2.18625 -174.56257 562.95943
5690.0000 -178.78506 -172.92476 5.86030 2.24597 -173.52906 610.10919
5695.0000 -180.32966 -173.95001 6.37965 2.24356 -173.57071 590.22689
5700.0000 -179.95550 -174.90349 5.05201 2.20273 -174.27732 601.85348
5705.0000 -180.01967 -174.70126 5.31842 2.18131 -174.64814 567.97382
5710.0000 -180.70779 -174.61621 6.09158 2.18824 -174.52806 579.34126
5715.0000 -181.44429 -176.99026 4.45404 2.10630 -175.94626 530.16807
5720.0000 -180.78172 -176.08998 4.69174 2.06872 -176.59670 495.93965
5725.0000 -179.59769 -173.79783 5.79986 2.14787 -175.22677 534.62942
5730.0000 -180.10080 -174.66962 5.43117 2.20497 -174.23855 577.47217
5735.0000 -180.32535 -174.17088 6.15447 2.20432 -174.24993 592.90325
5740.0000 -179.95098 -175.19284 4.75815 2.19438 -174.42190 573.75785
5745.0000 -180.50751 -175.32809 5.17942 2.15966 -175.02276 550.51975
5750.0000 -180.40889 -174.98150 5.42739 2.14399 -175.29406 558.96939
FREEZING PROCESS: loop number 24 T-loop= 526.00000000000000
main_MD> interactions number 24 at Temperature= 526.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.59839 -0.18760 -2.53913
force_rgl> df(natom) 2.53881 -0.26887 -0.47024
5755.0000 -181.52056 -176.62454 4.89602 2.11098 -175.86533 540.65445
5760.0000 -180.76408 -175.96789 4.79619 2.06975 -176.57887 504.53487
5765.0000 -181.64060 -176.49290 5.14770 2.06327 -176.69106 508.94204
5770.0000 -181.78637 -176.09070 5.69567 2.07811 -176.43411 514.62162
5775.0000 -179.87077 -175.22481 4.64595 2.09778 -176.09380 523.20558
5780.0000 -180.24801 -175.15428 5.09373 2.14968 -175.19552 545.66594
5785.0000 -180.88595 -175.16609 5.71986 2.12727 -175.58332 555.42479
5790.0000 -180.60591 -176.06355 4.54236 2.13367 -175.47263 533.13060
5795.0000 -180.67012 -175.07883 5.59129 2.09201 -176.19358 500.48182
5800.0000 -180.69878 -176.36622 4.33256 2.12424 -175.63573 517.06652
5805.0000 -180.49386 -175.69200 4.80186 2.09356 -176.16681 490.05822
5810.0000 -181.34913 -176.54664 4.80250 2.09519 -176.13861 508.33006
5815.0000 -181.34600 -176.34345 5.00255 2.11773 -175.74847 525.48577
5820.0000 -180.93828 -176.15139 4.78688 2.08115 -176.38152 504.40384
5825.0000 -180.58713 -175.34557 5.24156 2.12488 -175.62474 531.22903
5830.0000 -181.70222 -175.84964 5.85258 2.15276 -175.14219 573.73706
5835.0000 -181.69995 -175.64963 6.05032 2.09672 -176.11204 540.60284
5840.0000 -181.02110 -176.55525 4.46585 2.11495 -175.79659 575.55281
5845.0000 -181.96010 -176.84245 5.11765 2.06282 -176.69884 525.18159
5850.0000 -182.24256 -177.84044 4.40212 2.01695 -177.49263 494.13355
5855.0000 -181.25437 -176.16773 5.08664 2.03046 -177.25892 488.20360
5860.0000 -179.77790 -175.08150 4.69639 2.11981 -175.71253 544.38343
5865.0000 -179.69961 -175.20485 4.49476 2.14711 -175.23997 527.43606
5870.0000 -181.31946 -176.20642 5.11304 2.14354 -175.30179 544.39068
5875.0000 -181.85709 -177.31293 4.54416 2.04349 -177.03340 475.06705
5880.0000 -181.55334 -177.06516 4.48818 2.05223 -176.88210 504.14836
5885.0000 -182.07429 -177.26261 4.81168 2.03867 -177.11671 501.64490
5890.0000 -181.92356 -177.30938 4.61418 2.03120 -177.24606 494.39516
5895.0000 -182.23042 -178.03806 4.19236 2.02963 -177.27319 499.11462
5900.0000 -181.52659 -175.61121 5.91538 2.03244 -177.22458 501.17004
5905.0000 -180.08973 -175.63709 4.45263 2.11881 -175.72975 570.74952
5910.0000 -181.16279 -175.66215 5.50063 2.10780 -175.92040 534.67524
5915.0000 -181.04019 -175.66022 5.37997 2.13262 -175.49070 552.13859
5920.0000 -180.56271 -176.47981 4.08290 2.10663 -175.94055 535.89122
5925.0000 -181.20254 -176.64443 4.55811 2.07084 -176.56002 511.48757
5930.0000 -180.27670 -175.90397 4.37272 2.04669 -176.97798 486.62117
5935.0000 -181.91710 -175.36794 6.54916 2.11706 -175.75999 556.12239
5940.0000 -180.33255 -175.59945 4.73309 2.13662 -175.42148 581.59880
5945.0000 -181.02526 -176.48600 4.53925 2.13194 -175.50249 543.56348
5950.0000 -181.76913 -177.34942 4.41971 2.05733 -176.79377 488.36489
5955.0000 -180.23404 -174.90461 5.32943 2.08797 -176.26345 513.17555
5960.0000 -181.84954 -175.78601 6.06353 2.15778 -175.05528 591.19635
5965.0000 -181.36011 -176.34846 5.01165 2.07932 -176.41324 524.47352
5970.0000 -181.04365 -176.07080 4.97285 2.08299 -176.34965 517.14505
5975.0000 -181.35598 -176.54989 4.80609 2.10033 -176.04965 518.34291
5980.0000 -180.88768 -176.69844 4.18923 2.07550 -176.47934 515.64097
5985.0000 -181.59687 -177.26278 4.33409 2.06834 -176.60323 503.38520
5990.0000 -181.30246 -177.01168 4.29078 2.03213 -177.22987 468.74233
5995.0000 -181.69867 -177.28392 4.41475 2.03283 -177.21787 472.06455
6000.0000 -180.64751 -175.59461 5.05289 2.06672 -176.63137 492.55914
FREEZING PROCESS: loop number 25 T-loop= 501.00000000000000
main_MD> interactions number 25 at Temperature= 501.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.20839 -1.07894 1.48145
force_rgl> df(natom) -2.90396 -0.46316 -2.60589
6005.0000 -179.75959 -174.38109 5.37850 2.15740 -175.06189 560.88024
6010.0000 -180.45587 -175.67919 4.77668 2.14885 -175.20987 547.88311
6015.0000 -180.62522 -176.02697 4.59825 2.10932 -175.89405 508.32612
6020.0000 -181.10309 -176.11149 4.99160 2.12269 -175.66268 525.19183
6025.0000 -181.94209 -177.46763 4.47446 2.07061 -176.56396 489.69874
6030.0000 -181.16620 -177.13807 4.02813 2.04409 -177.02300 478.17013
6035.0000 -181.05103 -176.44202 4.60901 2.07916 -176.41601 513.46791
6040.0000 -181.64618 -176.24890 5.39728 2.06153 -176.72113 492.22064
6045.0000 -180.31094 -175.54806 4.76288 2.08839 -176.25630 511.91866
6050.0000 -180.93662 -176.31281 4.62381 2.13296 -175.48487 537.53251
6055.0000 -180.85234 -176.52596 4.32638 2.09921 -176.06903 497.68959
6060.0000 -181.17040 -176.30014 4.87026 2.09379 -176.16282 516.28153
6065.0000 -181.33478 -176.19092 5.14386 2.09371 -176.16409 510.85122
6070.0000 -181.24452 -176.34014 4.90438 2.07513 -176.48575 496.87648
6075.0000 -181.12561 -175.86479 5.26082 2.11545 -175.78797 516.75485
6080.0000 -181.22293 -175.74446 5.47847 2.11229 -175.84263 518.22250
6085.0000 -181.71999 -176.83977 4.88022 2.06552 -176.65213 507.64629
6090.0000 -181.51247 -177.10328 4.40919 2.05092 -176.90469 494.31142
6095.0000 -182.08701 -177.57097 4.51603 2.02836 -177.29523 476.48320
6100.0000 -182.42514 -178.28643 4.13871 1.98244 -178.08993 451.41496
6105.0000 -181.58938 -177.14719 4.44219 2.01345 -177.55330 474.38596
6110.0000 -181.83433 -176.93652 4.89781 2.06954 -176.58240 518.25968
6115.0000 -181.14010 -176.54957 4.59053 2.08847 -176.25488 518.21878
6120.0000 -181.97781 -177.36124 4.61657 2.02412 -177.36860 482.79254
6125.0000 -182.26621 -176.86021 5.40600 2.02766 -177.30724 487.01931
6130.0000 -180.84115 -176.61690 4.22425 2.06523 -176.65711 492.36296
6135.0000 -181.04630 -176.35065 4.69565 2.07316 -176.51988 473.38558
6140.0000 -180.50960 -175.55870 4.95089 2.10618 -175.94833 514.52554
6145.0000 -181.81019 -176.68762 5.12256 2.09347 -176.16835 528.28737
6150.0000 -181.28679 -176.91837 4.36842 2.06308 -176.69436 482.09288
6155.0000 -181.82816 -177.12170 4.70646 2.04497 -177.00770 500.92365
6160.0000 -182.37806 -177.46819 4.90987 2.05134 -176.89740 525.04913
6165.0000 -181.63665 -177.58422 4.05243 2.01672 -177.49662 493.40090
6170.0000 -181.05074 -176.39170 4.65904 2.04162 -177.06576 485.60972
6175.0000 -181.98969 -176.66535 5.32433 2.08453 -176.32298 499.64876
6180.0000 -181.18725 -177.11959 4.06767 2.01408 -177.54226 460.54268
6185.0000 -180.43145 -175.56534 4.86611 2.06424 -176.67413 479.58974
6190.0000 -180.59160 -176.99602 3.59558 2.07084 -176.56000 489.71587
6195.0000 -181.50621 -175.78683 5.71938 2.05783 -176.78519 493.48252
6200.0000 -182.02034 -177.91145 4.10889 2.06473 -176.66568 512.64338
6205.0000 -182.15583 -178.01751 4.13832 1.97548 -178.21035 441.23786
6210.0000 -182.50886 -177.68012 4.82874 2.01375 -177.54811 457.15010
6215.0000 -181.84844 -177.30189 4.54655 1.99577 -177.85917 439.56985
6220.0000 -180.88649 -176.92719 3.95930 2.05384 -176.85417 492.24099
6225.0000 -180.92422 -176.65912 4.26511 2.08849 -176.25447 528.10900
6230.0000 -181.03589 -176.79882 4.23706 2.02759 -177.30849 486.85329
6235.0000 -182.05851 -177.34823 4.71028 2.06429 -176.67326 501.34282
6240.0000 -180.39474 -175.69562 4.69912 2.06440 -176.67136 510.48957
6245.0000 -181.78370 -177.04891 4.73479 2.09532 -176.13622 528.25016
6250.0000 -181.64648 -176.98092 4.66556 2.07459 -176.49514 529.09311
FREEZING PROCESS: loop number 26 T-loop= 476.00000000000000
main_MD> interactions number 26 at Temperature= 476.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.85432 1.92382 2.84012
force_rgl> df(natom) -0.38405 1.10829 0.55168
6255.0000 -181.37784 -176.97254 4.40529 2.01914 -177.45469 476.74213
6260.0000 -181.51875 -177.25953 4.25922 2.05934 -176.75901 503.89044
6265.0000 -180.28949 -176.55794 3.73154 2.04570 -176.99513 458.96997
6270.0000 -180.73755 -175.84613 4.89143 2.09001 -176.22829 494.13014
6275.0000 -180.72086 -176.14087 4.57999 2.07369 -176.51066 498.64822
6280.0000 -180.51537 -176.62709 3.88828 2.08098 -176.38442 497.01383
6285.0000 -181.70030 -176.56211 5.13819 2.06438 -176.67172 505.18815
6290.0000 -181.14841 -176.58028 4.56813 2.06814 -176.60680 508.98754
6295.0000 -181.84372 -177.29823 4.54549 2.05793 -176.78336 507.20184
6300.0000 -181.79923 -177.50265 4.29658 2.01742 -177.48448 496.69017
6305.0000 -182.49448 -177.49072 5.00376 2.01938 -177.45058 490.12562
6310.0000 -182.41073 -177.99583 4.41491 2.02071 -177.42752 495.23455
6315.0000 -182.29965 -177.64546 4.65420 1.96211 -178.44172 458.28064
6320.0000 -182.98094 -177.96532 5.01562 1.97539 -178.21185 477.23006
6325.0000 -182.28049 -177.70439 4.57609 1.97769 -178.17210 469.34846
6330.0000 -182.62060 -177.82231 4.79830 1.99442 -177.88253 500.07369
6335.0000 -183.42498 -178.89871 4.52627 1.95907 -178.49433 467.26945
6340.0000 -182.86864 -178.45018 4.41846 1.96327 -178.42177 476.71132
6345.0000 -182.21073 -178.28419 3.92654 1.97339 -178.24647 477.47560
6350.0000 -182.03440 -178.32202 3.71238 1.95745 -178.52243 470.71388
6355.0000 -182.33636 -178.23381 4.10255 1.96136 -178.45469 464.65459
6360.0000 -182.36678 -177.74892 4.61786 1.98876 -177.98056 472.37305
6365.0000 -182.18395 -177.66061 4.52335 2.01063 -177.60206 507.90959
6370.0000 -181.98969 -177.84343 4.14627 1.99669 -177.84328 477.16223
6375.0000 -183.23460 -178.59403 4.64057 1.95004 -178.65069 448.08314
6380.0000 -182.24317 -177.30837 4.93480 1.97435 -178.23001 473.56981
6385.0000 -182.70934 -177.87220 4.83715 2.00448 -177.70840 500.94818
6390.0000 -182.62737 -178.16557 4.46180 1.97643 -178.19395 480.93620
6395.0000 -182.71407 -177.46783 5.24624 1.99454 -177.88047 483.93181
6400.0000 -181.89381 -177.68258 4.21123 2.01749 -177.48333 507.18962
6405.0000 -182.66158 -177.19023 5.47135 2.06782 -176.61233 544.30779
6410.0000 -183.24754 -177.98520 5.26234 2.01999 -177.44002 524.60295
6415.0000 -182.86783 -177.96318 4.90465 1.99751 -177.82910 499.73385
6420.0000 -183.49456 -179.10722 4.38734 1.96436 -178.40276 474.07781
6425.0000 -183.63593 -179.75914 3.87679 1.90471 -179.43512 427.19657
6430.0000 -182.81694 -178.61707 4.19987 1.91958 -179.17783 441.33740
6435.0000 -183.14656 -178.95397 4.19260 1.95128 -178.62915 461.94483
6440.0000 -182.23482 -178.01659 4.21823 1.96666 -178.36308 472.96948
6445.0000 -183.47660 -179.53964 3.93696 1.92876 -179.01897 449.63193
6450.0000 -183.22048 -178.81283 4.40765 1.91717 -179.21961 430.60699
6455.0000 -183.24169 -178.59268 4.64900 1.92173 -179.14070 442.12490
6460.0000 -183.50793 -179.08758 4.42035 1.92944 -179.00711 448.75319
6465.0000 -182.38357 -178.22749 4.15608 1.97505 -178.21786 481.62234
6470.0000 -183.23911 -178.84780 4.39131 1.96591 -178.37595 462.08812
6475.0000 -182.24793 -177.91914 4.32879 1.99544 -177.86493 497.44434
6480.0000 -182.03826 -176.67783 5.36043 2.03778 -177.13222 531.25440
6485.0000 -182.98000 -178.34354 4.63646 1.98589 -178.03013 483.18156
6490.0000 -182.60521 -178.06246 4.54275 1.94527 -178.73318 462.84615
6495.0000 -181.93320 -177.55451 4.37869 1.99151 -177.93294 474.50752
6500.0000 -181.92178 -177.16872 4.75307 2.02787 -177.30363 484.92233
FREEZING PROCESS: loop number 27 T-loop= 451.00000000000000
main_MD> interactions number 27 at Temperature= 451.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.63740 -1.48210 0.45753
force_rgl> df(natom) -2.25051 -0.12444 -1.28505
6505.0000 -182.34608 -178.49548 3.85061 2.01012 -177.61082 473.80455
6510.0000 -182.48376 -178.24878 4.23497 1.97083 -178.29084 435.73164
6515.0000 -183.18353 -178.19446 4.98906 1.94897 -178.66913 417.57546
6520.0000 -183.07335 -178.92725 4.14610 1.93868 -178.84727 431.37631
6525.0000 -181.53931 -177.43537 4.10395 2.01384 -177.54654 476.56369
6530.0000 -181.91736 -177.77370 4.14366 1.96629 -178.36945 433.22830
6535.0000 -181.88824 -177.23357 4.65467 1.99101 -177.94168 459.39274
6540.0000 -182.25829 -177.94082 4.31748 2.01118 -177.59253 475.23363
6545.0000 -182.52453 -178.47726 4.04726 1.96797 -178.34039 449.96173
6550.0000 -182.28464 -177.75188 4.53277 1.98808 -177.99239 467.05156
6555.0000 -181.95368 -177.50175 4.45193 2.00220 -177.74790 463.45160
6560.0000 -181.78540 -177.59362 4.19178 1.98158 -178.10476 464.22721
6565.0000 -182.82818 -178.38127 4.44691 1.98114 -178.11246 468.37612
6570.0000 -183.13429 -179.13533 3.99896 1.94188 -178.79192 441.62942
6575.0000 -182.36294 -177.97757 4.38537 1.94939 -178.66197 443.56739
6580.0000 -183.63844 -179.65604 3.98239 1.94567 -178.72636 446.30549
6585.0000 -182.80738 -178.70106 4.10632 1.90833 -179.37261 416.80313
6590.0000 -182.65293 -177.56730 5.08563 1.99568 -177.86082 488.60317
6595.0000 -181.11643 -176.63350 4.48293 2.01099 -177.59576 452.07090
6600.0000 -181.67247 -177.39797 4.27450 2.03365 -177.20364 475.89738
6605.0000 -181.41527 -176.75580 4.65947 2.02928 -177.27929 460.88909
6610.0000 -181.77290 -177.00552 4.76738 2.05120 -176.89990 474.11515
6615.0000 -182.13395 -177.42498 4.70897 2.02962 -177.27337 470.19114
6620.0000 -182.91975 -178.26677 4.65297 1.98397 -178.06348 444.64187
6625.0000 -183.57716 -179.71688 3.86028 1.93940 -178.83474 421.31082
6630.0000 -183.67475 -179.22635 4.44840 1.89958 -179.52391 399.93472
6635.0000 -183.46200 -179.84792 3.61407 1.91139 -179.31965 422.08856
6640.0000 -182.35538 -178.92533 3.43005 1.90736 -179.38938 405.46322
6645.0000 -183.17952 -179.60390 3.57562 1.90382 -179.45059 381.99304
6650.0000 -182.56598 -178.70001 3.86597 1.90603 -179.41233 403.78226
6655.0000 -182.25624 -178.04402 4.21222 1.96755 -178.34763 440.29458
6660.0000 -181.09419 -177.15731 3.93688 2.02555 -177.34378 480.83345
6665.0000 -181.26343 -177.31316 3.95028 2.04730 -176.96741 479.45986
6670.0000 -182.54791 -178.00177 4.54615 2.01363 -177.55012 475.58300
6675.0000 -181.74014 -177.31094 4.42920 2.00623 -177.67822 463.58725
6680.0000 -181.42239 -177.26147 4.16091 1.98409 -178.06135 445.46949
6685.0000 -182.32312 -177.51214 4.81098 2.02605 -177.33513 473.74716
6690.0000 -183.06815 -178.73281 4.33535 1.97888 -178.15150 441.32942
6695.0000 -182.41088 -178.43027 3.98061 1.97491 -178.22020 435.83454
6700.0000 -182.63836 -177.94469 4.69368 1.96254 -178.43435 430.99091
6705.0000 -181.62991 -177.85877 3.77114 2.00412 -177.71470 475.82868
6710.0000 -182.34731 -177.46936 4.87796 2.02312 -177.38582 470.33179
6715.0000 -182.46796 -178.70496 3.76300 1.95080 -178.63751 424.69480
6720.0000 -182.92976 -179.40792 3.52184 1.93122 -178.97637 419.91487
6725.0000 -182.01940 -177.90684 4.11256 1.94230 -178.78468 426.51656
6730.0000 -181.88493 -177.70468 4.18025 2.02150 -177.41392 494.92081
6735.0000 -182.61257 -178.63039 3.98218 2.00136 -177.76249 469.08827
6740.0000 -182.88806 -179.63675 3.25131 1.94535 -178.73189 429.45378
6745.0000 -182.41405 -178.11105 4.30299 1.95502 -178.56441 442.36941
6750.0000 -182.18544 -178.03303 4.15241 1.99410 -177.88814 474.06878
FREEZING PROCESS: loop number 28 T-loop= 426.00000000000000
main_MD> interactions number 28 at Temperature= 426.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.69480 -1.17931 -0.25614
force_rgl> df(natom) 0.45818 2.37992 4.60169
6755.0000 -182.35435 -178.06441 4.28993 1.98119 -178.11161 459.77695
6760.0000 -182.69809 -178.79458 3.90351 1.96250 -178.43504 426.61908
6765.0000 -182.29391 -178.58007 3.71384 1.94355 -178.76296 420.97716
6770.0000 -182.69924 -178.14777 4.55147 1.97165 -178.27660 450.49076
6775.0000 -182.88964 -179.06857 3.82106 1.96859 -178.32962 453.27240
6780.0000 -183.10822 -179.35534 3.75288 1.90891 -179.36257 400.07719
6785.0000 -183.16912 -178.95518 4.21394 1.93204 -178.96220 418.79840
6790.0000 -182.90087 -179.27731 3.62356 1.92072 -179.15807 415.89749
6795.0000 -182.84524 -179.43244 3.41280 1.90896 -179.36168 410.12048
6800.0000 -182.17685 -177.82456 4.35229 1.93543 -178.90348 418.02190
6805.0000 -182.76927 -178.42063 4.34864 1.99386 -177.89225 470.66519
6810.0000 -182.84145 -178.78406 4.05740 1.96300 -178.42645 437.22759
6815.0000 -182.59805 -178.72725 3.87080 1.94888 -178.67069 431.35095
6820.0000 -181.99560 -177.65310 4.34250 1.98915 -177.97385 457.91687
6825.0000 -182.80610 -178.07106 4.73504 1.97526 -178.21427 442.66446
6830.0000 -182.89854 -178.19356 4.70498 1.97611 -178.19950 437.85327
6835.0000 -183.02711 -179.65206 3.37506 1.94585 -178.72311 430.79020
6840.0000 -182.25159 -178.56200 3.68959 1.92089 -179.15523 403.20651
6845.0000 -182.37910 -178.54904 3.83006 1.95925 -178.49121 425.33659
6850.0000 -183.24320 -178.63535 4.60785 1.94912 -178.66651 429.39992
6855.0000 -182.73780 -178.70022 4.03758 1.92270 -179.12376 407.46993
6860.0000 -182.25777 -178.35149 3.90627 1.96461 -178.39842 440.04648
6865.0000 -182.45066 -178.62853 3.82213 1.94934 -178.66276 423.76182
6870.0000 -182.41371 -178.43026 3.98345 1.96569 -178.37987 445.99359
6875.0000 -182.81367 -178.62012 4.19355 1.96758 -178.34714 453.72125
6880.0000 -181.88261 -177.82634 4.05626 1.95048 -178.64311 448.62286
6885.0000 -182.83907 -178.69448 4.14459 1.95027 -178.64672 453.95474
6890.0000 -183.23861 -179.03073 4.20789 1.92958 -179.00470 438.76328
6895.0000 -183.55584 -179.34519 4.21065 1.91398 -179.27468 423.64846
6900.0000 -182.82693 -179.72646 3.10047 1.90538 -179.42354 416.47582
6905.0000 -183.05922 -179.16664 3.89258 1.89605 -179.58513 388.65359
6910.0000 -182.30525 -178.74350 3.56175 1.92965 -179.00362 416.87959
6915.0000 -182.48801 -178.69341 3.79460 1.93401 -178.92817 433.55580
6920.0000 -183.29851 -179.47278 3.82572 1.92248 -179.12768 422.87901
6925.0000 -183.41101 -179.47253 3.93848 1.89610 -179.58427 408.39222
6930.0000 -182.58356 -178.80553 3.77803 1.91762 -179.21169 410.97227
6935.0000 -182.80788 -178.27996 4.52792 1.95725 -178.52595 452.07619
6940.0000 -183.41138 -178.90692 4.50445 1.96312 -178.42425 451.25739
6945.0000 -183.55521 -178.95920 4.59601 1.91893 -179.18906 433.67140
6950.0000 -183.68053 -179.49518 4.18536 1.90519 -179.42693 418.16755
6955.0000 -182.63160 -179.29354 3.33806 1.89455 -179.61101 405.73037
6960.0000 -183.46061 -179.77458 3.68604 1.90651 -179.40399 412.34448
6965.0000 -183.50126 -179.69252 3.80874 1.87953 -179.87090 389.99359
6970.0000 -183.34435 -179.23598 4.10836 1.94242 -178.78249 445.30342
6975.0000 -182.90218 -179.38462 3.51756 1.91397 -179.27495 430.13530
6980.0000 -183.63150 -179.02736 4.60414 1.93498 -178.91135 442.81060
6985.0000 -183.04317 -179.28374 3.75944 1.92405 -179.10056 434.18572
6990.0000 -183.09437 -179.10328 3.99109 1.90078 -179.50325 414.41933
6995.0000 -183.00331 -179.23463 3.76868 1.93737 -178.86989 435.35343
7000.0000 -182.81099 -179.47786 3.33314 1.93179 -178.96646 430.91300
FREEZING PROCESS: loop number 29 T-loop= 401.00000000000000
main_MD> interactions number 29 at Temperature= 401.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.67818 1.36043 -2.16645
force_rgl> df(natom) 1.37791 -3.56132 5.76344
7005.0000 -183.25735 -179.47083 3.78652 1.89913 -179.53177 402.06872
7010.0000 -183.57263 -179.81382 3.75881 1.90437 -179.44108 411.20558
7015.0000 -184.00689 -180.34679 3.66010 1.87985 -179.86550 396.61471
7020.0000 -183.75377 -179.95938 3.79439 1.88320 -179.80753 400.53887
7025.0000 -183.92702 -180.42770 3.49932 1.86327 -180.15242 388.45497
7030.0000 -183.18311 -179.36008 3.82303 1.85726 -180.25646 378.53083
7035.0000 -182.95861 -178.71915 4.23946 1.92723 -179.04538 434.22588
7040.0000 -183.37094 -180.09630 3.27464 1.91973 -179.17531 436.13405
7045.0000 -184.10036 -180.16267 3.93769 1.88299 -179.81113 403.40471
7050.0000 -183.86578 -180.19578 3.67000 1.84563 -180.45770 373.45926
7055.0000 -183.66806 -180.70386 2.96420 1.89802 -179.55090 408.59937
7060.0000 -183.04978 -179.72050 3.32928 1.85883 -180.22927 379.22075
7065.0000 -183.64571 -180.04688 3.59883 1.88413 -179.79139 399.75516
7070.0000 -183.69043 -180.39305 3.29738 1.86355 -180.14751 389.65172
7075.0000 -183.35479 -180.06680 3.28799 1.86097 -180.19218 387.06865
7080.0000 -183.64665 -179.50266 4.14399 1.87747 -179.90668 399.14405
7085.0000 -183.42049 -179.50396 3.91653 1.92134 -179.14731 437.67943
7090.0000 -184.01223 -179.60057 4.41166 1.89404 -179.61989 402.63188
7095.0000 -183.78966 -180.00065 3.78901 1.87338 -179.97747 396.54704
7100.0000 -183.94741 -180.08545 3.86196 1.86904 -180.05247 390.60894
7105.0000 -184.03962 -180.01785 4.02177 1.85737 -180.25448 377.89330
7110.0000 -183.02261 -179.41923 3.60338 1.88054 -179.85354 395.76567
7115.0000 -183.19134 -179.12053 4.07081 1.90273 -179.46954 406.13922
7120.0000 -183.33741 -179.71472 3.62268 1.91291 -179.29325 423.29745
7125.0000 -183.57567 -180.11725 3.45842 1.86646 -180.09712 390.01520
7130.0000 -183.47908 -180.44504 3.03404 1.86816 -180.06780 389.90312
7135.0000 -183.73817 -180.01445 3.72373 1.85181 -180.35081 371.49284
7140.0000 -183.79343 -180.08987 3.70356 1.86131 -180.18638 383.33620
7145.0000 -183.38756 -179.82318 3.56439 1.85885 -180.22893 380.12388
7150.0000 -183.22047 -179.32396 3.89652 1.90596 -179.41352 417.64167
7155.0000 -182.84279 -179.28968 3.55311 1.93654 -178.88428 421.87914
7160.0000 -183.40889 -179.82761 3.58127 1.90827 -179.37351 397.42132
7165.0000 -182.34090 -178.30937 4.03153 1.94507 -178.73675 439.82152
7170.0000 -183.15763 -179.70747 3.45016 1.94270 -178.77766 440.24634
7175.0000 -183.14473 -179.71352 3.43121 1.87623 -179.92818 386.78901
7180.0000 -183.08785 -178.82497 4.26288 1.88842 -179.71715 395.02759
7185.0000 -183.33095 -179.73363 3.59731 1.89919 -179.53068 403.33368
7190.0000 -182.65327 -178.29829 4.35499 1.91346 -179.28376 414.64666
7195.0000 -182.80854 -178.11082 4.69772 1.98168 -178.10300 468.95678
7200.0000 -183.39548 -179.66913 3.72636 1.94845 -178.67816 445.44248
7205.0000 -183.39128 -179.79036 3.60092 1.88398 -179.79390 388.31930
7210.0000 -184.03549 -180.72331 3.31219 1.86825 -180.06627 378.96411
7215.0000 -183.80358 -180.26231 3.54127 1.84777 -180.42057 374.85817
7220.0000 -183.78023 -180.14345 3.63678 1.86730 -180.08263 390.59280
7225.0000 -184.24599 -180.26148 3.98451 1.87780 -179.90085 397.90951
7230.0000 -183.81833 -180.54453 3.27380 1.82918 -180.74240 359.82406
7235.0000 -183.98199 -180.53021 3.45177 1.83151 -180.70198 363.26903
7240.0000 -183.53785 -180.15976 3.37809 1.86853 -180.06134 377.91878
7245.0000 -182.81714 -178.66634 4.15080 1.90260 -179.47169 420.61615
7250.0000 -183.29642 -179.14404 4.15238 1.93817 -178.85605 458.16913
FREEZING PROCESS: loop number 30 T-loop= 376.00000000000000
main_MD> interactions number 30 at Temperature= 376.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.57082 -2.29627 -0.00305
force_rgl> df(natom) 0.99009 1.79746 -0.04235
7255.0000 -183.48586 -179.67258 3.81328 1.91149 -179.31790 422.49077
7260.0000 -183.61070 -179.97249 3.63822 1.87079 -180.02225 401.09897
7265.0000 -183.89920 -180.35959 3.53961 1.85829 -180.23860 388.32422
7270.0000 -183.31737 -179.88800 3.42937 1.87017 -180.03292 402.19023
7275.0000 -183.57032 -180.28954 3.28078 1.85977 -180.21292 391.60876
7280.0000 -184.09154 -180.20972 3.88182 1.86712 -180.08572 397.74524
7285.0000 -184.58125 -181.20222 3.37903 1.82926 -180.74102 367.81168
7290.0000 -183.83734 -179.82410 4.01324 1.85233 -180.34177 388.17080
7295.0000 -184.45781 -181.41249 3.04532 1.84175 -180.52476 381.81266
7300.0000 -183.61289 -180.66258 2.95031 1.82325 -180.84510 359.58099
7305.0000 -184.35277 -180.26207 4.09071 1.84695 -180.43486 384.33707
7310.0000 -184.11479 -180.27160 3.84319 1.83387 -180.66126 373.39007
7315.0000 -184.15586 -179.71470 4.44117 1.85799 -180.24377 395.46262
7320.0000 -184.54682 -180.94232 3.60450 1.84144 -180.53016 382.84083
7325.0000 -184.44983 -181.06930 3.38052 1.79687 -181.30160 338.72587
7330.0000 -184.24871 -180.65911 3.58960 1.82313 -180.84714 362.45917
7335.0000 -184.31536 -181.07110 3.24427 1.82505 -180.81395 364.44767
7340.0000 -184.41186 -180.92729 3.48457 1.82200 -180.86660 360.76801
7345.0000 -184.53834 -180.94332 3.59501 1.83460 -180.64863 377.33251
7350.0000 -183.81313 -179.78478 4.02835 1.85377 -180.31675 385.49712
7355.0000 -183.15643 -180.10672 3.04971 1.86295 -180.15788 390.55921
7360.0000 -183.75163 -180.34758 3.40405 1.85506 -180.29444 390.52442
7365.0000 -183.54635 -180.42900 3.11734 1.85035 -180.37600 382.13047
7370.0000 -184.04132 -180.76057 3.28075 1.84186 -180.52289 376.95463
7375.0000 -184.25568 -180.52347 3.73221 1.82996 -180.72887 371.61830
7380.0000 -183.90132 -180.71570 3.18562 1.83573 -180.62907 377.93857
7385.0000 -184.08939 -180.67440 3.41498 1.83156 -180.70121 366.22057
7390.0000 -183.92374 -180.18301 3.74073 1.85721 -180.25734 391.06163
7395.0000 -183.20502 -180.44039 2.76463 1.85715 -180.25826 390.20021
7400.0000 -184.36682 -180.62224 3.74458 1.83105 -180.70995 367.82237
7405.0000 -183.51911 -179.09792 4.42119 1.86636 -180.09897 399.67790
7410.0000 -182.95283 -179.34365 3.60918 1.93776 -178.86319 453.98593
7415.0000 -184.34261 -180.78606 3.55654 1.86370 -180.14500 398.74480
7420.0000 -183.93498 -180.20439 3.73059 1.84916 -180.39653 377.74338
7425.0000 -184.26058 -180.17368 4.08690 1.86809 -180.06889 402.18208
7430.0000 -184.34644 -180.78451 3.56193 1.82563 -180.80377 364.36325
7435.0000 -183.55352 -179.97807 3.57545 1.84051 -180.54625 375.28538
7440.0000 -183.76139 -180.35216 3.40924 1.86869 -180.05854 402.49543
7445.0000 -184.40866 -180.33038 4.07828 1.84062 -180.54433 374.95341
7450.0000 -183.94382 -180.96649 2.97733 1.82713 -180.77788 365.78054
7455.0000 -183.96930 -180.39183 3.57748 1.85616 -180.27539 400.22536
7460.0000 -184.01305 -180.59681 3.41623 1.82090 -180.88561 367.22644
7465.0000 -183.63635 -180.50520 3.13115 1.86258 -180.16435 391.20619
7470.0000 -184.24594 -180.16804 4.07790 1.86026 -180.20455 397.67572
7475.0000 -183.98988 -180.81867 3.17122 1.82983 -180.73118 367.40125
7480.0000 -183.57295 -179.52405 4.04889 1.86261 -180.16386 393.90047
7485.0000 -184.22090 -180.48928 3.73162 1.86412 -180.13761 395.79694
7490.0000 -184.87817 -181.67184 3.20634 1.82347 -180.84120 357.85328
7495.0000 -184.49137 -181.32328 3.16809 1.79681 -181.30258 340.05433
7500.0000 -184.85907 -181.93157 2.92751 1.77860 -181.61777 325.65256
FREEZING PROCESS: loop number 31 T-loop= 351.00000000000000
main_MD> interactions number 31 at Temperature= 351.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.97368 1.53926 1.21149
force_rgl> df(natom) 0.58097 1.90901 2.06331
7505.0000 -184.66612 -181.72793 2.93819 1.78449 -181.51580 327.92106
7510.0000 -183.99289 -181.09284 2.90005 1.79799 -181.28219 338.52055
7515.0000 -184.29343 -181.44535 2.84808 1.80360 -181.18505 343.90553
7520.0000 -184.08296 -181.32505 2.75791 1.78974 -181.42503 335.37925
7525.0000 -184.59931 -181.36117 3.23814 1.79831 -181.27658 340.23120
7530.0000 -184.29090 -181.15712 3.13378 1.79958 -181.25463 342.38087
7535.0000 -184.15166 -180.88778 3.26388 1.81030 -181.06915 350.74306
7540.0000 -184.80341 -181.00933 3.79408 1.82545 -180.80701 364.07136
7545.0000 -184.22353 -180.66278 3.56075 1.81483 -180.99083 356.04174
7550.0000 -184.07970 -180.97895 3.10075 1.82616 -180.79473 363.60575
7555.0000 -184.10803 -181.06585 3.04219 1.82624 -180.79322 366.56876
7560.0000 -183.69456 -180.23185 3.46271 1.83852 -180.58081 375.84273
7565.0000 -184.25221 -181.03825 3.21396 1.82739 -180.77339 365.85363
7570.0000 -184.30178 -180.77085 3.53093 1.83040 -180.72121 367.40961
7575.0000 -184.20655 -181.39077 2.81578 1.80195 -181.21364 342.27427
7580.0000 -184.48294 -181.47538 3.00756 1.77658 -181.65270 325.35316
7585.0000 -184.29669 -181.32159 2.97510 1.79587 -181.31890 341.01151
7590.0000 -184.16133 -180.62641 3.53493 1.80098 -181.23052 343.38863
7595.0000 -183.98606 -180.84784 3.13822 1.81557 -180.97791 355.61994
7600.0000 -184.53032 -180.80819 3.72213 1.82202 -180.86624 365.75427
7605.0000 -184.52817 -181.45360 3.07457 1.81770 -180.94114 361.81365
7610.0000 -183.83798 -180.63432 3.20366 1.81101 -181.05692 349.98058
7615.0000 -184.55619 -181.44348 3.11271 1.80861 -181.09837 351.37542
7620.0000 -184.60998 -181.07098 3.53901 1.81855 -180.92634 357.40236
7625.0000 -184.12723 -180.56581 3.56142 1.81181 -181.04304 354.24106
7630.0000 -184.22026 -180.96410 3.25616 1.84946 -180.39140 385.47929
7635.0000 -184.15700 -180.67654 3.48046 1.80851 -181.10020 349.13526
7640.0000 -184.43775 -180.95098 3.48677 1.80685 -181.12892 349.71130
7645.0000 -184.15616 -181.36713 2.78902 1.81464 -180.99402 349.51054
7650.0000 -184.24129 -180.93019 3.31110 1.79477 -181.33796 338.58688
7655.0000 -184.53444 -181.32353 3.21091 1.79528 -181.32905 340.83051
7660.0000 -184.50850 -181.06943 3.43907 1.81329 -181.01733 352.19042
7665.0000 -184.74723 -181.51694 3.23029 1.80030 -181.24230 342.81376
7670.0000 -184.34120 -180.94581 3.39539 1.79716 -181.29659 339.45640
7675.0000 -184.13596 -181.07973 3.05622 1.82289 -180.85123 364.11288
7680.0000 -184.75082 -181.47197 3.27885 1.78282 -181.54478 327.34682
7685.0000 -184.11141 -180.37088 3.74053 1.80834 -181.10314 350.30761
7690.0000 -184.13401 -180.39764 3.73636 1.86345 -180.14933 393.83738
7695.0000 -184.18997 -180.78145 3.40852 1.82228 -180.86174 363.33072
7700.0000 -185.01216 -181.89590 3.11625 1.79355 -181.35899 338.50533
7705.0000 -184.72682 -181.07091 3.65590 1.78500 -181.50709 333.21835
7710.0000 -184.54833 -180.80288 3.74546 1.82023 -180.89731 362.96430
7715.0000 -184.19447 -180.86722 3.32725 1.82508 -180.81342 366.01441
7720.0000 -184.44188 -181.33017 3.11172 1.80016 -181.24469 342.98835
7725.0000 -184.83364 -181.84394 2.98970 1.78566 -181.49566 331.27500
7730.0000 -184.59599 -181.28295 3.31304 1.79236 -181.37955 338.26332
7735.0000 -184.57646 -181.16515 3.41131 1.80260 -181.20245 348.31430
7740.0000 -183.89027 -180.39660 3.49367 1.82733 -180.77441 370.07269
7745.0000 -183.92295 -180.61787 3.30508 1.86268 -180.16268 397.15724
7750.0000 -184.33011 -181.24606 3.08404 1.79509 -181.33233 336.44701
FREEZING PROCESS: loop number 32 T-loop= 326.00000000000000
main_MD> interactions number 32 at Temperature= 326.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.00248 0.53064 -0.03572
force_rgl> df(natom) -0.01401 -0.16635 -0.41520
7755.0000 -184.59563 -182.03978 2.55585 1.77355 -181.70516 324.14278
7760.0000 -184.42496 -181.27608 3.14888 1.78144 -181.56865 329.54342
7765.0000 -184.71418 -181.14868 3.56550 1.81328 -181.01753 351.54205
7770.0000 -184.59757 -181.83020 2.76737 1.79043 -181.41302 332.20187
7775.0000 -185.06402 -182.32082 2.74320 1.75767 -181.98007 307.80832
7780.0000 -184.42624 -181.70680 2.71944 1.75489 -182.02819 303.48541
7785.0000 -184.66306 -181.38812 3.27494 1.77769 -181.63347 325.34932
7790.0000 -185.03576 -182.12048 2.91529 1.77927 -181.60611 321.99054
7795.0000 -184.51129 -181.65947 2.85182 1.75591 -182.01056 306.67790
7800.0000 -184.47096 -181.20473 3.26623 1.77883 -181.61388 324.45580
7805.0000 -184.83122 -181.80991 3.02131 1.79038 -181.41387 336.32280
7810.0000 -184.86124 -181.43876 3.42248 1.77742 -181.63826 324.91805
7815.0000 -184.49778 -181.69616 2.80162 1.75945 -181.94928 309.90521
7820.0000 -184.86192 -181.96722 2.89470 1.75866 -181.96281 305.52190
7825.0000 -184.59358 -180.85136 3.74222 1.80049 -181.23890 345.05949
7830.0000 -183.94844 -180.66456 3.28388 1.83456 -180.64926 377.85318
7835.0000 -184.65715 -181.64001 3.01714 1.81838 -180.92928 362.02102
7840.0000 -184.62847 -181.83470 2.79378 1.77506 -181.67907 320.43432
7845.0000 -184.30785 -181.40307 2.90478 1.77354 -181.70541 319.03457
7850.0000 -184.29637 -181.20761 3.08876 1.80162 -181.21930 344.93884
7855.0000 -184.17477 -181.26848 2.90629 1.79145 -181.39547 335.12147
7860.0000 -184.83026 -181.85504 2.97522 1.80571 -181.14867 348.32891
7865.0000 -184.89459 -182.03547 2.85912 1.76162 -181.91172 305.38880
7870.0000 -184.36697 -181.26590 3.10107 1.78026 -181.58912 323.84768
7875.0000 -184.95536 -181.78999 3.16537 1.79987 -181.24958 346.76808
7880.0000 -184.83933 -181.40485 3.43448 1.76953 -181.77480 318.55471
7885.0000 -184.31038 -181.52351 2.78687 1.79153 -181.39399 336.07572
7890.0000 -184.77220 -181.92374 2.84846 1.77924 -181.60676 326.82371
7895.0000 -185.05661 -181.98459 3.07202 1.77241 -181.72493 319.74732
7900.0000 -183.84229 -181.05859 2.78370 1.78688 -181.47452 333.31325
7905.0000 -184.49677 -181.21837 3.27841 1.79851 -181.27314 340.53255
7910.0000 -184.45131 -180.93003 3.52129 1.80523 -181.15681 347.74581
7915.0000 -184.75834 -181.77268 2.98566 1.79589 -181.31846 340.26729
7920.0000 -184.67609 -181.14436 3.53173 1.78457 -181.51446 329.51912
7925.0000 -184.53027 -181.47563 3.05464 1.79881 -181.26807 340.87477
7930.0000 -185.01045 -182.18138 2.82907 1.77332 -181.70915 321.77096
7935.0000 -184.67630 -181.37855 3.29775 1.77578 -181.66659 321.59495
7940.0000 -184.33854 -181.51531 2.82324 1.78005 -181.59261 328.20174
7945.0000 -185.16016 -181.96208 3.19808 1.78088 -181.57831 326.74114
7950.0000 -183.98892 -180.84624 3.14268 1.78422 -181.52052 329.44340
7955.0000 -184.62655 -181.68602 2.94053 1.80428 -181.17339 346.42263
7960.0000 -184.91290 -182.07598 2.83693 1.75301 -182.06067 297.40322
7965.0000 -184.22765 -180.90142 3.32624 1.79176 -181.38994 334.06434
7970.0000 -184.35244 -180.99890 3.35354 1.81630 -180.96527 356.34437
7975.0000 -184.95143 -181.44949 3.50195 1.79570 -181.32175 341.45283
7980.0000 -184.97606 -182.13318 2.84288 1.78371 -181.52940 329.42065
7985.0000 -185.11678 -182.65337 2.46340 1.73938 -182.29660 292.40091
7990.0000 -184.53942 -181.60114 2.93827 1.75213 -182.07589 303.51479
7995.0000 -184.18215 -181.42161 2.76055 1.78313 -181.53932 328.65483
8000.0000 -184.42559 -181.02151 3.40408 1.81307 -181.02120 355.51340
FREEZING PROCESS: loop number 33 T-loop= 301.00000000000000
main_MD> interactions number 33 at Temperature= 301.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.15211 -2.86956 -0.78558
force_rgl> df(natom) -5.50576 -0.21152 1.15319
8005.0000 -184.79597 -181.79728 2.99870 1.78682 -181.47554 331.19832
8010.0000 -185.19890 -182.37768 2.82123 1.74945 -182.12227 301.46205
8015.0000 -184.87342 -182.04115 2.83227 1.75202 -182.07786 303.61686
8020.0000 -184.83077 -182.14062 2.69015 1.73233 -182.41850 281.52797
8025.0000 -184.99030 -182.40623 2.58408 1.74178 -182.25511 293.28073
8030.0000 -185.37860 -182.87032 2.50829 1.72231 -182.59194 278.52533
8035.0000 -185.02113 -182.17203 2.84910 1.72899 -182.47637 285.38668
8040.0000 -184.97307 -182.42329 2.54978 1.75612 -182.00689 304.75252
8045.0000 -185.36203 -182.29806 3.06397 1.74121 -182.26495 294.12995
8050.0000 -184.98616 -182.44287 2.54329 1.72820 -182.49005 282.82067
8055.0000 -184.90602 -182.13073 2.77529 1.74411 -182.21465 294.90076
8060.0000 -185.09484 -182.17240 2.92244 1.73823 -182.31649 289.54194
8065.0000 -184.83525 -182.31865 2.51659 1.75246 -182.07013 302.40922
8070.0000 -185.05106 -182.12282 2.92824 1.74164 -182.25738 293.55424
8075.0000 -184.92012 -181.78295 3.13717 1.77505 -181.67920 321.71213
8080.0000 -185.22273 -182.54644 2.67629 1.75222 -182.07438 302.84090
8085.0000 -185.45265 -182.79711 2.65554 1.72105 -182.61388 282.05929
8090.0000 -185.47797 -182.72439 2.75358 1.69651 -183.03857 253.99989
8095.0000 -184.87761 -182.17772 2.69989 1.73343 -182.39949 284.04336
8100.0000 -185.22163 -181.92453 3.29710 1.75593 -182.01005 301.69337
8105.0000 -184.87568 -181.90080 2.97488 1.76542 -181.84586 311.37264
8110.0000 -184.79447 -181.67800 3.11647 1.76951 -181.77505 318.04160
8115.0000 -184.90468 -182.30971 2.59497 1.75622 -182.00518 303.89043
8120.0000 -185.23544 -182.69808 2.53736 1.71250 -182.76184 267.61244
8125.0000 -185.24640 -182.66185 2.58455 1.71506 -182.71752 268.52139
8130.0000 -184.81726 -181.44279 3.37447 1.75753 -181.98238 306.12387
8135.0000 -184.97436 -181.91100 3.06336 1.77873 -181.61558 324.62552
8140.0000 -184.38920 -181.56750 2.82170 1.77481 -181.68346 314.47571
8145.0000 -184.95274 -182.15572 2.79701 1.76558 -181.84310 314.28780
8150.0000 -185.43547 -182.53097 2.90449 1.73265 -182.41303 284.25395
8155.0000 -185.23574 -182.13234 3.10340 1.71848 -182.65822 271.21419
8160.0000 -184.82892 -182.44769 2.38123 1.74964 -182.11905 300.47931
8165.0000 -185.26903 -182.68850 2.58053 1.72401 -182.56250 279.50750
8170.0000 -184.67499 -181.99729 2.67771 1.74129 -182.26347 292.64000
8175.0000 -185.01453 -181.80928 3.20524 1.76643 -181.82844 313.27782
8180.0000 -184.85774 -182.32496 2.53278 1.75593 -182.01013 303.77213
8185.0000 -184.93824 -182.51727 2.42097 1.72745 -182.50309 279.76842
8190.0000 -185.05068 -181.87474 3.17594 1.75561 -182.01573 307.70577
8195.0000 -185.19449 -182.28875 2.90574 1.73442 -182.38244 286.83112
8200.0000 -184.91970 -181.95504 2.96466 1.74468 -182.20479 294.99190
8205.0000 -184.90768 -181.71706 3.19062 1.75776 -181.97852 309.68663
8210.0000 -184.40457 -181.45293 2.95164 1.78743 -181.46495 330.80642
8215.0000 -184.66530 -181.78220 2.88310 1.76667 -181.82430 315.12880
8220.0000 -184.73920 -181.87930 2.85991 1.77408 -181.69604 320.75957
8225.0000 -185.07122 -182.30429 2.76692 1.72988 -182.46090 281.78473
8230.0000 -184.30045 -181.58638 2.71408 1.74933 -182.12429 297.93850
8235.0000 -184.44177 -180.95851 3.48326 1.78533 -181.50131 330.78440
8240.0000 -184.51265 -181.59297 2.91968 1.78770 -181.46034 331.50826
8245.0000 -184.86603 -182.08080 2.78524 1.75590 -182.01068 306.55710
8250.0000 -184.88182 -181.62600 3.25582 1.75570 -182.01412 306.84376
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 12 [min], 31.6607744 [s].
main_MD> Deallocating global variables
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