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nanoparticlesims/growth_Melting_Silver_ICO_2451/freezeSims/run_77/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_77.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 = 77 ntipo2 = 0
read_input> Finish reading input
main_MD> Allocating global variables
main_MD> Number of outputs that will be created: 1800
main_MD> Size of nv and nvoiz: 77 7700
main_MD> Size of nv and nvoiz: 77 7700
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 = 77
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> 7.9577069690781918E-002 -3.8277429088343501E-002 -0.12682101629611253 initial drift of cluster / NP1 for coalescence
init> 0.34492882325208191 0.35563800535984708 0.31055686514095265 scaling for velocity /for coalescence NP1
init.f90 > facguy = 3.7316085582922045E-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) 0.83733 -1.48547 0.61078
force_rgl> df(natom) 1.92211 -4.61505 1.03661
preparo> THERMALIZATION PROCESS AT 1210.5790144454836
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -165.32708514417854 14.407165265087693 -179.73425040926622 7.2186808444027343E-004
preparo> END THERMALISATION ON NPAST DEFINE IN PARACLUSTER MODULE
main_MD> Time-loop is starting for freezing
main_MD> Now the computation of EXECUTION TIME starts
main_MD> Running from loop 1 to 36
FREEZING PROCESS: loop number 1 T-loop= 1183.0000000000000
main_MD> interactions number 1 at Temperature= 1183.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.26130 -0.92549 -0.16835
force_rgl> df(natom) -3.24003 -2.76326 -4.62407
5.0000 -181.43035 -168.06860 13.36174 3.34365 -166.63237 1304.24681
10.0000 -180.64915 -170.25857 10.39058 3.13489 -170.41091 1181.68713
15.0000 -182.55422 -171.69598 10.85824 3.05007 -171.94603 1087.84759
20.0000 -181.23074 -171.32969 9.90104 3.10952 -170.87003 1158.40929
25.0000 -183.52987 -171.51278 12.01709 3.15785 -169.99529 1190.73090
30.0000 -183.60903 -170.28391 13.32512 3.07732 -171.45283 1153.18774
35.0000 -181.18498 -170.50156 10.68342 3.16294 -169.90323 1197.51802
40.0000 -181.91681 -169.74616 12.17065 3.15744 -170.00277 1163.63343
45.0000 -183.24690 -169.03330 14.21360 3.19975 -169.23702 1232.58112
50.0000 -182.30784 -170.22344 12.08441 3.17961 -169.60144 1201.97658
55.0000 -183.13074 -169.67097 13.45977 3.13471 -170.41404 1170.87968
60.0000 -181.60334 -170.05262 11.55072 3.17583 -169.66985 1211.43810
65.0000 -178.79827 -166.57395 12.22432 3.24097 -168.49093 1236.17036
70.0000 -179.45645 -166.91132 12.54514 3.36095 -166.31932 1271.58430
75.0000 -181.73549 -171.07461 10.66088 3.28816 -167.63686 1268.63186
80.0000 -182.84024 -170.36323 12.47702 3.12805 -170.53457 1151.15661
85.0000 -182.31890 -172.44345 9.87545 3.07006 -171.58417 1117.65905
90.0000 -181.51542 -171.16784 10.34758 3.02207 -172.45286 1110.91571
95.0000 -179.68817 -166.92536 12.76281 3.25359 -168.26249 1245.39508
100.0000 -182.09686 -170.39116 11.70570 3.22288 -168.81835 1206.34333
105.0000 -180.06452 -168.99514 11.06938 3.17422 -169.69899 1187.88569
110.0000 -178.83114 -167.68845 11.14269 3.26128 -168.12323 1274.54318
115.0000 -181.50144 -167.70450 13.79694 3.25260 -168.28036 1230.14282
120.0000 -182.42078 -169.63924 12.78154 3.18018 -169.59111 1193.57160
125.0000 -180.98561 -168.68327 12.30233 3.23104 -168.67070 1216.50319
130.0000 -179.87544 -169.39948 10.47597 3.16946 -169.78525 1166.09509
135.0000 -181.33498 -168.79836 12.53662 3.22358 -168.80565 1232.64091
140.0000 -180.70836 -169.78405 10.92431 3.23995 -168.50935 1243.95890
145.0000 -179.75559 -168.01155 11.74404 3.16229 -169.91493 1231.73766
150.0000 -181.35299 -170.54428 10.80870 3.22883 -168.71068 1219.03573
155.0000 -180.98894 -169.25279 11.73614 3.20042 -169.22472 1213.00801
160.0000 -177.15445 -164.59646 12.55799 3.31683 -167.11794 1297.99825
165.0000 -179.83915 -166.42700 13.41216 3.36024 -166.33225 1309.34939
170.0000 -181.50561 -170.25480 11.25081 3.30527 -167.32703 1271.01477
175.0000 -179.19503 -167.72735 11.46767 3.21515 -168.95814 1197.44320
180.0000 -183.96709 -172.34625 11.62083 3.14770 -170.17900 1166.40677
185.0000 -183.34043 -172.11602 11.22441 3.04321 -172.07015 1098.29096
190.0000 -181.77903 -170.74088 11.03815 3.07898 -171.42287 1122.91321
195.0000 -180.18561 -167.22714 12.95847 3.30067 -167.41028 1305.04477
200.0000 -181.42918 -168.90512 12.52406 3.24959 -168.33488 1244.11644
205.0000 -181.76210 -168.18243 13.57967 3.23540 -168.59168 1219.06477
210.0000 -182.68405 -172.43838 10.24567 3.10671 -170.92097 1166.92139
215.0000 -182.26885 -170.85608 11.41277 3.00253 -172.80649 1071.17772
220.0000 -181.41925 -170.44674 10.97251 3.11572 -170.75785 1145.67612
225.0000 -181.18118 -169.95123 11.22994 3.16451 -169.87474 1208.23123
230.0000 -180.65289 -167.59069 13.06220 3.21200 -169.01527 1232.85643
235.0000 -182.05765 -167.73346 14.32419 3.30500 -167.33190 1301.90235
240.0000 -180.58559 -168.36770 12.21788 3.23463 -168.60557 1225.43557
245.0000 -181.97929 -170.10336 11.87593 3.19482 -169.32616 1197.14050
250.0000 -179.78876 -168.63015 11.15861 3.10600 -170.93368 1144.18312
FREEZING PROCESS: loop number 2 T-loop= 1158.0000000000000
main_MD> interactions number 2 at Temperature= 1158.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.33159 -0.38907 2.09032
force_rgl> df(natom) -1.59679 -0.17713 -2.66463
255.0000 -178.45073 -166.16659 12.28414 3.30313 -167.36577 1267.75290
260.0000 -180.99069 -169.28829 11.70240 3.27687 -167.84120 1223.87579
265.0000 -182.77173 -170.95787 11.81386 3.13647 -170.38219 1179.33907
270.0000 -179.53405 -168.82820 10.70586 3.23486 -168.60147 1281.75500
275.0000 -182.50580 -168.69582 13.80998 3.25305 -168.27224 1225.15957
280.0000 -183.72245 -171.72837 11.99408 3.17572 -169.67192 1211.47511
285.0000 -182.53596 -170.18032 12.35564 3.08352 -171.34067 1170.66746
290.0000 -180.33061 -167.62285 12.70776 3.22741 -168.73628 1214.57065
295.0000 -180.72291 -167.00747 13.71544 3.29163 -167.57397 1249.72827
300.0000 -176.67016 -164.16242 12.50774 3.37161 -166.12649 1319.44650
305.0000 -180.17175 -169.23325 10.93850 3.23708 -168.56138 1216.05920
310.0000 -182.37267 -171.91612 10.45656 3.12605 -170.57082 1143.09346
315.0000 -182.46172 -171.94451 10.51721 3.05817 -171.79946 1128.53656
320.0000 -181.70811 -171.60142 10.10669 3.04282 -172.07721 1093.16608
325.0000 -184.33675 -171.40401 12.93274 3.09232 -171.18129 1146.94012
330.0000 -184.34277 -173.58843 10.75434 3.04814 -171.98089 1096.65984
335.0000 -182.11394 -168.87107 13.24287 3.13107 -170.48005 1182.90087
340.0000 -182.66131 -170.37611 12.28520 3.14687 -170.19404 1183.90504
345.0000 -184.64477 -173.98262 10.66215 3.00120 -172.83051 1102.25050
350.0000 -181.88736 -169.32266 12.56470 3.12884 -170.52034 1159.44354
355.0000 -183.53688 -171.65186 11.88502 3.01148 -172.64451 1085.57970
360.0000 -181.61316 -169.83847 11.77469 3.11457 -170.77870 1162.52629
365.0000 -181.75591 -168.96311 12.79280 3.21378 -168.98299 1215.84060
370.0000 -184.19931 -171.54245 12.65686 3.12345 -170.61790 1147.52312
375.0000 -181.18378 -166.53863 14.64515 3.19836 -169.26213 1246.58807
380.0000 -182.18353 -168.64922 13.53431 3.27486 -167.87742 1285.31691
385.0000 -181.86583 -170.26205 11.60378 3.17804 -169.62996 1172.22017
390.0000 -183.64761 -171.33141 12.31620 3.09983 -171.04549 1142.50056
395.0000 -181.72540 -169.54916 12.17624 3.18236 -169.55176 1240.46874
400.0000 -181.94188 -169.66870 12.27318 3.20031 -169.22684 1223.74775
405.0000 -182.11787 -172.19288 9.92500 3.06923 -171.59924 1123.88193
410.0000 -181.57972 -169.87897 11.70075 3.16854 -169.80187 1194.87841
415.0000 -180.71209 -168.46232 12.24977 3.21832 -168.90082 1240.70516
420.0000 -179.78160 -167.17985 12.60175 3.21318 -168.99382 1185.69719
425.0000 -178.15905 -166.65409 11.50496 3.35256 -166.47125 1286.08078
430.0000 -179.85050 -168.08242 11.76808 3.26787 -168.00410 1262.27069
435.0000 -181.24756 -171.03772 10.20984 3.22140 -168.84500 1206.98748
440.0000 -182.43188 -171.00492 11.42696 3.08147 -171.37778 1133.80415
445.0000 -182.41698 -172.26259 10.15439 3.03249 -172.26423 1077.14976
450.0000 -182.15977 -170.82615 11.33362 3.09756 -171.08651 1111.43901
455.0000 -183.74467 -173.33819 10.40648 3.00624 -172.73938 1090.99825
460.0000 -183.89581 -173.27919 10.61662 3.02846 -172.33724 1114.42752
465.0000 -182.58049 -170.72324 11.85725 3.05551 -171.84763 1103.17452
470.0000 -181.92847 -172.65354 9.27493 2.97334 -173.33472 1034.89157
475.0000 -182.79981 -172.54446 10.25535 2.98623 -173.10147 1089.48448
480.0000 -184.57709 -175.22492 9.35217 2.94079 -173.92399 1037.43100
485.0000 -181.93827 -172.65493 9.28334 2.92717 -174.17051 1009.23053
490.0000 -182.76804 -171.40608 11.36197 3.03894 -172.14753 1073.64584
495.0000 -179.71857 -168.38947 11.32909 3.24245 -168.46401 1250.65106
500.0000 -181.71207 -168.79151 12.92056 3.18060 -169.58347 1198.94441
FREEZING PROCESS: loop number 3 T-loop= 1133.0000000000000
main_MD> interactions number 3 at Temperature= 1133.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.11896 -5.24238 1.54739
force_rgl> df(natom) -1.40977 2.69158 -2.39243
505.0000 -180.50494 -168.56778 11.93715 3.19853 -169.25909 1222.55175
510.0000 -182.48694 -172.78560 9.70135 3.15549 -170.03803 1202.56118
515.0000 -184.45593 -174.56865 9.88728 2.95319 -173.69953 1051.65475
520.0000 -186.13344 -175.93289 10.20055 2.90356 -174.59767 1030.18909
525.0000 -185.72834 -174.20766 11.52069 2.89740 -174.70926 1016.26077
530.0000 -181.63430 -170.67920 10.95510 3.06038 -171.75944 1130.23452
535.0000 -180.73190 -169.86815 10.86375 3.13878 -170.34044 1167.02694
540.0000 -179.08540 -167.04340 12.04199 3.27175 -167.93382 1270.14036
545.0000 -181.37369 -169.46948 11.90420 3.28976 -167.60786 1240.93039
550.0000 -179.88791 -167.83614 12.05177 3.30035 -167.41621 1273.06757
555.0000 -180.41577 -169.72527 10.69051 3.26999 -167.96564 1259.85761
560.0000 -183.96253 -172.08242 11.88011 3.16111 -169.93634 1201.79453
565.0000 -185.54644 -173.03738 12.50906 3.01236 -172.62859 1085.41574
570.0000 -183.63057 -172.11508 11.51549 3.00138 -172.82728 1107.03329
575.0000 -185.43681 -174.80173 10.63507 2.93638 -174.00374 1084.65204
580.0000 -183.60265 -173.65029 9.95237 2.87619 -175.09305 994.89656
585.0000 -185.15691 -173.26165 11.89526 2.94670 -173.81695 1036.64642
590.0000 -183.04875 -172.70158 10.34717 3.02524 -172.39537 1098.96032
595.0000 -184.68516 -174.04167 10.64350 2.97038 -173.38833 1064.43418
600.0000 -183.52683 -172.41738 11.10945 2.98046 -173.20596 1093.47396
605.0000 -182.72553 -170.79161 11.93392 3.05450 -171.86594 1124.29877
610.0000 -181.46714 -170.67512 10.79202 3.19423 -169.33692 1238.16243
615.0000 -184.08163 -172.57176 11.50988 3.02633 -172.37576 1120.21964
620.0000 -183.59011 -172.02548 11.56463 3.05650 -171.82974 1141.22379
625.0000 -183.07963 -172.89409 10.18554 3.05044 -171.93933 1120.40419
630.0000 -183.88781 -173.78351 10.10430 2.96749 -173.44058 1052.05996
635.0000 -182.18456 -171.95764 10.22693 3.01559 -172.57017 1085.34233
640.0000 -182.39391 -170.97361 11.42030 3.02298 -172.43637 1098.28312
645.0000 -181.88465 -170.97378 10.91087 3.03337 -172.24830 1082.80056
650.0000 -179.78420 -169.00970 10.77450 3.20549 -169.13296 1200.82372
655.0000 -182.03560 -171.26174 10.77386 3.15462 -170.05372 1212.74144
660.0000 -182.66463 -173.15474 9.50988 3.03401 -172.23663 1095.25300
665.0000 -183.29575 -170.48252 12.81322 3.02249 -172.44515 1101.86676
670.0000 -182.87794 -172.13886 10.73908 3.01648 -172.55390 1099.09480
675.0000 -183.79881 -173.70776 10.09106 2.97477 -173.30882 1054.61559
680.0000 -184.94355 -174.15796 10.78558 3.01268 -172.62274 1085.90216
685.0000 -183.77107 -172.11386 11.65721 3.10290 -170.98985 1167.45293
690.0000 -182.32636 -170.30478 12.02158 3.11020 -170.85768 1133.14763
695.0000 -182.34726 -170.81240 11.53485 3.11300 -170.80711 1165.02577
700.0000 -181.72715 -170.57509 11.15207 3.07160 -171.55630 1125.58192
705.0000 -182.15936 -171.86990 10.28946 3.09831 -171.07292 1136.27941
710.0000 -182.75280 -173.06482 9.68797 2.98134 -173.19002 1072.11268
715.0000 -185.19346 -173.37876 11.81469 3.01033 -172.66529 1075.31493
720.0000 -184.13371 -173.47803 10.65568 2.96646 -173.45925 1069.66717
725.0000 -182.05393 -172.39296 9.66097 2.99026 -173.02853 1019.70842
730.0000 -181.82601 -172.08076 9.74526 3.00844 -172.69947 1052.03732
735.0000 -182.73467 -170.65282 12.08185 3.08091 -171.38779 1093.45753
740.0000 -182.35790 -170.44328 11.91462 3.10595 -170.93460 1141.45998
745.0000 -181.93363 -170.73004 11.20359 3.16384 -169.88685 1159.64050
750.0000 -181.28483 -171.48721 9.79762 3.07192 -171.55054 1130.87899
FREEZING PROCESS: loop number 4 T-loop= 1108.0000000000000
main_MD> interactions number 4 at Temperature= 1108.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.64878 -1.10563 2.89083
force_rgl> df(natom) -0.10504 0.88859 -2.63824
755.0000 -182.66277 -171.81919 10.84358 3.04434 -172.04970 1087.59884
760.0000 -180.68953 -170.41470 10.27482 3.12292 -170.62750 1162.14389
765.0000 -184.17649 -172.79311 11.38338 3.00912 -172.68713 1064.41066
770.0000 -183.81594 -174.12943 9.68651 2.93540 -174.02140 1051.27043
775.0000 -182.12042 -172.39952 9.72090 2.92639 -174.18447 1065.31840
780.0000 -182.86934 -170.62512 12.24423 3.04907 -171.96419 1117.66544
785.0000 -184.21232 -172.01603 12.19629 3.04410 -172.05401 1143.46951
790.0000 -185.40123 -174.40117 11.00006 2.97773 -173.25539 1086.63131
795.0000 -182.77834 -171.91762 10.86072 3.00176 -172.82049 1052.50831
800.0000 -182.82681 -171.35822 11.46859 3.02551 -172.39052 1119.64038
805.0000 -182.07775 -169.75071 12.32704 3.12529 -170.58452 1150.53155
810.0000 -182.75216 -171.90063 10.85153 3.11963 -170.68702 1190.46382
815.0000 -185.08118 -172.87921 12.20197 3.06135 -171.74192 1115.04597
820.0000 -183.68206 -174.26955 9.41251 2.88656 -174.90542 1012.76892
825.0000 -183.48752 -172.56030 10.92722 2.91967 -174.30625 1047.62481
830.0000 -182.51042 -171.71076 10.79965 3.08505 -171.31296 1105.81831
835.0000 -181.52888 -170.57385 10.95503 3.06605 -171.65688 1117.69106
840.0000 -183.09866 -171.79236 11.30630 3.04269 -172.07961 1095.91440
845.0000 -181.50947 -171.01893 10.49054 3.12552 -170.58042 1141.90738
850.0000 -183.60441 -170.58438 13.02003 3.14839 -170.16657 1181.14660
855.0000 -181.12380 -169.34275 11.78105 3.15618 -170.02555 1186.20973
860.0000 -183.86354 -173.88300 9.98054 3.04214 -172.08954 1118.66597
865.0000 -184.09431 -173.28529 10.80902 2.89483 -174.75572 1000.57513
870.0000 -183.63087 -173.25297 10.37789 2.96996 -173.39603 1068.04645
875.0000 -182.49620 -171.86670 10.62950 3.00259 -172.80541 1081.34192
880.0000 -182.83786 -170.84413 11.99373 3.04693 -172.00285 1088.50431
885.0000 -183.89592 -172.57912 11.31680 3.09113 -171.20281 1165.94139
890.0000 -183.81634 -172.99407 10.82227 2.99188 -172.99927 1057.19955
895.0000 -181.19900 -171.25246 9.94654 3.06525 -171.67126 1108.63305
900.0000 -184.40736 -174.25581 10.15155 2.95612 -173.64653 1023.14047
905.0000 -182.94110 -171.98563 10.95546 2.95320 -173.69935 1069.80660
910.0000 -183.87179 -170.32517 13.54662 3.04420 -172.05227 1083.63787
915.0000 -182.44143 -171.12959 11.31184 3.09934 -171.05437 1133.63139
920.0000 -184.12939 -173.98462 10.14477 2.99602 -172.92431 1098.45250
925.0000 -183.56091 -173.82830 9.73260 2.93024 -174.11491 1012.70686
930.0000 -185.53101 -175.20531 10.32570 2.91990 -174.30200 1014.27642
935.0000 -182.72017 -172.69674 10.02343 2.92557 -174.19931 1029.81349
940.0000 -184.58427 -173.36296 11.22131 3.01942 -172.50072 1096.14650
945.0000 -185.09387 -174.00853 11.08534 2.96979 -173.39907 1054.12255
950.0000 -184.42668 -172.62433 11.80235 2.96974 -173.39998 1097.03365
955.0000 -183.83072 -174.05167 9.77905 2.94955 -173.76531 1056.73401
960.0000 -182.64309 -174.14536 8.49773 2.92673 -174.17833 1050.64034
965.0000 -180.45810 -169.97886 10.47924 2.98166 -173.18411 1037.08410
970.0000 -181.63821 -168.60350 13.03471 3.19757 -169.27637 1193.49883
975.0000 -183.34886 -171.83565 11.51321 3.10278 -170.99199 1154.72361
980.0000 -182.85458 -171.51548 11.33910 3.10724 -170.91132 1113.25417
985.0000 -181.88992 -170.99331 10.89660 3.14598 -170.21021 1155.58630
990.0000 -182.01130 -170.55856 11.45274 3.11928 -170.69337 1144.34111
995.0000 -180.81884 -169.41976 11.39908 3.16457 -169.87375 1191.07432
1000.0000 -181.97508 -171.73008 10.24500 3.16984 -169.77835 1186.74893
FREEZING PROCESS: loop number 5 T-loop= 1083.0000000000000
main_MD> interactions number 5 at Temperature= 1083.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.33027 0.12878 -1.44271
force_rgl> df(natom) 2.18171 2.50789 1.71198
1005.0000 -181.63568 -170.38142 11.25426 3.03486 -172.22134 1099.21936
1010.0000 -181.72210 -171.64063 10.08146 3.09536 -171.12632 1145.51323
1015.0000 -185.68115 -173.61379 12.06737 3.02490 -172.40161 1118.30321
1020.0000 -183.79402 -172.61940 11.17463 3.04953 -171.95579 1105.69712
1025.0000 -185.37844 -174.51702 10.86142 3.02116 -172.46924 1085.80596
1030.0000 -183.54687 -171.70125 11.84563 2.98102 -173.19585 1062.95730
1035.0000 -180.45244 -167.56628 12.88616 3.16437 -169.87725 1173.06529
1040.0000 -184.25887 -173.18972 11.06915 3.21194 -169.01630 1227.69797
1045.0000 -183.62083 -172.00629 11.61454 2.97236 -173.35261 1058.44443
1050.0000 -183.97031 -172.75641 11.21390 3.00679 -172.72931 1044.67472
1055.0000 -183.44446 -172.65875 10.78572 3.00141 -172.82683 1090.85949
1060.0000 -183.83422 -173.53970 10.29452 3.01328 -172.61195 1086.79755
1065.0000 -183.83984 -174.04928 9.79056 2.93941 -173.94884 1039.31052
1070.0000 -183.35167 -172.58607 10.76559 2.97707 -173.26735 1063.11178
1075.0000 -182.95091 -171.79361 11.15730 3.00386 -172.78235 1110.93256
1080.0000 -182.59665 -172.19097 10.40568 3.07295 -171.53186 1134.29696
1085.0000 -183.48317 -171.82995 11.65322 3.04390 -172.05762 1109.46445
1090.0000 -182.88220 -170.48332 12.39888 3.03629 -172.19537 1088.27327
1095.0000 -182.67647 -172.07646 10.60001 3.07765 -171.44688 1140.70997
1100.0000 -183.10037 -173.47784 9.62253 3.05097 -171.92982 1122.95119
1105.0000 -182.98666 -171.16338 11.82328 3.04156 -172.10000 1131.96783
1110.0000 -182.32908 -172.70721 9.62186 3.02747 -172.35507 1095.40425
1115.0000 -183.05422 -171.68018 11.37404 3.01971 -172.49554 1066.16152
1120.0000 -181.38528 -169.22040 12.16488 3.04693 -172.00293 1089.67031
1125.0000 -182.72963 -171.12611 11.60353 3.17667 -169.65471 1194.68142
1130.0000 -185.19635 -175.03451 10.16184 3.00997 -172.67179 1104.50067
1135.0000 -182.80816 -173.16092 9.64724 2.96844 -173.42341 1073.87603
1140.0000 -183.43278 -172.20249 11.23029 3.02601 -172.38145 1084.25444
1145.0000 -183.74408 -171.88539 11.85869 3.07925 -171.41788 1114.32857
1150.0000 -181.80942 -169.69849 12.11093 3.06976 -171.58973 1138.25138
1155.0000 -181.96935 -170.77695 11.19240 3.08132 -171.38042 1115.87055
1160.0000 -181.93617 -171.84983 10.08634 3.05602 -171.83840 1098.01765
1165.0000 -183.78631 -172.81185 10.97446 2.99587 -172.92709 1097.18242
1170.0000 -182.77807 -172.19985 10.57822 3.05553 -171.84717 1106.78324
1175.0000 -184.46904 -173.89528 10.57376 2.97845 -173.24222 1082.54034
1180.0000 -182.86303 -173.33725 9.52578 2.91581 -174.37607 1022.56282
1185.0000 -184.51185 -174.58514 9.92671 2.92988 -174.12134 1045.18696
1190.0000 -182.88027 -171.65934 11.22093 3.01778 -172.53041 1056.93465
1195.0000 -183.09045 -171.71758 11.37287 3.01025 -172.66681 1062.05275
1200.0000 -183.71481 -174.11948 9.59533 2.99232 -172.99125 1073.50179
1205.0000 -185.49952 -173.69426 11.80526 2.98046 -173.20584 1106.49427
1210.0000 -184.47231 -173.06313 11.40918 2.97247 -173.35044 1093.68071
1215.0000 -183.60258 -173.47112 10.13146 2.96427 -173.49886 1047.99416
1220.0000 -185.16506 -175.01082 10.15424 2.89600 -174.73464 1053.36342
1225.0000 -182.22737 -171.25378 10.97360 2.96572 -173.47271 1057.85733
1230.0000 -184.34604 -173.44995 10.89609 3.06998 -171.58571 1119.46144
1235.0000 -181.67997 -171.63221 10.04776 3.01335 -172.61059 1078.74959
1240.0000 -182.23631 -170.47025 11.76606 3.12591 -170.57331 1184.52293
1245.0000 -182.85704 -171.93110 10.92594 3.08348 -171.34141 1143.89549
1250.0000 -185.75383 -174.96885 10.78497 2.99349 -172.97014 1071.74060
FREEZING PROCESS: loop number 6 T-loop= 1058.0000000000000
main_MD> interactions number 6 at Temperature= 1058.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.75553 -0.40010 -1.56633
force_rgl> df(natom) -1.00148 -2.45818 1.49562
1255.0000 -184.46177 -175.25535 9.20642 2.88674 -174.90211 997.17901
1260.0000 -185.22381 -175.30109 9.92272 2.87397 -175.13326 1015.05406
1265.0000 -184.65779 -174.58148 10.07630 2.88283 -174.97290 991.35859
1270.0000 -183.70998 -172.89387 10.81611 3.01149 -172.64433 1082.70397
1275.0000 -184.15416 -172.63341 11.52076 3.08077 -171.39040 1134.89183
1280.0000 -183.71766 -173.22630 10.49136 3.01990 -172.49218 1098.04552
1285.0000 -184.27473 -173.55284 10.72188 2.98220 -173.17441 1057.76994
1290.0000 -184.76531 -174.65161 10.11371 2.88044 -175.01624 980.16965
1295.0000 -184.25597 -173.62524 10.63073 2.84634 -175.63342 994.94864
1300.0000 -184.39643 -173.94510 10.45133 2.93431 -174.04125 1049.02533
1305.0000 -184.98976 -173.23876 11.75100 2.95574 -173.65331 1076.31553
1310.0000 -184.52711 -172.22892 12.29819 3.05416 -171.87206 1119.83586
1315.0000 -183.83729 -172.35395 11.48333 2.96336 -173.51533 1065.97183
1320.0000 -184.89764 -173.45142 11.44622 3.04323 -172.06991 1116.39306
1325.0000 -184.20022 -171.79194 12.40828 2.94560 -173.83687 1062.44388
1330.0000 -184.19401 -174.36390 9.83011 2.96937 -173.40660 1066.43214
1335.0000 -183.14681 -172.59307 10.55374 2.91816 -174.33352 1012.59138
1340.0000 -185.11574 -175.65286 9.46287 2.94600 -173.82954 1034.55861
1345.0000 -184.03341 -173.28663 10.74678 2.92937 -174.13064 1059.35171
1350.0000 -185.08094 -172.55159 12.52935 2.96514 -173.48329 1054.89517
1355.0000 -184.56909 -174.17807 10.39102 2.92952 -174.12786 1010.68798
1360.0000 -184.52839 -174.63909 9.88930 2.96227 -173.53506 1055.94629
1365.0000 -183.16063 -172.43393 10.72671 2.97225 -173.35446 1048.22648
1370.0000 -184.52341 -173.87696 10.64646 3.03155 -172.28121 1081.21260
1375.0000 -183.36528 -173.46016 9.90512 2.96061 -173.56527 1043.50306
1380.0000 -184.18694 -173.74847 10.43847 2.91511 -174.38865 1005.42557
1385.0000 -185.89978 -175.52506 10.37473 2.88612 -174.91332 1016.91836
1390.0000 -184.45995 -174.21992 10.24003 2.95926 -173.58961 1045.66297
1395.0000 -185.27420 -173.25491 12.01930 2.92678 -174.17743 1041.61810
1400.0000 -183.54459 -172.05499 11.48960 3.02311 -172.43393 1076.39964
1405.0000 -183.54959 -172.66373 10.88586 3.03098 -172.29149 1109.62833
1410.0000 -183.16116 -172.14091 11.02025 3.02974 -172.31397 1084.13539
1415.0000 -184.51400 -174.41800 10.09600 2.99150 -173.00612 1070.49118
1420.0000 -181.57072 -170.80875 10.76197 3.00191 -172.81777 1082.36574
1425.0000 -183.92013 -174.55452 9.36561 3.02426 -172.41321 1114.61761
1430.0000 -183.95112 -174.09997 9.85115 2.87237 -175.16223 995.68160
1435.0000 -183.20802 -173.34763 9.86039 2.89725 -174.71203 999.47033
1440.0000 -182.99244 -172.99835 9.99409 3.03460 -172.22602 1105.03342
1445.0000 -181.16022 -170.24871 10.91151 3.12969 -170.50503 1151.96310
1450.0000 -181.87085 -170.70277 11.16808 3.12446 -170.59960 1116.66240
1455.0000 -181.72883 -172.23698 9.49185 3.08230 -171.36263 1119.28600
1460.0000 -183.76601 -173.38147 10.38454 2.96758 -173.43911 1063.77859
1465.0000 -183.35772 -173.88235 9.47537 2.96778 -173.43543 1019.36824
1470.0000 -184.01532 -174.94487 9.07046 2.94263 -173.89065 1055.38805
1475.0000 -184.66523 -174.30893 10.35630 2.91258 -174.43457 1010.55573
1480.0000 -183.89878 -174.60129 9.29749 2.92747 -174.16493 1015.02527
1485.0000 -185.14234 -173.88725 11.25509 2.93819 -173.97096 1044.19002
1490.0000 -183.09925 -172.34248 10.75678 2.94126 -173.91536 1046.62641
1495.0000 -183.07405 -172.47007 10.60398 2.96390 -173.50561 1025.80775
1500.0000 -181.06147 -170.24115 10.82032 3.03559 -172.20806 1060.42203
FREEZING PROCESS: loop number 7 T-loop= 1033.0000000000000
main_MD> interactions number 7 at Temperature= 1033.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -4.90629 0.94769 2.17493
force_rgl> df(natom) 2.42221 8.27715 -3.03033
1505.0000 -184.08046 -171.76324 12.31722 2.98886 -173.05392 1097.02426
1510.0000 -183.16380 -171.76811 11.39569 3.04092 -172.11159 1129.72335
1515.0000 -184.86512 -173.01075 11.85437 3.00277 -172.80209 1072.18743
1520.0000 -183.02678 -171.61218 11.41460 3.07422 -171.50893 1136.55709
1525.0000 -184.22852 -173.94997 10.27856 3.00333 -172.79195 1077.27889
1530.0000 -183.81911 -173.52409 10.29502 2.95862 -173.60128 1080.79282
1535.0000 -185.42073 -174.38940 11.03133 2.93165 -174.08928 1047.87226
1540.0000 -184.93922 -172.63834 12.30087 2.99230 -172.99162 1066.68004
1545.0000 -183.29613 -173.52808 9.76805 2.96919 -173.40992 1023.55511
1550.0000 -184.44214 -176.38124 8.06091 2.88400 -174.95182 982.89433
1555.0000 -182.98102 -171.57193 11.40909 2.89765 -174.70476 1021.21690
1560.0000 -184.53447 -173.58533 10.94914 3.01909 -172.50680 1091.35632
1565.0000 -182.78683 -171.05900 11.72783 3.01125 -172.64864 1085.12508
1570.0000 -185.13657 -174.74239 10.39417 2.99257 -172.98667 1053.42440
1575.0000 -182.39475 -173.04279 9.35196 2.91728 -174.34949 1015.54307
1580.0000 -183.67707 -173.74136 9.93571 2.96689 -173.45155 1034.23552
1585.0000 -186.11998 -175.49379 10.62619 2.92640 -174.18430 1028.98714
1590.0000 -186.45515 -177.10678 9.34837 2.87885 -175.04495 996.38609
1595.0000 -186.14648 -174.55226 11.59422 2.86959 -175.21258 991.56919
1600.0000 -186.12826 -176.49064 9.63762 2.91730 -174.34915 1041.27564
1605.0000 -185.55227 -176.32023 9.23203 2.83493 -175.83992 983.26216
1610.0000 -184.98040 -173.51447 11.46593 2.86369 -175.31938 1015.99219
1615.0000 -186.00096 -175.86099 10.13997 2.88076 -175.01047 1010.45840
1620.0000 -184.09566 -174.47365 9.62201 2.81568 -176.18829 969.71168
1625.0000 -185.46964 -175.84629 9.62336 2.85378 -175.49867 1004.39287
1630.0000 -184.09882 -174.24206 9.85676 2.91573 -174.37754 1039.54308
1635.0000 -185.08709 -175.55180 9.53529 2.85745 -175.43224 973.03290
1640.0000 -185.90026 -174.55645 11.34381 2.93115 -174.09840 1039.90397
1645.0000 -184.27091 -174.01918 10.25173 2.93027 -174.11427 1039.83633
1650.0000 -184.44444 -174.75337 9.69108 2.90626 -174.54895 1033.24415
1655.0000 -183.68436 -172.28656 11.39780 2.93733 -173.98655 1029.52703
1660.0000 -183.90940 -173.56930 10.34010 3.03611 -172.19867 1089.38598
1665.0000 -183.12693 -173.20596 9.92097 2.89810 -174.69649 1021.39232
1670.0000 -185.83297 -175.80968 10.02329 2.87278 -175.15487 981.91815
1675.0000 -184.71417 -175.90022 8.81395 2.84637 -175.63293 1009.95250
1680.0000 -185.51986 -173.25850 12.26136 2.92013 -174.29782 1017.05533
1685.0000 -185.13845 -173.93364 11.20480 2.94757 -173.80121 1048.98667
1690.0000 -184.26715 -173.69156 10.57559 2.93355 -174.05498 1029.42216
1695.0000 -183.98634 -174.98652 8.99981 2.93753 -173.98289 1042.64632
1700.0000 -184.24421 -174.10324 10.14098 2.88392 -174.95318 991.70413
1705.0000 -184.17947 -172.96022 11.21925 3.01682 -172.54790 1102.98200
1710.0000 -185.12058 -172.97353 12.14705 3.01544 -172.57285 1118.71749
1715.0000 -183.64305 -171.99856 11.64450 3.02280 -172.43961 1091.75587
1720.0000 -182.48403 -171.84923 10.63480 2.98930 -173.04587 1064.87269
1725.0000 -182.64369 -172.61831 10.02538 3.01189 -172.63713 1070.78290
1730.0000 -181.83180 -172.11253 9.71927 2.97401 -173.32260 1048.99254
1735.0000 -184.29334 -174.19775 10.09559 2.96132 -173.55232 1039.51907
1740.0000 -183.82669 -173.87965 9.94704 2.93655 -174.00071 1070.74630
1745.0000 -184.53789 -174.21551 10.32238 2.95813 -173.61008 1032.24140
1750.0000 -184.08539 -173.76725 10.31813 2.88118 -175.00278 997.51933
FREEZING PROCESS: loop number 8 T-loop= 1008.0000000000000
main_MD> interactions number 8 at Temperature= 1008.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.73061 -2.03540 -0.36762
force_rgl> df(natom) 1.25968 -4.43173 1.97814
1755.0000 -182.28558 -172.03820 10.24738 2.97164 -173.36559 1071.30629
1760.0000 -181.58344 -170.85851 10.72494 3.08610 -171.29397 1134.88799
1765.0000 -181.67789 -171.54842 10.12947 3.04263 -172.08063 1085.52867
1770.0000 -183.48467 -172.53767 10.94701 2.99363 -172.96763 1069.07907
1775.0000 -184.10678 -172.51368 11.59309 3.02400 -172.41786 1105.90594
1780.0000 -183.63018 -174.13001 9.50018 2.92845 -174.14719 1034.66052
1785.0000 -184.34962 -175.26705 9.08257 2.86231 -175.34439 989.08576
1790.0000 -183.76896 -174.23941 9.52955 2.88881 -174.86466 1024.70866
1795.0000 -184.01830 -174.44216 9.57614 2.92120 -174.27849 1022.87853
1800.0000 -184.55702 -175.30405 9.25297 2.85148 -175.54037 981.77284
1805.0000 -184.60654 -174.79940 9.80714 2.82937 -175.94058 972.89190
1810.0000 -186.49779 -177.57939 8.91840 2.76320 -177.13819 929.14965
1815.0000 -183.85568 -174.34430 9.51138 2.81741 -176.15709 974.80293
1820.0000 -185.47103 -175.78733 9.68370 2.87506 -175.11362 987.48946
1825.0000 -184.82569 -174.25128 10.57442 2.86465 -175.30194 992.26117
1830.0000 -181.95115 -172.76931 9.18184 3.01146 -172.64484 1085.10313
1835.0000 -184.26738 -172.86639 11.40099 3.02335 -172.42971 1090.31699
1840.0000 -183.59470 -173.31513 10.27957 2.99960 -172.85955 1055.10830
1845.0000 -184.29017 -173.79371 10.49646 2.95229 -173.71577 1042.74731
1850.0000 -184.65804 -173.46545 11.19259 2.94314 -173.88139 1037.57084
1855.0000 -184.71867 -174.28343 10.43525 2.96179 -173.54386 1028.55662
1860.0000 -185.88530 -173.88961 11.99569 2.84367 -175.68175 979.01632
1865.0000 -184.75073 -174.84235 9.90837 2.87152 -175.17762 1024.04469
1870.0000 -186.45555 -175.88905 10.56649 2.88064 -175.01261 995.82480
1875.0000 -186.42436 -176.19962 10.22474 2.82347 -176.04738 947.76201
1880.0000 -184.47933 -175.55955 8.91978 2.78648 -176.71683 955.40684
1885.0000 -184.94761 -174.83798 10.10963 2.89778 -174.70242 1016.26800
1890.0000 -184.42501 -174.98369 9.44132 2.88865 -174.86768 993.88537
1895.0000 -184.03851 -173.23293 10.80558 2.92976 -174.12361 1017.57459
1900.0000 -183.82923 -173.55599 10.27324 2.95476 -173.67107 1045.99408
1905.0000 -184.41558 -174.32385 10.09173 2.95309 -173.70137 1059.03127
1910.0000 -184.36850 -175.15148 9.21702 2.91960 -174.30752 1011.92492
1915.0000 -185.01591 -176.28270 8.73321 2.85634 -175.45237 977.76972
1920.0000 -185.52877 -174.58376 10.94500 2.91691 -174.35604 1027.68377
1925.0000 -184.82875 -173.44811 11.38063 2.94384 -173.86863 1038.47915
1930.0000 -184.73070 -174.88483 9.84587 2.89923 -174.67618 1022.45732
1935.0000 -186.64389 -177.14597 9.49792 2.83063 -175.91778 965.24493
1940.0000 -185.03682 -174.83283 10.20399 2.85052 -175.55770 994.48158
1945.0000 -181.06929 -172.53301 8.53628 2.97731 -173.26300 1075.54014
1950.0000 -183.79395 -173.07029 10.72366 3.00309 -172.79636 1100.38803
1955.0000 -185.64146 -173.65578 11.98568 2.94140 -173.91295 1057.21424
1960.0000 -185.95051 -173.56869 12.38182 2.96024 -173.57188 1069.25546
1965.0000 -187.21993 -176.67773 10.54220 2.84126 -175.72534 960.67019
1970.0000 -182.67841 -172.74643 9.93198 2.93213 -174.08066 1045.20103
1975.0000 -186.39753 -176.63604 9.76149 2.94005 -173.93738 1037.59932
1980.0000 -187.32888 -176.78811 10.54078 2.81381 -176.22223 944.87210
1985.0000 -184.92801 -176.34223 8.58578 2.77372 -176.94779 921.66303
1990.0000 -183.68225 -172.82932 10.85292 2.97099 -173.37738 1047.49281
1995.0000 -186.32597 -174.67823 11.64774 2.91912 -174.31616 1021.61138
2000.0000 -186.07575 -175.31940 10.75635 2.87238 -175.16206 1022.85168
FREEZING PROCESS: loop number 9 T-loop= 983.00000000000000
main_MD> interactions number 9 at Temperature= 983.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.26549 -3.46144 -0.05147
force_rgl> df(natom) 1.21624 0.51062 1.44190
2005.0000 -184.42623 -174.87338 9.55285 2.92026 -174.29549 1017.05430
2010.0000 -185.54006 -176.79750 8.74256 2.80700 -176.34544 958.11406
2015.0000 -186.41149 -176.32467 10.08682 2.76388 -177.12593 912.36909
2020.0000 -186.85521 -176.34021 10.51500 2.79858 -176.49786 949.59608
2025.0000 -186.88769 -178.81772 8.06997 2.70940 -178.11186 899.02182
2030.0000 -184.69388 -177.37982 7.31406 2.74990 -177.37886 905.98574
2035.0000 -186.82102 -177.54412 9.27690 2.75821 -177.22841 933.04158
2040.0000 -187.45752 -175.41542 12.04210 2.82508 -176.01814 972.86077
2045.0000 -186.79774 -177.81068 8.98706 2.82217 -176.07085 972.14568
2050.0000 -185.77438 -176.51169 9.26269 2.81071 -176.27826 974.30616
2055.0000 -183.62991 -175.88139 7.74852 2.82135 -176.08578 955.65550
2060.0000 -185.77034 -176.46510 9.30523 2.81645 -176.17441 950.26638
2065.0000 -185.44765 -176.21194 9.23570 2.83329 -175.86953 1000.41528
2070.0000 -186.14940 -176.70633 9.44306 2.84389 -175.67775 994.78074
2075.0000 -185.31127 -173.24008 12.07119 2.84207 -175.71076 970.20943
2080.0000 -185.55643 -174.79361 10.76282 2.87945 -175.03420 1030.04648
2085.0000 -186.77621 -176.42795 10.34826 2.81756 -176.15421 976.97709
2090.0000 -184.78561 -176.99385 7.79176 2.77553 -176.91508 923.72704
2095.0000 -187.06463 -177.52289 9.54174 2.74205 -177.52099 913.04540
2100.0000 -186.64622 -176.91276 9.73345 2.72123 -177.89771 900.60407
2105.0000 -185.76701 -177.38892 8.37809 2.73786 -177.59685 911.74042
2110.0000 -186.87917 -176.63944 10.23973 2.77409 -176.94111 915.51019
2115.0000 -185.66057 -176.54559 9.11499 2.80583 -176.36661 980.66925
2120.0000 -185.15045 -175.68462 9.46583 2.83365 -175.86299 985.94540
2125.0000 -184.97823 -174.43676 10.54147 2.91325 -174.42244 1024.83140
2130.0000 -184.18529 -172.42338 11.76191 2.99896 -172.87108 1101.39750
2135.0000 -184.39949 -173.85808 10.54141 2.93799 -173.97455 1016.00196
2140.0000 -185.63015 -175.20085 10.42929 2.88081 -175.00959 999.31036
2145.0000 -186.08155 -176.83788 9.24366 2.83923 -175.76210 948.99968
2150.0000 -186.23447 -175.74163 10.49284 2.79674 -176.53108 928.13637
2155.0000 -185.55831 -175.82711 9.73120 2.76477 -177.10971 917.68077
2160.0000 -184.06040 -174.74479 9.31561 2.90100 -174.64413 1017.70705
2165.0000 -184.86065 -174.95771 9.90294 2.91901 -174.31821 1038.90999
2170.0000 -186.38013 -175.85038 10.52975 2.86490 -175.29743 1026.46562
2175.0000 -185.56586 -175.58525 9.98061 2.82355 -176.04584 997.20491
2180.0000 -184.96720 -174.80708 10.16012 2.86208 -175.34842 1002.92216
2185.0000 -186.51269 -175.79309 10.71960 2.91292 -174.42835 1050.48708
2190.0000 -184.15641 -173.48430 10.67211 2.90338 -174.60096 1060.30956
2195.0000 -184.30450 -174.31956 9.98494 2.95519 -173.66323 1068.26156
2200.0000 -185.25701 -177.47638 7.78062 2.83447 -175.84829 981.45539
2205.0000 -188.18476 -177.16923 11.01553 2.76838 -177.04442 928.27194
2210.0000 -186.87086 -177.43216 9.43870 2.69801 -178.31798 884.97537
2215.0000 -186.05214 -177.36834 8.68380 2.78377 -176.76585 940.17790
2220.0000 -184.95422 -174.42679 10.52744 2.80427 -176.39490 954.15479
2225.0000 -185.58170 -176.98484 8.59686 2.86251 -175.34065 998.44621
2230.0000 -186.96740 -178.37858 8.58882 2.77273 -176.96571 947.98373
2235.0000 -185.31302 -176.91585 8.39717 2.70193 -178.24712 885.17288
2240.0000 -186.50322 -175.55715 10.94607 2.83814 -175.78176 981.36693
2245.0000 -186.30197 -174.97155 11.33042 2.89605 -174.73362 1029.63670
2250.0000 -185.19530 -175.33440 9.86090 2.90113 -174.64171 1043.22648
FREEZING PROCESS: loop number 10 T-loop= 958.00000000000000
main_MD> interactions number 10 at Temperature= 958.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.09542 5.32869 -1.27636
force_rgl> df(natom) -4.01745 -1.30825 0.96069
2255.0000 -185.41097 -176.27098 9.13999 2.80938 -176.30230 965.53196
2260.0000 -184.78052 -174.10165 10.67887 2.84534 -175.65146 1005.21018
2265.0000 -186.04503 -177.04071 9.00433 2.87092 -175.18853 1000.70041
2270.0000 -187.03625 -177.36991 9.66634 2.74933 -177.38927 911.47459
2275.0000 -185.73074 -175.14349 10.58724 2.78787 -176.69172 938.23012
2280.0000 -185.00444 -176.35041 8.65403 2.79484 -176.56548 937.39660
2285.0000 -185.23746 -176.17408 9.06338 2.84830 -175.59785 980.32735
2290.0000 -185.99637 -174.84617 11.15021 2.82741 -175.97599 973.89251
2295.0000 -186.04941 -177.00496 9.04444 2.81583 -176.18558 978.84116
2300.0000 -186.59320 -175.93827 10.65492 2.80127 -176.44920 949.55181
2305.0000 -187.70896 -178.95985 8.74910 2.73862 -177.58302 898.93646
2310.0000 -188.07097 -180.05149 8.01948 2.63383 -179.47958 842.27530
2315.0000 -187.87846 -178.85208 9.02638 2.63404 -179.47588 865.26430
2320.0000 -187.29773 -178.00354 9.29420 2.69593 -178.35565 881.42859
2325.0000 -186.23103 -176.53845 9.69258 2.80205 -176.43505 950.50384
2330.0000 -187.09999 -176.71972 10.38027 2.74016 -177.55512 900.57828
2335.0000 -186.49301 -177.79156 8.70145 2.81527 -176.19566 945.74871
2340.0000 -186.96110 -176.89776 10.06335 2.74514 -177.46495 896.63103
2345.0000 -184.45718 -175.62293 8.83425 2.81172 -176.26001 947.51882
2350.0000 -183.56512 -173.55626 10.00886 2.90249 -174.61705 996.57426
2355.0000 -184.00898 -172.85522 11.15376 2.93265 -174.07122 1024.99128
2360.0000 -185.16545 -176.85817 8.30728 2.88399 -174.95196 1026.32686
2365.0000 -185.17912 -176.17256 9.00656 2.75136 -177.35253 903.15366
2370.0000 -185.13339 -175.78462 9.34877 2.79967 -176.47807 948.21511
2375.0000 -187.00319 -178.92422 8.07897 2.75928 -177.20909 927.03991
2380.0000 -185.18548 -177.54360 7.64188 2.71009 -178.09937 888.58520
2385.0000 -184.47797 -174.72457 9.75341 2.82432 -176.03200 951.31222
2390.0000 -186.23405 -175.36281 10.87124 2.95758 -173.62009 1042.59287
2395.0000 -186.40728 -174.88021 11.52707 2.84963 -175.57381 977.50458
2400.0000 -186.78902 -176.13985 10.64917 2.84985 -175.56990 996.19920
2405.0000 -185.52349 -176.05799 9.46550 2.84664 -175.62799 957.99765
2410.0000 -184.34767 -173.15366 11.19401 2.87192 -175.17041 950.13796
2415.0000 -183.61838 -172.60418 11.01421 2.94303 -173.88338 1029.90778
2420.0000 -184.41279 -174.48202 9.93077 2.90367 -174.59571 1030.64627
2425.0000 -185.34473 -173.78199 11.56274 2.93515 -174.02607 1051.87303
2430.0000 -185.20979 -174.22896 10.98083 2.93436 -174.04023 1013.13541
2435.0000 -184.26846 -175.87268 8.39578 2.91131 -174.45746 1008.02530
2440.0000 -185.55794 -176.62966 8.92828 2.79502 -176.56221 954.89699
2445.0000 -185.40656 -176.52281 8.88375 2.75885 -177.21697 922.76627
2450.0000 -185.55934 -174.58638 10.97296 2.87687 -175.08085 1008.01118
2455.0000 -183.97240 -174.43598 9.53642 2.90763 -174.52405 1012.45113
2460.0000 -185.20326 -174.16558 11.03768 2.93187 -174.08544 1047.16499
2465.0000 -186.00987 -175.59345 10.41643 2.84779 -175.60710 986.95973
2470.0000 -185.93852 -176.68565 9.25287 2.77758 -176.87782 943.85641
2475.0000 -187.47126 -178.68489 8.78637 2.75075 -177.36352 939.13921
2480.0000 -184.42641 -174.18660 10.23980 2.83339 -175.86771 942.91997
2485.0000 -184.81707 -173.67091 11.14616 2.90202 -174.62565 1027.18769
2490.0000 -185.01223 -176.62676 8.38547 2.82996 -175.92981 988.95597
2495.0000 -183.97541 -173.59934 10.37607 2.88248 -174.97937 968.41112
2500.0000 -185.74065 -176.53730 9.20335 2.89396 -174.77154 980.15120
FREEZING PROCESS: loop number 11 T-loop= 933.00000000000000
main_MD> interactions number 11 at Temperature= 933.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.20026 -1.47397 4.41986
force_rgl> df(natom) -0.80484 1.82247 2.59811
2505.0000 -185.95429 -175.69315 10.26113 2.85332 -175.50711 996.48006
2510.0000 -184.23971 -175.63051 8.60920 2.80723 -176.34133 977.11394
2515.0000 -185.63964 -176.11765 9.52200 2.84699 -175.62165 989.34189
2520.0000 -184.72547 -176.77611 7.94936 2.84164 -175.71837 982.87232
2525.0000 -186.85463 -177.01809 9.83653 2.76834 -177.04511 960.56531
2530.0000 -185.25609 -175.47968 9.77641 2.78193 -176.79910 961.96306
2535.0000 -185.97183 -177.43879 8.53304 2.78645 -176.71738 925.83912
2540.0000 -185.44920 -176.82521 8.62400 2.78852 -176.67992 920.31126
2545.0000 -183.17983 -174.57215 8.60768 2.85782 -175.42562 974.86576
2550.0000 -181.37762 -171.84521 9.53241 2.96618 -173.46441 1082.26396
2555.0000 -185.02775 -176.66446 8.36329 2.88553 -174.92410 1017.49202
2560.0000 -184.85373 -175.33706 9.51667 2.85542 -175.46910 975.57857
2565.0000 -184.10492 -175.80657 8.29835 2.86811 -175.23944 993.51195
2570.0000 -186.64925 -177.27458 9.37467 2.86097 -175.36851 986.66737
2575.0000 -186.78004 -177.23731 9.54273 2.75864 -177.22064 942.89838
2580.0000 -188.00713 -178.77214 9.23499 2.69061 -178.45199 874.86298
2585.0000 -186.25331 -177.23329 9.02002 2.79023 -176.64892 953.40794
2590.0000 -185.65908 -176.99764 8.66145 2.78123 -176.81176 959.37243
2595.0000 -185.30898 -177.02904 8.27994 2.74808 -177.41185 915.92169
2600.0000 -187.11967 -178.66187 8.45780 2.72812 -177.77303 895.30793
2605.0000 -186.54919 -177.86663 8.68256 2.73126 -177.71629 886.26977
2610.0000 -186.50776 -177.41538 9.09238 2.74148 -177.53124 888.82092
2615.0000 -186.18447 -174.97786 11.20660 2.81331 -176.23115 972.50018
2620.0000 -187.83997 -178.07644 9.76353 2.76794 -177.05232 936.72412
2625.0000 -187.32189 -178.32955 8.99234 2.74845 -177.40508 919.58895
2630.0000 -188.03384 -179.64544 8.38840 2.65098 -179.16921 849.33768
2635.0000 -185.34594 -177.33848 8.00746 2.66712 -178.87716 838.90189
2640.0000 -187.90129 -176.99576 10.90553 2.75340 -177.31560 918.76588
2645.0000 -186.59994 -176.60581 9.99413 2.76509 -177.10403 911.25475
2650.0000 -186.93505 -177.77669 9.15836 2.78907 -176.66986 940.89824
2655.0000 -185.30361 -177.62506 7.67855 2.70531 -178.18588 897.27564
2660.0000 -187.68486 -176.66628 11.01858 2.81733 -176.15846 976.06713
2665.0000 -186.28692 -177.37711 8.90980 2.75343 -177.31491 916.37685
2670.0000 -186.88773 -178.40918 8.47855 2.73145 -177.71282 914.61700
2675.0000 -187.27186 -178.56899 8.70287 2.70417 -178.20647 885.62246
2680.0000 -187.37949 -179.32961 8.04988 2.65717 -179.05715 891.58574
2685.0000 -185.86134 -177.20614 8.65520 2.70369 -178.21527 875.59976
2690.0000 -185.96146 -176.94493 9.01653 2.77016 -177.01212 936.55709
2695.0000 -186.20164 -176.10790 10.09373 2.82629 -175.99630 955.25014
2700.0000 -185.63793 -176.01864 9.61929 2.78767 -176.69533 949.49559
2705.0000 -184.89521 -175.46964 9.42557 2.84581 -175.64305 965.19102
2710.0000 -186.32835 -175.83834 10.49000 2.83454 -175.84704 953.57917
2715.0000 -185.39161 -175.56575 9.82586 2.81431 -176.21319 958.05804
2720.0000 -186.73849 -174.91087 11.82762 2.85114 -175.54659 988.10073
2725.0000 -186.62503 -177.62330 9.00173 2.82034 -176.10390 951.31323
2730.0000 -186.10907 -176.76778 9.34130 2.76861 -177.04018 936.39847
2735.0000 -186.10622 -177.96153 8.14469 2.76977 -177.01926 940.53920
2740.0000 -186.11431 -176.98848 9.12583 2.75452 -177.29519 934.50466
2745.0000 -184.57152 -175.45077 9.12075 2.81658 -176.17198 961.07225
2750.0000 -185.23982 -175.65088 9.58894 2.87015 -175.20239 985.41389
FREEZING PROCESS: loop number 12 T-loop= 908.00000000000000
main_MD> interactions number 12 at Temperature= 908.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.97904 -1.76745 4.31065
force_rgl> df(natom) 2.74993 6.31041 -12.18795
2755.0000 -185.63890 -176.63156 9.00734 2.76838 -177.04434 925.49741
2760.0000 -185.84775 -178.79541 7.05234 2.76916 -177.03026 925.97233
2765.0000 -185.52099 -176.40038 9.12061 2.67315 -178.76800 873.98819
2770.0000 -185.54755 -177.32809 8.21946 2.73538 -177.64170 895.87344
2775.0000 -187.37198 -178.66775 8.70423 2.70026 -178.27734 898.00985
2780.0000 -185.55262 -176.87478 8.67784 2.74564 -177.45596 909.79614
2785.0000 -188.04828 -178.64379 9.40449 2.72616 -177.80855 898.48504
2790.0000 -186.85013 -177.69548 9.15465 2.72124 -177.89755 903.31419
2795.0000 -186.99594 -177.95279 9.04315 2.74421 -177.48192 921.20499
2800.0000 -187.95884 -178.18017 9.77868 2.73566 -177.63663 899.73097
2805.0000 -188.37003 -179.59066 8.77937 2.62775 -179.58966 848.15759
2810.0000 -187.45606 -179.15170 8.30436 2.68434 -178.56540 883.42599
2815.0000 -186.06169 -177.39959 8.66209 2.74371 -177.49085 901.86597
2820.0000 -186.74104 -177.25395 9.48709 2.71977 -177.92425 871.08950
2825.0000 -186.46014 -178.68383 7.77631 2.72541 -177.82214 868.56177
2830.0000 -187.89326 -178.34713 9.54612 2.59700 -180.14632 830.17793
2835.0000 -186.02431 -176.02649 9.99782 2.74445 -177.47755 918.72084
2840.0000 -186.55207 -178.85168 7.70039 2.72748 -177.78473 906.67012
2845.0000 -185.66763 -177.92260 7.74502 2.66538 -178.90865 868.32417
2850.0000 -187.44083 -177.04779 10.39303 2.77705 -176.88748 944.44821
2855.0000 -187.97053 -178.42658 9.54396 2.73158 -177.71055 880.49043
2860.0000 -187.75900 -178.73244 9.02656 2.67720 -178.69470 890.18356
2865.0000 -186.61118 -177.39150 9.21968 2.71414 -178.02614 876.88315
2870.0000 -187.43034 -178.25725 9.17308 2.74400 -177.48567 922.78394
2875.0000 -186.55072 -176.39297 10.15776 2.77736 -176.88182 954.20363
2880.0000 -189.16533 -178.84441 10.32093 2.71564 -177.99890 882.01302
2885.0000 -184.13102 -176.51833 7.61269 2.76456 -177.11356 909.59314
2890.0000 -186.69248 -177.25229 9.44019 2.79456 -176.57056 939.00352
2895.0000 -186.63247 -178.74331 7.88916 2.73667 -177.61838 887.55830
2900.0000 -188.31185 -179.78370 8.52815 2.62705 -179.60239 806.45839
2905.0000 -187.47004 -178.78101 8.68903 2.65649 -179.06945 863.51432
2910.0000 -187.91089 -179.90711 8.00378 2.61980 -179.73364 815.31317
2915.0000 -185.69505 -175.70366 9.99139 2.75066 -177.36517 897.26632
2920.0000 -184.92549 -176.28575 8.63974 2.79722 -176.52246 943.64836
2925.0000 -185.94229 -176.97483 8.96746 2.76992 -177.01653 940.07228
2930.0000 -185.12193 -176.10035 9.02158 2.82466 -176.02579 944.89302
2935.0000 -185.68642 -175.97068 9.71575 2.82656 -175.99134 963.28533
2940.0000 -186.83775 -176.94300 9.89475 2.79922 -176.48622 951.23877
2945.0000 -187.68593 -177.73970 9.94624 2.75563 -177.27512 908.22524
2950.0000 -187.41676 -177.20957 10.20719 2.74942 -177.38761 903.26352
2955.0000 -185.21014 -176.95360 8.25654 2.76631 -177.08184 951.15992
2960.0000 -186.69052 -178.80239 7.88812 2.76851 -177.04205 963.63471
2965.0000 -186.43619 -176.81782 9.61837 2.71761 -177.96324 903.05609
2970.0000 -186.57584 -177.21956 9.35627 2.80308 -176.41644 967.44894
2975.0000 -188.22525 -178.66353 9.56172 2.73864 -177.58271 935.11462
2980.0000 -187.63671 -178.61193 9.02478 2.69064 -178.45152 870.08681
2985.0000 -187.09401 -176.84572 10.24829 2.69451 -178.38146 887.55289
2990.0000 -186.42357 -175.92180 10.50176 2.80372 -176.40474 951.57446
2995.0000 -187.98472 -176.81353 11.17119 2.81154 -176.26328 961.91710
3000.0000 -187.11347 -178.38267 8.73080 2.73607 -177.62913 914.92218
FREEZING PROCESS: loop number 13 T-loop= 883.00000000000000
main_MD> interactions number 13 at Temperature= 883.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -4.28183 -3.08615 -3.62947
force_rgl> df(natom) 0.98964 -0.06752 1.09702
3005.0000 -188.32240 -180.24337 8.07903 2.62583 -179.62452 851.38287
3010.0000 -187.42562 -179.39167 8.03395 2.65046 -179.17870 869.82924
3015.0000 -187.66764 -178.95269 8.71495 2.67484 -178.73741 869.81954
3020.0000 -186.88238 -177.62952 9.25287 2.65902 -179.02378 837.38266
3025.0000 -185.91057 -176.22433 9.68625 2.77079 -177.00075 927.01421
3030.0000 -185.11773 -177.27599 7.84174 2.84039 -175.74107 976.28483
3035.0000 -185.61130 -177.50110 8.11020 2.80328 -176.41281 968.59125
3040.0000 -186.59648 -177.58156 9.01491 2.76299 -177.14202 925.94909
3045.0000 -185.82230 -177.43782 8.38449 2.74454 -177.47588 911.97873
3050.0000 -185.66827 -176.75717 8.91110 2.74326 -177.49909 892.98138
3055.0000 -187.34557 -177.98894 9.35663 2.72067 -177.90801 904.59947
3060.0000 -187.57135 -178.48875 9.08260 2.73908 -177.57471 918.37016
3065.0000 -186.28412 -177.65088 8.63324 2.72174 -177.88851 897.59366
3070.0000 -186.41997 -177.34988 9.07009 2.73520 -177.64497 900.25385
3075.0000 -187.41053 -179.09073 8.31980 2.68378 -178.57554 849.02501
3080.0000 -187.13060 -179.02970 8.10090 2.64139 -179.34289 827.89712
3085.0000 -187.24933 -179.02111 8.22821 2.67697 -178.69886 866.34962
3090.0000 -187.17633 -177.63904 9.53729 2.68346 -178.58134 873.06618
3095.0000 -187.52883 -177.89769 9.63113 2.74077 -177.54417 907.68388
3100.0000 -186.56331 -176.28646 10.27685 2.74806 -177.41222 895.86061
3105.0000 -187.02578 -178.48275 8.54303 2.78438 -176.75484 946.05560
3110.0000 -186.98381 -177.93336 9.05045 2.70717 -178.15228 890.87574
3115.0000 -187.14235 -179.35660 7.78575 2.74087 -177.54228 937.95817
3120.0000 -185.28161 -176.21657 9.06504 2.77047 -177.00654 935.90076
3125.0000 -185.72874 -176.56619 9.16256 2.78802 -176.68901 943.07585
3130.0000 -188.11361 -178.49569 9.61792 2.79068 -176.64086 941.13175
3135.0000 -186.68236 -177.61297 9.06939 2.73832 -177.58848 914.78380
3140.0000 -187.09554 -178.12800 8.96754 2.76587 -177.08988 906.16605
3145.0000 -185.29732 -175.52512 9.77220 2.79793 -176.50964 948.95622
3150.0000 -188.99380 -179.96087 9.03293 2.74597 -177.45004 926.03761
3155.0000 -187.81724 -179.29217 8.52507 2.66188 -178.97205 871.60389
3160.0000 -187.43138 -178.72184 8.70954 2.64811 -179.22112 841.04929
3165.0000 -186.70246 -178.14512 8.55734 2.68688 -178.51950 893.35054
3170.0000 -187.21402 -178.36691 8.84711 2.68625 -178.53085 872.02914
3175.0000 -188.50627 -179.19238 9.31389 2.63513 -179.45614 838.66816
3180.0000 -185.61013 -176.16726 9.44287 2.74066 -177.54607 938.53383
3185.0000 -187.86556 -177.50087 10.36469 2.80367 -176.40564 947.28982
3190.0000 -186.51348 -179.28058 7.23289 2.65711 -179.05823 846.20044
3195.0000 -186.14990 -177.44076 8.70914 2.74558 -177.45716 898.60318
3200.0000 -185.45016 -177.25900 8.19117 2.76682 -177.07257 933.65747
3205.0000 -187.54639 -177.78519 9.76119 2.76932 -177.02731 947.89252
3210.0000 -185.69511 -177.00121 8.69390 2.70626 -178.16873 900.53346
3215.0000 -189.51198 -179.73866 9.77332 2.70479 -178.19527 878.06990
3220.0000 -187.27477 -178.45905 8.81571 2.68030 -178.63855 889.68343
3225.0000 -187.64684 -179.35366 8.29318 2.61551 -179.81118 827.73283
3230.0000 -187.18083 -180.15206 7.02877 2.59465 -180.18883 808.45603
3235.0000 -186.99528 -178.43269 8.56259 2.69707 -178.33515 885.75335
3240.0000 -185.89377 -178.32958 7.56418 2.72829 -177.76996 885.02081
3245.0000 -185.23332 -176.04646 9.18686 2.77279 -176.96456 888.01900
3250.0000 -187.56145 -179.39362 8.16783 2.71640 -177.98523 884.29511
FREEZING PROCESS: loop number 14 T-loop= 858.00000000000000
main_MD> interactions number 14 at Temperature= 858.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 7.22351 4.87140 3.05733
force_rgl> df(natom) -3.35353 1.15508 -0.89312
3255.0000 -186.66868 -179.32696 7.34172 2.64162 -179.33875 845.74703
3260.0000 -188.18161 -179.05733 9.12428 2.66890 -178.84485 862.35679
3265.0000 -187.23916 -178.12211 9.11705 2.64519 -179.27398 847.94323
3270.0000 -187.35811 -178.33400 9.02411 2.67331 -178.76508 857.59212
3275.0000 -188.71230 -181.17675 7.53555 2.64574 -179.26408 845.84009
3280.0000 -188.57899 -180.01268 8.56631 2.55496 -180.90708 775.89636
3285.0000 -188.83339 -180.40542 8.42797 2.65222 -179.14681 835.83372
3290.0000 -186.30573 -177.65360 8.65213 2.60297 -180.03816 832.52619
3295.0000 -188.59918 -179.78451 8.81467 2.65472 -179.10156 868.23069
3300.0000 -188.94824 -180.41084 8.53740 2.60001 -180.09182 849.31835
3305.0000 -189.13991 -180.81203 8.32788 2.57407 -180.56121 810.22000
3310.0000 -186.32672 -178.61111 7.71561 2.60029 -180.08664 820.92115
3315.0000 -188.61535 -179.12260 9.49274 2.63389 -179.47861 854.08797
3320.0000 -187.22120 -178.87170 8.34950 2.64857 -179.21287 841.64653
3325.0000 -186.92398 -179.44569 7.47828 2.65286 -179.13523 845.33173
3330.0000 -186.83103 -178.11100 8.72003 2.66438 -178.92671 840.36592
3335.0000 -187.20958 -178.72849 8.48109 2.66561 -178.90454 842.33565
3340.0000 -189.02564 -178.32972 10.69592 2.69872 -178.30524 910.98276
3345.0000 -186.88727 -179.58731 7.29996 2.68404 -178.57097 900.98544
3350.0000 -187.29007 -179.92692 7.36315 2.64762 -179.23001 871.38037
3355.0000 -187.72363 -179.18056 8.54307 2.65657 -179.06816 830.43787
3360.0000 -188.22913 -178.41694 9.81219 2.65296 -179.13343 857.30845
3365.0000 -187.83158 -179.73387 8.09771 2.63392 -179.47804 842.41740
3370.0000 -187.65106 -179.85663 7.79443 2.65546 -179.08817 846.35959
3375.0000 -188.59745 -180.19096 8.40649 2.62347 -179.66715 820.74078
3380.0000 -189.14990 -178.20810 10.94180 2.62152 -179.70255 816.25416
3385.0000 -186.71803 -178.25137 8.46666 2.65553 -179.08699 852.52503
3390.0000 -186.67835 -178.92903 7.74932 2.71839 -177.94926 904.46201
3395.0000 -187.14555 -178.99055 8.15500 2.65149 -179.16003 856.63245
3400.0000 -187.30852 -178.32594 8.98259 2.65867 -179.03004 864.46497
3405.0000 -185.12923 -177.27515 7.85408 2.68776 -178.50349 867.79553
3410.0000 -186.76197 -177.71876 9.04321 2.76943 -177.02545 937.47194
3415.0000 -186.14582 -176.55874 9.58708 2.77032 -177.00932 939.90002
3420.0000 -187.74731 -179.73794 8.00938 2.71752 -177.96488 905.17698
3425.0000 -188.72651 -180.17152 8.55498 2.62091 -179.71344 837.25507
3430.0000 -186.83342 -178.88622 7.94720 2.69284 -178.41164 892.40433
3435.0000 -186.92670 -178.89133 8.03537 2.70516 -178.18871 897.17190
3440.0000 -187.18309 -179.65498 7.52811 2.61362 -179.84547 815.28549
3445.0000 -187.72486 -178.68979 9.03507 2.58641 -180.33800 801.95050
3450.0000 -188.10264 -179.39095 8.71170 2.68765 -178.50563 903.40406
3455.0000 -189.27601 -181.29140 7.98461 2.65188 -179.15290 876.12357
3460.0000 -187.03721 -178.60255 8.43466 2.61536 -179.81393 836.28832
3465.0000 -188.53501 -180.31066 8.22435 2.58548 -180.35471 796.81779
3470.0000 -186.21524 -177.73099 8.48425 2.69159 -178.43428 866.49984
3475.0000 -186.49402 -177.78944 8.70458 2.72503 -177.82907 914.57645
3480.0000 -187.19180 -177.70410 9.48769 2.72976 -177.74344 906.76353
3485.0000 -186.84282 -177.94535 8.89746 2.71971 -177.92522 890.65903
3490.0000 -185.83900 -175.70089 10.13811 2.72180 -177.88743 903.38534
3495.0000 -185.45147 -176.75994 8.69154 2.77803 -176.86970 895.28405
3500.0000 -186.71466 -178.46454 8.25011 2.72949 -177.74829 868.68475
FREEZING PROCESS: loop number 15 T-loop= 833.00000000000000
main_MD> interactions number 15 at Temperature= 833.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.12526 -0.25575 -4.92849
force_rgl> df(natom) -1.32598 2.69231 1.67869
3505.0000 -186.05151 -177.73563 8.31588 2.68648 -178.52666 869.11489
3510.0000 -188.42054 -180.11828 8.30226 2.63850 -179.39516 824.84339
3515.0000 -187.67168 -179.75171 7.91997 2.58858 -180.29865 816.49798
3520.0000 -188.31492 -180.15299 8.16193 2.60184 -180.05863 811.66052
3525.0000 -189.20963 -181.62197 7.58766 2.56890 -180.65485 788.88301
3530.0000 -188.38961 -181.50214 6.88747 2.53211 -181.32070 737.00310
3535.0000 -189.77612 -182.09843 7.67769 2.51167 -181.69061 775.50753
3540.0000 -188.38972 -180.28060 8.10912 2.58039 -180.44689 821.32310
3545.0000 -187.82164 -179.09351 8.72813 2.62820 -179.58152 843.16889
3550.0000 -187.45111 -179.24609 8.20502 2.60812 -179.94502 842.45521
3555.0000 -186.95599 -178.97028 7.98570 2.63509 -179.45687 832.69288
3560.0000 -188.18102 -180.90466 7.27636 2.61701 -179.78405 816.41968
3565.0000 -187.44044 -178.44242 8.99802 2.64674 -179.24591 825.66356
3570.0000 -188.43579 -178.89752 9.53827 2.69994 -178.28312 909.44584
3575.0000 -188.21953 -179.75263 8.46690 2.66245 -178.96161 869.66669
3580.0000 -185.57835 -177.15915 8.41920 2.65097 -179.16945 846.94151
3585.0000 -187.74364 -180.90967 6.83397 2.63054 -179.53926 821.96984
3590.0000 -188.53129 -179.76634 8.76495 2.58274 -180.40431 796.74617
3595.0000 -189.63607 -181.74547 7.89061 2.54480 -181.09108 782.96566
3600.0000 -189.15609 -181.65114 7.50495 2.48753 -182.12766 754.66979
3605.0000 -189.27166 -182.40850 6.86316 2.47033 -182.43895 723.98156
3610.0000 -188.90059 -181.28974 7.61085 2.53375 -181.29105 777.83780
3615.0000 -189.35948 -180.88957 8.46991 2.52719 -181.40985 777.75841
3620.0000 -188.29332 -180.12831 8.16501 2.58995 -180.27385 822.05786
3625.0000 -187.10110 -180.03418 7.06693 2.62888 -179.56921 836.49101
3630.0000 -187.98568 -180.01836 7.96732 2.65390 -179.11633 859.67301
3635.0000 -188.77112 -180.70515 8.06597 2.55580 -180.89199 790.76469
3640.0000 -188.43269 -179.55230 8.88038 2.64184 -179.33465 841.47063
3645.0000 -186.41370 -178.53146 7.88225 2.68856 -178.48915 904.66683
3650.0000 -186.46298 -178.07536 8.38762 2.68349 -178.58080 870.45050
3655.0000 -186.73067 -178.57752 8.15315 2.72036 -177.91357 887.95289
3660.0000 -187.09688 -179.15682 7.94006 2.65289 -179.13475 859.88207
3665.0000 -187.54084 -179.19487 8.34596 2.65771 -179.04747 840.78340
3670.0000 -188.69884 -181.71793 6.98091 2.52987 -181.36130 792.73934
3675.0000 -188.64532 -180.54275 8.10257 2.55590 -180.89020 785.80390
3680.0000 -189.47499 -181.60451 7.87048 2.51807 -181.57485 745.00755
3685.0000 -188.67968 -182.17708 6.50260 2.52857 -181.38484 763.26006
3690.0000 -189.89695 -182.55720 7.33975 2.46421 -182.54966 748.12788
3695.0000 -188.50072 -179.73260 8.76813 2.52013 -181.53752 801.01159
3700.0000 -187.56230 -179.86144 7.70087 2.61591 -179.80393 805.97239
3705.0000 -187.31454 -180.21933 7.09521 2.63190 -179.51456 825.40481
3710.0000 -186.61981 -178.79184 7.82797 2.61608 -179.80094 835.07532
3715.0000 -187.09250 -178.61883 8.47367 2.69008 -178.46165 886.36949
3720.0000 -187.10993 -178.63205 8.47789 2.73885 -177.57885 923.30552
3725.0000 -188.47607 -178.49771 9.97836 2.65599 -179.07857 852.90662
3730.0000 -188.34554 -180.55645 7.78909 2.63921 -179.38226 848.88143
3735.0000 -186.66004 -179.08843 7.57161 2.64228 -179.32669 868.85889
3740.0000 -188.68193 -178.70077 9.98116 2.65662 -179.06712 832.91174
3745.0000 -187.92304 -177.71877 10.20427 2.69175 -178.43127 880.96932
3750.0000 -188.87596 -180.43994 8.43602 2.62200 -179.69382 854.94297
FREEZING PROCESS: loop number 16 T-loop= 808.00000000000000
main_MD> interactions number 16 at Temperature= 808.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.50510 3.54306 1.81468
force_rgl> df(natom) 0.33669 -10.00892 3.10622
3755.0000 -188.46121 -179.82464 8.63657 2.60620 -179.97979 813.57317
3760.0000 -187.46807 -178.95850 8.50958 2.61678 -179.78831 845.91511
3765.0000 -187.36690 -179.42775 7.93915 2.60119 -180.07034 858.54894
3770.0000 -187.75474 -178.50055 9.25420 2.66717 -178.87627 875.31415
3775.0000 -186.54217 -178.77301 7.76916 2.66859 -178.85052 874.01450
3780.0000 -188.18989 -179.07871 9.11118 2.67517 -178.73136 864.19784
3785.0000 -188.75369 -180.94510 7.80859 2.57839 -180.48300 788.15981
3790.0000 -186.49312 -179.12956 7.36356 2.62004 -179.72931 850.62607
3795.0000 -188.61031 -180.12252 8.48779 2.62657 -179.61111 843.98584
3800.0000 -189.39847 -182.20884 7.18963 2.57952 -180.46255 800.14050
3805.0000 -190.13506 -182.70349 7.43157 2.46348 -182.56295 729.64796
3810.0000 -188.84765 -181.30997 7.53767 2.53050 -181.34994 789.90615
3815.0000 -187.77933 -181.23012 6.54921 2.55198 -180.96102 769.02693
3820.0000 -188.57765 -181.29641 7.28123 2.51944 -181.55001 755.07939
3825.0000 -189.41718 -181.97430 7.44288 2.50602 -181.79292 784.47364
3830.0000 -189.96632 -182.07154 7.89478 2.50216 -181.86280 780.53891
3835.0000 -189.62881 -180.86816 8.76066 2.56168 -180.78551 822.66677
3840.0000 -188.42859 -179.45829 8.97029 2.60396 -180.02027 824.24816
3845.0000 -187.57372 -179.92093 7.65278 2.61325 -179.85223 835.78015
3850.0000 -187.99032 -179.86234 8.12798 2.58744 -180.31929 799.31888
3855.0000 -188.06977 -180.07740 7.99237 2.58932 -180.28524 815.99829
3860.0000 -187.62189 -180.00562 7.61627 2.59843 -180.12037 788.85826
3865.0000 -187.76769 -180.05178 7.71591 2.60704 -179.96459 824.01961
3870.0000 -189.21547 -180.24381 8.97166 2.60017 -180.08891 815.56138
3875.0000 -187.76320 -180.29933 7.46388 2.59311 -180.21662 823.62667
3880.0000 -188.76992 -180.36070 8.40922 2.60152 -180.06452 818.54220
3885.0000 -186.57692 -177.24693 9.32999 2.67270 -178.77623 865.36905
3890.0000 -187.98324 -179.25049 8.73275 2.70979 -178.10488 903.25197
3895.0000 -187.54606 -178.27486 9.27120 2.65260 -179.13992 862.77470
3900.0000 -186.04659 -177.90618 8.14041 2.65909 -179.02252 835.35957
3905.0000 -187.27224 -177.10161 10.17063 2.72633 -177.80548 907.99766
3910.0000 -187.75530 -178.87630 8.87901 2.70046 -178.27371 906.55685
3915.0000 -188.24888 -180.01212 8.23676 2.59850 -180.11915 836.96559
3920.0000 -187.46245 -180.89685 6.56560 2.63912 -179.38400 834.98075
3925.0000 -188.57674 -181.06636 7.51038 2.55657 -180.87804 809.34477
3930.0000 -188.30899 -179.83811 8.47087 2.54737 -181.04453 772.83354
3935.0000 -189.99794 -181.48841 8.50953 2.56250 -180.77073 795.46547
3940.0000 -188.93769 -180.01821 8.91948 2.57093 -180.61819 786.29802
3945.0000 -188.18371 -180.25569 7.92802 2.61897 -179.74865 829.14852
3950.0000 -186.77422 -178.37364 8.40058 2.60353 -180.02814 801.96164
3955.0000 -188.28735 -180.92245 7.36489 2.63765 -179.41049 855.27492
3960.0000 -186.85288 -179.32575 7.52714 2.58278 -180.40357 822.43849
3965.0000 -189.85350 -181.35456 8.49894 2.55894 -180.83512 778.51993
3970.0000 -187.95076 -179.88666 8.06410 2.54124 -181.15541 800.21420
3975.0000 -189.50097 -180.82659 8.67438 2.54435 -181.09913 771.24405
3980.0000 -189.65348 -182.51459 7.13889 2.52299 -181.48580 763.92377
3985.0000 -187.98548 -180.46399 7.52149 2.54983 -180.99994 776.43461
3990.0000 -189.38569 -180.22432 9.16137 2.61125 -179.88830 797.19845
3995.0000 -189.44214 -181.21484 8.22730 2.55407 -180.92332 806.93303
4000.0000 -189.14552 -181.42451 7.72100 2.57418 -180.55930 800.88921
FREEZING PROCESS: loop number 17 T-loop= 783.00000000000000
main_MD> interactions number 17 at Temperature= 783.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.67827 -0.78545 -0.49135
force_rgl> df(natom) -0.14582 -1.64319 2.89007
4005.0000 -189.84014 -182.65067 7.18947 2.51320 -181.66301 753.99832
4010.0000 -190.27515 -183.33737 6.93777 2.42676 -183.22752 732.68868
4015.0000 -190.70734 -182.55841 8.14893 2.45172 -182.77575 727.45137
4020.0000 -190.69679 -182.15680 8.53999 2.49833 -181.93203 776.01555
4025.0000 -189.02587 -181.03607 7.98980 2.50928 -181.73400 810.32287
4030.0000 -188.00452 -179.27094 8.73359 2.60510 -179.99963 821.06957
4035.0000 -188.91721 -180.48634 8.43087 2.54429 -181.10023 795.40661
4040.0000 -188.78518 -180.92271 7.86247 2.56603 -180.70674 799.40083
4045.0000 -187.99928 -179.68605 8.31323 2.57277 -180.58483 819.21823
4050.0000 -189.39831 -182.75194 6.64637 2.49640 -181.96703 747.59551
4055.0000 -189.15309 -179.96161 9.19148 2.55467 -180.91244 765.16345
4060.0000 -188.41625 -181.48899 6.92726 2.56426 -180.73888 835.74959
4065.0000 -190.12860 -181.48417 8.64444 2.50257 -181.85533 744.93416
4070.0000 -190.42856 -182.18033 8.24824 2.51057 -181.71051 782.59643
4075.0000 -189.56506 -182.19543 7.36963 2.49025 -182.07828 758.66453
4080.0000 -189.42321 -181.50799 7.91522 2.48921 -182.09712 754.46058
4085.0000 -189.91603 -181.86182 8.05421 2.50404 -181.82867 785.63258
4090.0000 -188.73733 -181.19573 7.54160 2.53579 -181.25416 788.38726
4095.0000 -187.61056 -179.09018 8.52038 2.63999 -179.36814 829.23326
4100.0000 -190.58340 -182.89277 7.69063 2.52931 -181.37146 788.87704
4105.0000 -190.93966 -184.05217 6.88749 2.42738 -183.21631 723.50904
4110.0000 -191.22013 -181.90385 9.31628 2.39459 -183.80973 696.83788
4115.0000 -188.09358 -180.66177 7.43181 2.48308 -182.20812 769.38393
4120.0000 -189.14375 -181.16596 7.97779 2.55920 -180.83047 808.07254
4125.0000 -188.16992 -181.13679 7.03313 2.57458 -180.55205 797.30736
4130.0000 -187.71045 -179.83528 7.87517 2.55432 -180.91876 775.80438
4135.0000 -188.41376 -179.90450 8.50926 2.60483 -180.00459 847.00214
4140.0000 -189.45826 -182.14881 7.30944 2.53979 -181.18180 764.39153
4145.0000 -190.34150 -181.90427 8.43724 2.51883 -181.56107 762.85024
4150.0000 -187.61809 -180.46093 7.15716 2.54963 -181.00361 787.12649
4155.0000 -188.92902 -180.61689 8.31214 2.55002 -180.99653 777.96738
4160.0000 -188.65176 -180.62258 8.02918 2.58615 -180.34260 817.14859
4165.0000 -187.15963 -180.47635 6.68328 2.55047 -180.98838 788.96147
4170.0000 -188.58169 -179.33020 9.25148 2.62762 -179.59208 826.69244
4175.0000 -189.26080 -181.05852 8.20228 2.60511 -179.99955 819.73536
4180.0000 -188.54820 -180.57476 7.97343 2.59113 -180.25247 795.35780
4185.0000 -189.36139 -181.85512 7.50626 2.56841 -180.66371 797.49115
4190.0000 -188.92968 -180.89996 8.02971 2.49831 -181.93255 748.81649
4195.0000 -188.38543 -181.11088 7.27455 2.54608 -181.06789 796.24846
4200.0000 -188.64605 -180.21733 8.42872 2.57450 -180.55343 809.67297
4205.0000 -189.68327 -181.13942 8.54385 2.55331 -180.93703 808.36372
4210.0000 -188.73953 -180.61103 8.12849 2.54372 -181.11058 802.09376
4215.0000 -187.00174 -179.40378 7.59796 2.54768 -181.03891 792.58610
4220.0000 -188.43036 -179.99600 8.43436 2.59580 -180.16793 810.58410
4225.0000 -189.31547 -180.54679 8.76868 2.61359 -179.84608 845.91206
4230.0000 -189.48867 -180.80167 8.68700 2.56428 -180.73838 785.67321
4235.0000 -189.10058 -181.85356 7.24702 2.50507 -181.81009 759.45928
4240.0000 -189.87067 -182.64401 7.22667 2.47767 -182.30597 742.86597
4245.0000 -190.32595 -183.00399 7.32196 2.48345 -182.20144 737.60135
4250.0000 -189.26862 -182.27111 6.99752 2.45155 -182.77877 710.96555
FREEZING PROCESS: loop number 18 T-loop= 758.00000000000000
main_MD> interactions number 18 at Temperature= 758.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 5.32110 -8.38230 -7.04350
force_rgl> df(natom) 4.56143 -2.52343 -4.02489
4255.0000 -188.65086 -181.97561 6.67525 2.51630 -181.60680 780.99272
4260.0000 -190.27164 -181.86333 8.40831 2.46237 -182.58300 751.81025
4265.0000 -190.15533 -183.26988 6.88545 2.45176 -182.77506 730.77774
4270.0000 -190.74278 -182.90935 7.83342 2.45949 -182.63510 728.81814
4275.0000 -190.02993 -180.67048 9.35946 2.47896 -182.28274 743.74063
4280.0000 -189.23837 -181.25834 7.98003 2.57362 -180.56933 817.05649
4285.0000 -191.08142 -182.13568 8.94574 2.48365 -182.19777 770.15796
4290.0000 -189.61973 -182.35762 7.26211 2.53275 -181.30917 785.89847
4295.0000 -191.06809 -183.77733 7.29076 2.44202 -182.95119 726.78295
4300.0000 -189.82884 -183.33646 6.49239 2.39740 -183.75879 695.23769
4305.0000 -189.62393 -181.41141 8.21252 2.47816 -182.29717 751.12062
4310.0000 -190.07549 -183.61887 6.45662 2.46462 -182.54229 751.50083
4315.0000 -190.00832 -183.76825 6.24008 2.41217 -183.49158 697.71178
4320.0000 -188.85629 -181.33027 7.52602 2.45206 -182.76948 722.82610
4325.0000 -188.61146 -181.37899 7.23248 2.54042 -181.17028 773.64380
4330.0000 -189.77526 -182.58707 7.18819 2.49677 -181.96043 751.49152
4335.0000 -188.66520 -182.36969 6.29551 2.46151 -182.59853 734.47513
4340.0000 -189.39109 -181.88395 7.50714 2.48582 -182.15851 727.04603
4345.0000 -189.23785 -182.29814 6.93971 2.47614 -182.33375 725.91404
4350.0000 -190.65044 -182.96599 7.68445 2.41311 -183.47454 703.15022
4355.0000 -189.49469 -182.68001 6.81468 2.43720 -183.03846 704.53012
4360.0000 -189.06175 -182.64890 6.41284 2.47685 -182.32085 742.74078
4365.0000 -190.26938 -182.58772 7.68166 2.46897 -182.46352 737.12597
4370.0000 -188.49653 -179.73888 8.75765 2.52248 -181.49502 768.42659
4375.0000 -188.63280 -180.09804 8.53476 2.60583 -179.98642 839.83319
4380.0000 -190.44881 -182.21568 8.23314 2.56828 -180.66607 803.33680
4385.0000 -188.42299 -181.29525 7.12774 2.50379 -181.83325 746.87213
4390.0000 -187.94127 -180.73942 7.20186 2.58429 -180.37622 818.60278
4395.0000 -188.24309 -181.53914 6.70395 2.50863 -181.74570 768.83091
4400.0000 -189.12150 -180.94224 8.17925 2.52847 -181.38652 797.96531
4405.0000 -190.39401 -181.44770 8.94631 2.49652 -181.96492 780.41713
4410.0000 -190.52870 -182.94280 7.58590 2.48500 -182.17340 757.69628
4415.0000 -191.38892 -183.47877 7.91015 2.42482 -183.26263 713.08390
4420.0000 -189.81320 -182.37112 7.44208 2.42425 -183.27283 720.64007
4425.0000 -188.72663 -180.46579 8.26085 2.53196 -181.32352 771.58217
4430.0000 -189.08564 -180.81997 8.26567 2.59449 -180.19174 819.64484
4435.0000 -189.25310 -182.29575 6.95735 2.52415 -181.46484 776.21560
4440.0000 -188.38375 -180.93304 7.45070 2.51037 -181.71411 762.82113
4445.0000 -189.85375 -181.67125 8.18250 2.52357 -181.47536 756.49478
4450.0000 -188.54024 -182.14754 6.39270 2.46546 -182.52712 704.73967
4455.0000 -189.06788 -182.22521 6.84267 2.52569 -181.43692 746.04208
4460.0000 -188.96948 -181.10734 7.86214 2.49086 -182.06731 740.31520
4465.0000 -189.10986 -181.05683 8.05303 2.55863 -180.84073 791.36369
4470.0000 -189.84680 -182.42157 7.42523 2.55018 -180.99362 785.13378
4475.0000 -189.49950 -181.95818 7.54132 2.49877 -181.92406 769.32895
4480.0000 -188.83447 -180.40685 8.42762 2.58563 -180.35202 790.58610
4485.0000 -191.29829 -183.32617 7.97213 2.53023 -181.35482 778.47731
4490.0000 -187.83423 -180.22460 7.60963 2.51247 -181.67617 778.74997
4495.0000 -188.23498 -179.39698 8.83800 2.60973 -179.91585 841.04471
4500.0000 -188.58653 -181.62289 6.96364 2.53689 -181.23416 804.50578
FREEZING PROCESS: loop number 19 T-loop= 733.00000000000000
main_MD> interactions number 19 at Temperature= 733.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.53790 -1.07957 3.27254
force_rgl> df(natom) -3.44636 -2.08435 2.44553
4505.0000 -188.98311 -182.58736 6.39575 2.44886 -182.82741 713.51355
4510.0000 -190.32208 -182.89135 7.43073 2.43514 -183.07588 701.10416
4515.0000 -189.56427 -182.10243 7.46185 2.48393 -182.19270 740.22256
4520.0000 -189.99418 -180.69227 9.30191 2.49058 -182.07240 750.84139
4525.0000 -188.28258 -181.04349 7.23909 2.53857 -181.20380 761.82937
4530.0000 -190.08389 -181.77936 8.30453 2.50360 -181.83666 762.48809
4535.0000 -189.40129 -182.43187 6.96943 2.45181 -182.77412 712.41850
4540.0000 -188.85543 -180.98758 7.86785 2.52495 -181.45031 766.68534
4545.0000 -188.93341 -181.81406 7.11935 2.48305 -182.20861 738.67642
4550.0000 -189.00808 -180.98062 8.02746 2.53826 -181.20933 783.38921
4555.0000 -190.60688 -183.01172 7.59516 2.52023 -181.53567 759.35338
4560.0000 -189.57254 -182.61124 6.96130 2.44087 -182.97203 715.78971
4565.0000 -190.40182 -182.77058 7.63124 2.46541 -182.52801 738.81352
4570.0000 -190.54437 -183.91345 6.63092 2.44204 -182.95086 721.85043
4575.0000 -189.72560 -182.71581 7.00980 2.40802 -183.56663 713.85852
4580.0000 -190.25847 -183.52440 6.73407 2.38524 -183.97904 682.22114
4585.0000 -190.67393 -183.80434 6.86959 2.39418 -183.81718 666.69380
4590.0000 -189.20419 -180.15407 9.05012 2.45952 -182.63446 753.27377
4595.0000 -188.76550 -179.74544 9.02006 2.56341 -180.75417 799.34593
4600.0000 -188.64166 -180.26424 8.37741 2.58562 -180.35228 828.33952
4605.0000 -189.45880 -182.87825 6.58055 2.52100 -181.52177 767.83967
4610.0000 -189.35663 -182.69098 6.66565 2.46356 -182.56140 741.47169
4615.0000 -189.94026 -182.58728 7.35298 2.39992 -183.71332 694.97318
4620.0000 -190.31223 -182.72638 7.58585 2.46830 -182.47558 739.79771
4625.0000 -188.89818 -181.02738 7.87080 2.51719 -181.59084 780.54673
4630.0000 -189.96677 -182.12880 7.83798 2.44971 -182.81218 724.07157
4635.0000 -190.16165 -182.88905 7.27260 2.49938 -181.91310 772.71055
4640.0000 -190.32683 -183.75367 6.57316 2.41933 -183.36203 695.14302
4645.0000 -191.84802 -184.38628 7.46174 2.36729 -184.30384 656.43751
4650.0000 -190.48261 -183.96796 6.51464 2.36841 -184.28360 666.33644
4655.0000 -190.57434 -183.50062 7.07372 2.42454 -183.26758 711.39114
4660.0000 -190.69153 -184.79765 5.89389 2.38736 -183.94062 684.77682
4665.0000 -188.38775 -181.35342 7.03433 2.43967 -182.99385 715.77318
4670.0000 -188.48146 -181.35899 7.12247 2.54175 -181.14633 790.04749
4675.0000 -189.79037 -182.81678 6.97358 2.48170 -182.23313 725.28448
4680.0000 -190.21694 -182.74053 7.47640 2.47580 -182.33982 740.24262
4685.0000 -192.29021 -185.14174 7.14847 2.37876 -184.09629 682.40283
4690.0000 -189.43061 -182.69551 6.73509 2.39916 -183.72705 697.50097
4695.0000 -190.37423 -183.19995 7.17427 2.45472 -182.72139 736.67029
4700.0000 -191.45409 -183.35618 8.09792 2.40109 -183.69211 694.56295
4705.0000 -190.14695 -183.63108 6.51588 2.40215 -183.67296 682.62651
4710.0000 -189.92598 -183.17262 6.75336 2.44607 -182.87798 725.78720
4715.0000 -190.13384 -183.53208 6.60176 2.39119 -183.87124 692.80374
4720.0000 -189.77653 -182.10897 7.66755 2.44663 -182.86778 714.69427
4725.0000 -192.32269 -183.93834 8.38435 2.42167 -183.31968 710.92816
4730.0000 -189.65749 -182.07079 7.58670 2.42333 -183.28964 713.95846
4735.0000 -190.83213 -182.74721 8.08492 2.42087 -183.33406 709.42263
4740.0000 -189.24926 -181.18110 8.06816 2.51461 -181.63738 788.85890
4745.0000 -189.71331 -182.85082 6.86249 2.49312 -182.02632 745.97963
4750.0000 -190.19652 -183.37360 6.82292 2.49433 -182.00447 768.14513
FREEZING PROCESS: loop number 20 T-loop= 708.00000000000000
main_MD> interactions number 20 at Temperature= 708.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.93281 -0.49744 1.07466
force_rgl> df(natom) -3.15995 2.12546 0.05461
4755.0000 -190.63389 -184.32191 6.31198 2.41683 -183.40728 681.54639
4760.0000 -190.15910 -181.78355 8.37555 2.43897 -183.00643 729.23316
4765.0000 -189.32514 -182.30328 7.02187 2.51203 -181.68415 768.43480
4770.0000 -190.42910 -183.95552 6.47359 2.40894 -183.54994 691.27738
4775.0000 -191.26888 -183.90971 7.35916 2.39614 -183.78161 690.31008
4780.0000 -190.44249 -183.09095 7.35154 2.43037 -183.16209 706.12224
4785.0000 -190.00278 -182.62681 7.37597 2.46203 -182.58916 717.51490
4790.0000 -189.91805 -181.95240 7.96565 2.47274 -182.39534 702.01344
4795.0000 -190.24687 -183.33114 6.91574 2.47170 -182.41411 704.62013
4800.0000 -190.01408 -183.29748 6.71660 2.44044 -182.97979 710.23992
4805.0000 -190.35043 -182.57845 7.77198 2.45303 -182.75193 729.40441
4810.0000 -190.37789 -182.31505 8.06284 2.45352 -182.74310 741.30072
4815.0000 -188.81792 -181.64063 7.17730 2.45544 -182.70845 732.08955
4820.0000 -190.20146 -182.72137 7.48009 2.51171 -181.68993 779.34325
4825.0000 -190.78357 -184.53647 6.24710 2.41105 -183.51173 705.14374
4830.0000 -191.37940 -184.07743 7.30197 2.36750 -184.29996 680.83873
4835.0000 -189.55887 -181.52113 8.03774 2.44577 -182.88338 708.79163
4840.0000 -189.33139 -180.87510 8.45629 2.59684 -180.14916 825.79623
4845.0000 -190.03162 -183.11409 6.91753 2.46145 -182.59966 748.47348
4850.0000 -190.19508 -183.06764 7.12745 2.46140 -182.60050 740.83661
4855.0000 -190.01178 -182.00049 8.01129 2.50640 -181.78601 753.90251
4860.0000 -190.55267 -183.58113 6.97154 2.46424 -182.54903 729.10363
4865.0000 -190.00090 -182.48006 7.52085 2.40641 -183.59584 694.10202
4870.0000 -190.11739 -182.97034 7.14705 2.44652 -182.86982 708.81275
4875.0000 -190.53243 -183.57659 6.95585 2.43959 -182.99520 722.95520
4880.0000 -190.25949 -183.02565 7.23384 2.41431 -183.45284 700.99895
4885.0000 -189.98859 -182.08337 7.90523 2.47435 -182.36612 737.23089
4890.0000 -191.30233 -184.19933 7.10299 2.48831 -182.11341 737.89942
4895.0000 -190.59124 -182.40563 8.18561 2.44673 -182.86600 722.29061
4900.0000 -190.80718 -184.18187 6.62531 2.44137 -182.96302 732.37845
4905.0000 -190.90561 -184.09366 6.81195 2.39277 -183.84259 696.49435
4910.0000 -189.51987 -183.49157 6.02830 2.35345 -184.55434 657.06087
4915.0000 -190.20819 -183.13127 7.07692 2.46824 -182.47671 700.14018
4920.0000 -190.80308 -183.15421 7.64887 2.43373 -183.10137 708.35852
4925.0000 -190.16038 -182.44647 7.71391 2.44736 -182.85470 737.23079
4930.0000 -191.89716 -185.34099 6.55617 2.37271 -184.20572 684.61354
4935.0000 -190.81366 -182.99557 7.81809 2.39034 -183.88671 681.55001
4940.0000 -190.59213 -182.33132 8.26082 2.44907 -182.82370 719.36518
4945.0000 -189.78272 -182.33767 7.44505 2.46202 -182.58929 732.73684
4950.0000 -190.42263 -183.52351 6.89912 2.41507 -183.43901 713.36825
4955.0000 -191.18234 -184.61550 6.56683 2.36977 -184.25898 690.20056
4960.0000 -192.38846 -185.17130 7.21717 2.33089 -184.96259 646.18459
4965.0000 -191.01493 -184.30665 6.70828 2.38431 -183.99572 704.07889
4970.0000 -192.34042 -185.61767 6.72275 2.33966 -184.80395 650.98683
4975.0000 -190.87942 -184.70260 6.17682 2.39504 -183.80154 704.74437
4980.0000 -190.83304 -184.90559 5.92745 2.33904 -184.81523 650.69036
4985.0000 -190.57502 -184.04854 6.52648 2.34345 -184.73535 653.29907
4990.0000 -191.20231 -184.23640 6.96590 2.37846 -184.10158 680.74427
4995.0000 -190.39589 -183.80655 6.58935 2.39980 -183.71550 696.98240
5000.0000 -190.48468 -183.44977 7.03491 2.40630 -183.59778 680.66472
FREEZING PROCESS: loop number 21 T-loop= 683.00000000000000
main_MD> interactions number 21 at Temperature= 683.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 4.88529 -2.46913 2.42620
force_rgl> df(natom) -4.54226 2.83364 -2.50598
5005.0000 -190.66066 -182.16100 8.49966 2.40634 -183.59711 716.70727
5010.0000 -189.71410 -183.37572 6.33837 2.42723 -183.21895 704.69448
5015.0000 -191.61435 -185.09716 6.51719 2.36419 -184.35991 666.16690
5020.0000 -190.75650 -184.22231 6.53419 2.34520 -184.70366 658.83546
5025.0000 -190.90143 -184.56444 6.33699 2.37413 -184.18003 681.63663
5030.0000 -190.27900 -183.36243 6.91658 2.43366 -183.10250 710.28624
5035.0000 -191.54750 -184.78874 6.75876 2.36995 -184.25570 659.06728
5040.0000 -192.00618 -185.79670 6.20947 2.32571 -185.05636 640.48674
5045.0000 -191.83167 -186.09170 5.73997 2.30104 -185.50298 621.24554
5050.0000 -192.65738 -185.52884 7.12854 2.29823 -185.55379 650.25671
5055.0000 -191.47014 -183.63868 7.83146 2.33231 -184.93697 648.38711
5060.0000 -190.97509 -183.36734 7.60775 2.41681 -183.40747 701.13894
5065.0000 -190.48035 -184.13585 6.34450 2.43696 -183.04281 698.97998
5070.0000 -190.39559 -184.09316 6.30243 2.40780 -183.57060 691.64207
5075.0000 -191.28146 -184.04189 7.23957 2.36726 -184.30447 663.96259
5080.0000 -189.78698 -183.07029 6.71669 2.42544 -183.25130 730.76879
5085.0000 -190.27867 -183.76912 6.50955 2.43869 -183.01161 738.01065
5090.0000 -189.38287 -182.95077 6.43211 2.40939 -183.54185 708.62759
5095.0000 -190.76333 -183.26353 7.49980 2.45075 -182.79329 728.99263
5100.0000 -190.22296 -182.47378 7.74918 2.42065 -183.33798 707.35333
5105.0000 -191.09432 -184.19129 6.90302 2.43329 -183.10933 725.29322
5110.0000 -191.23449 -184.51899 6.71550 2.36707 -184.30788 681.72771
5115.0000 -191.83926 -185.55393 6.28533 2.29533 -185.60622 649.31406
5120.0000 -192.07090 -185.91448 6.15642 2.30973 -185.34568 675.74168
5125.0000 -191.61921 -186.06327 5.55593 2.26649 -186.12821 623.73611
5130.0000 -191.19581 -185.56189 5.63392 2.28582 -185.77846 618.23196
5135.0000 -192.11317 -185.10590 7.00727 2.33075 -184.96517 662.27241
5140.0000 -190.65101 -184.54781 6.10320 2.37719 -184.12468 663.32931
5145.0000 -191.37322 -183.77806 7.59516 2.37314 -184.19801 640.65603
5150.0000 -190.25903 -183.11646 7.14257 2.38695 -183.94809 673.19862
5155.0000 -190.05874 -183.43614 6.62260 2.43611 -183.05821 712.62934
5160.0000 -190.68615 -184.37266 6.31349 2.37703 -184.12752 686.17635
5165.0000 -192.00683 -184.71620 7.29063 2.33741 -184.84456 645.36856
5170.0000 -190.19547 -183.56730 6.62817 2.35797 -184.47252 660.19991
5175.0000 -192.28916 -185.84706 6.44210 2.32502 -185.06887 667.92187
5180.0000 -193.17254 -185.65355 7.51900 2.25980 -186.24933 617.78818
5185.0000 -192.38949 -186.07647 6.31302 2.31132 -185.31678 680.82575
5190.0000 -191.25248 -183.75985 7.49263 2.30916 -185.35589 652.50348
5195.0000 -190.60196 -182.08189 8.52007 2.43246 -183.12436 707.12915
5200.0000 -189.88615 -183.62647 6.25969 2.46230 -182.58420 744.98341
5205.0000 -190.78418 -183.30338 7.48079 2.38892 -183.91243 687.23306
5210.0000 -191.88650 -185.42993 6.45656 2.40476 -183.62566 691.08324
5215.0000 -191.96301 -185.81929 6.14373 2.32040 -185.15256 651.74166
5220.0000 -190.86700 -184.44385 6.42315 2.33856 -184.82386 644.45013
5225.0000 -191.40823 -185.05127 6.35696 2.38236 -184.03104 671.26848
5230.0000 -192.31010 -185.66759 6.64251 2.28912 -185.71870 640.69049
5235.0000 -190.22646 -183.38337 6.84309 2.34947 -184.62638 677.27627
5240.0000 -190.96245 -183.76987 7.19258 2.40497 -183.62177 698.12962
5245.0000 -191.63895 -184.92784 6.71111 2.39692 -183.76753 692.42962
5250.0000 -191.55886 -185.73441 5.82445 2.30511 -185.42929 642.39039
FREEZING PROCESS: loop number 22 T-loop= 658.00000000000000
main_MD> interactions number 22 at Temperature= 658.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.34250 -0.69798 -0.71949
force_rgl> df(natom) 1.04216 0.49550 0.68942
5255.0000 -191.56829 -185.07442 6.49387 2.33967 -184.80366 670.70498
5260.0000 -191.37913 -185.25269 6.12644 2.32665 -185.03934 643.38165
5265.0000 -191.42930 -185.06956 6.35974 2.32323 -185.10122 640.17633
5270.0000 -190.88760 -183.67671 7.21089 2.37242 -184.21097 668.38019
5275.0000 -190.77978 -184.16587 6.61392 2.35812 -184.46972 687.46482
5280.0000 -192.69224 -187.06998 5.62226 2.29450 -185.62131 654.45199
5285.0000 -191.00948 -183.91694 7.09254 2.28825 -185.73440 647.89069
5290.0000 -191.87611 -185.05633 6.81978 2.35366 -184.55060 676.54843
5295.0000 -190.77503 -184.88149 5.89354 2.33295 -184.92536 665.39222
5300.0000 -190.56169 -183.87290 6.68879 2.34100 -184.77966 656.61888
5305.0000 -190.69061 -183.36859 7.32202 2.40436 -183.63295 685.78443
5310.0000 -190.33425 -184.19604 6.13821 2.41856 -183.37584 665.78254
5315.0000 -191.44825 -184.76300 6.68525 2.37948 -184.08325 669.61934
5320.0000 -192.59463 -186.13922 6.45541 2.30907 -185.35764 624.39756
5325.0000 -191.70350 -185.76766 5.93584 2.27721 -185.93414 635.98496
5330.0000 -191.16906 -184.41301 6.75604 2.31840 -185.18867 655.96466
5335.0000 -190.00770 -183.61399 6.39371 2.39096 -183.87539 712.57512
5340.0000 -192.36673 -185.59597 6.77076 2.29202 -185.66609 625.63987
5345.0000 -192.92510 -186.02088 6.90421 2.26337 -186.18472 616.99791
5350.0000 -191.91653 -185.86849 6.04804 2.24873 -186.44971 593.16332
5355.0000 -191.20625 -185.69484 5.51141 2.28329 -185.82410 606.62750
5360.0000 -190.85174 -184.13708 6.71466 2.36797 -184.29154 659.34573
5365.0000 -190.27057 -183.75786 6.51271 2.37365 -184.18873 683.84803
5370.0000 -191.63633 -185.09576 6.54057 2.33978 -184.80174 647.93976
5375.0000 -191.74950 -183.98340 7.76610 2.33577 -184.87438 655.22783
5380.0000 -190.80661 -184.43183 6.37478 2.36045 -184.42760 680.61450
5385.0000 -191.57041 -183.71687 7.85354 2.41235 -183.48823 692.65139
5390.0000 -191.36896 -184.54625 6.82270 2.37649 -184.13741 675.94860
5395.0000 -191.30111 -184.37732 6.92379 2.35018 -184.61356 659.99862
5400.0000 -189.48903 -181.42448 8.06455 2.40834 -183.56078 708.51561
5405.0000 -190.97945 -184.73650 6.24296 2.40959 -183.53817 692.70604
5410.0000 -190.57574 -183.63524 6.94051 2.36919 -184.26946 665.11317
5415.0000 -189.62472 -184.09771 5.52701 2.41280 -183.48005 708.00051
5420.0000 -191.61235 -184.83725 6.77510 2.39059 -183.88212 677.97834
5425.0000 -191.36050 -185.28507 6.07543 2.34666 -184.67716 674.66629
5430.0000 -190.63806 -183.69046 6.94760 2.34903 -184.63441 664.73588
5435.0000 -191.38391 -184.22897 7.15493 2.41960 -183.35698 717.00760
5440.0000 -191.58710 -184.72716 6.85995 2.37919 -184.08852 682.41929
5445.0000 -191.99846 -186.02511 5.97335 2.32124 -185.13737 629.99219
5450.0000 -192.68101 -186.16037 6.52064 2.23968 -186.61354 597.39298
5455.0000 -193.10266 -187.49188 5.61078 2.16963 -187.88140 568.16280
5460.0000 -191.41866 -184.93795 6.48071 2.27191 -186.03021 651.07849
5465.0000 -192.51384 -186.26921 6.24463 2.32818 -185.01172 670.32953
5470.0000 -192.12633 -187.14766 4.97867 2.24438 -186.52844 594.53336
5475.0000 -192.89759 -186.37567 6.52193 2.24418 -186.53200 584.68207
5480.0000 -190.93603 -185.16791 5.76811 2.27920 -185.89823 601.77263
5485.0000 -190.95472 -184.40663 6.54809 2.36361 -184.37046 663.69484
5490.0000 -190.36811 -184.21310 6.15501 2.34202 -184.76120 643.14679
5495.0000 -190.81342 -184.99636 5.81707 2.33226 -184.93783 659.01062
5500.0000 -192.16371 -184.90494 7.25877 2.33135 -184.95434 647.12999
FREEZING PROCESS: loop number 23 T-loop= 633.00000000000000
main_MD> interactions number 23 at Temperature= 633.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.08212 1.26759 2.25523
force_rgl> df(natom) -0.40981 -0.31101 -0.27114
5505.0000 -191.04515 -184.85050 6.19466 2.32369 -185.09298 655.42940
5510.0000 -191.36681 -185.23707 6.12974 2.33835 -184.82760 645.14188
5515.0000 -191.65059 -184.15249 7.49811 2.32834 -185.00882 657.82263
5520.0000 -192.05004 -185.25253 6.79751 2.33720 -184.84845 634.41231
5525.0000 -191.31984 -184.93207 6.38777 2.31845 -185.18787 632.57494
5530.0000 -190.41388 -184.53009 5.88379 2.33707 -184.85075 630.14921
5535.0000 -191.67860 -185.35665 6.32195 2.34099 -184.77984 642.13536
5540.0000 -191.34132 -184.12969 7.21163 2.31979 -185.16349 635.67181
5545.0000 -189.76608 -183.80419 5.96189 2.38939 -183.90391 680.56751
5550.0000 -190.30262 -184.09737 6.20525 2.37373 -184.18735 631.00314
5555.0000 -190.81245 -184.39568 6.41676 2.35978 -184.43969 651.64604
5560.0000 -190.90680 -183.96597 6.94083 2.38815 -183.92635 693.85655
5565.0000 -190.87943 -183.44313 7.43629 2.42622 -183.23730 714.72447
5570.0000 -190.99257 -184.87839 6.11418 2.37596 -184.14699 660.27149
5575.0000 -191.98471 -185.38903 6.59569 2.32372 -185.09239 620.82462
5580.0000 -192.15425 -186.74141 5.41284 2.26995 -186.06564 627.20983
5585.0000 -192.31494 -186.35109 5.96385 2.26010 -186.24385 594.06199
5590.0000 -192.60609 -186.29378 6.31231 2.26250 -186.20049 626.64911
5595.0000 -191.76464 -184.95697 6.80767 2.30312 -185.46527 635.21553
5600.0000 -192.70227 -187.09872 5.60355 2.23688 -186.66421 589.42729
5605.0000 -191.14468 -184.21637 6.92832 2.28823 -185.73479 618.53767
5610.0000 -190.32313 -184.12592 6.19720 2.36013 -184.43334 671.78043
5615.0000 -191.67645 -185.20467 6.47178 2.33221 -184.93882 658.83176
5620.0000 -190.26078 -184.31012 5.95066 2.32561 -185.05827 644.57828
5625.0000 -190.94091 -184.35771 6.58320 2.38173 -184.04240 657.20184
5630.0000 -191.37207 -184.96131 6.41076 2.36226 -184.39481 668.80168
5635.0000 -190.98754 -184.98725 6.00030 2.31449 -185.25954 641.32977
5640.0000 -191.95435 -186.03981 5.91455 2.32965 -184.98515 645.28603
5645.0000 -193.61100 -187.55574 6.05526 2.21696 -187.02476 583.18457
5650.0000 -192.30947 -186.38269 5.92678 2.20943 -187.16107 582.67141
5655.0000 -192.09778 -185.86122 6.23656 2.31196 -185.30520 627.72749
5660.0000 -192.99124 -186.25654 6.73471 2.28435 -185.80494 616.62465
5665.0000 -191.83217 -185.80074 6.03143 2.29937 -185.53314 633.84881
5670.0000 -190.90311 -184.94153 5.96158 2.27858 -185.90942 605.79274
5675.0000 -191.95892 -184.87401 7.08492 2.27876 -185.90620 598.43046
5680.0000 -191.40979 -185.01848 6.39130 2.32506 -185.06822 645.58635
5685.0000 -192.12914 -186.89199 5.23715 2.29200 -185.66646 594.25367
5690.0000 -193.34698 -186.65594 6.69105 2.23322 -186.73036 585.26808
5695.0000 -191.43183 -184.66717 6.76466 2.29936 -185.53333 642.80812
5700.0000 -191.77981 -186.25488 5.52493 2.31389 -185.27028 628.44060
5705.0000 -192.65323 -186.97376 5.67947 2.26786 -186.10343 595.65248
5710.0000 -193.63181 -187.73781 5.89400 2.19733 -187.37996 559.17444
5715.0000 -192.51552 -187.01609 5.49943 2.20173 -187.30034 571.11396
5720.0000 -192.18933 -185.65833 6.53099 2.24682 -186.48425 589.29903
5725.0000 -190.94380 -185.01312 5.93068 2.31808 -185.19443 646.31223
5730.0000 -190.93886 -184.18059 6.75827 2.37876 -184.09628 680.79934
5735.0000 -189.56652 -183.75567 5.81085 2.39777 -183.75224 661.72795
5740.0000 -190.25012 -184.28540 5.96472 2.39917 -183.72690 689.53910
5745.0000 -190.44453 -185.01291 5.43162 2.31775 -185.20039 640.75691
5750.0000 -191.74212 -186.41093 5.33119 2.24815 -186.46018 586.59826
FREEZING PROCESS: loop number 24 T-loop= 608.00000000000000
main_MD> interactions number 24 at Temperature= 608.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.55251 1.78352 2.42096
force_rgl> df(natom) 1.55107 -0.87956 -1.13140
5755.0000 -193.23509 -187.04166 6.19342 2.20314 -187.27490 564.47196
5760.0000 -192.51982 -187.09609 5.42373 2.25531 -186.33055 612.53944
5765.0000 -194.41619 -188.47808 5.93811 2.20066 -187.31975 558.85623
5770.0000 -193.52516 -188.13596 5.38921 2.15306 -188.18125 517.05657
5775.0000 -192.05439 -185.67713 6.37727 2.20979 -187.15443 570.62045
5780.0000 -191.68069 -185.93122 5.74946 2.29452 -185.62091 622.98886
5785.0000 -191.00355 -184.79809 6.20546 2.29846 -185.54958 629.93468
5790.0000 -191.27621 -186.15542 5.12079 2.29437 -185.62363 626.66683
5795.0000 -191.99290 -185.75405 6.23885 2.31851 -185.18676 645.12909
5800.0000 -192.06224 -185.67669 6.38555 2.28265 -185.83570 600.89594
5805.0000 -191.95604 -186.56223 5.39381 2.29834 -185.55173 613.75232
5810.0000 -192.11270 -185.46646 6.64623 2.28098 -185.86600 624.67091
5815.0000 -192.88809 -187.37163 5.51647 2.24640 -186.49189 600.32448
5820.0000 -193.51314 -187.95274 5.56040 2.19938 -187.34293 545.02687
5825.0000 -192.27973 -187.59049 4.68924 2.20339 -187.27036 570.31929
5830.0000 -192.85414 -187.10336 5.75078 2.22457 -186.88705 568.84413
5835.0000 -192.44485 -186.73143 5.71342 2.19783 -187.37097 553.62151
5840.0000 -192.84631 -186.77549 6.07082 2.25782 -186.28512 602.93434
5845.0000 -192.37674 -187.05422 5.32251 2.26453 -186.16363 588.23751
5850.0000 -191.59591 -184.96433 6.63158 2.26297 -186.19186 589.94270
5855.0000 -192.41686 -184.12864 8.28822 2.32708 -185.03153 655.90846
5860.0000 -191.97673 -185.62489 6.35184 2.31611 -185.23008 648.24481
5865.0000 -192.52998 -186.33081 6.19916 2.29181 -185.66999 621.61068
5870.0000 -192.49388 -186.11002 6.38386 2.27389 -185.99427 604.98761
5875.0000 -192.19712 -186.06091 6.13620 2.28782 -185.74222 637.01525
5880.0000 -193.33903 -187.31744 6.02159 2.23953 -186.61615 600.77251
5885.0000 -193.18690 -187.66038 5.52652 2.19023 -187.50850 556.57388
5890.0000 -192.24899 -186.79633 5.45267 2.19711 -187.38404 560.04444
5895.0000 -194.17935 -187.34771 6.83164 2.20804 -187.18615 576.90823
5900.0000 -192.47348 -185.57450 6.89898 2.25062 -186.41543 600.84092
5905.0000 -193.02674 -186.50799 6.51875 2.29576 -185.59847 642.73253
5910.0000 -192.77019 -187.19694 5.57325 2.22205 -186.93253 577.18449
5915.0000 -193.11200 -188.40157 4.71044 2.17965 -187.69999 551.58886
5920.0000 -194.23962 -188.08352 6.15611 2.15369 -188.16991 545.68279
5925.0000 -192.35931 -186.90569 5.45362 2.20229 -187.29014 570.84567
5930.0000 -192.68903 -186.20733 6.48170 2.24608 -186.49756 600.97635
5935.0000 -191.74549 -185.27219 6.47330 2.29182 -185.66984 635.87899
5940.0000 -191.55688 -186.37772 5.17916 2.27549 -185.96532 644.76525
5945.0000 -192.16073 -186.01107 6.14966 2.27709 -185.93648 606.22043
5950.0000 -192.72416 -187.65746 5.06670 2.21851 -186.99656 569.86454
5955.0000 -193.02675 -186.99175 6.03501 2.23903 -186.62518 569.11029
5960.0000 -191.89236 -184.81147 7.08088 2.27945 -185.89368 630.49305
5965.0000 -190.89148 -184.95157 5.93990 2.33518 -184.88496 663.00794
5970.0000 -191.48680 -184.51464 6.97216 2.34613 -184.68685 652.55779
5975.0000 -191.72532 -184.50702 7.21830 2.37807 -184.10879 653.89816
5980.0000 -191.16003 -184.01861 7.14142 2.38815 -183.92635 677.99690
5985.0000 -191.06940 -184.87813 6.19127 2.34940 -184.62772 653.89705
5990.0000 -191.12559 -185.00175 6.12383 2.36805 -184.29007 679.71651
5995.0000 -191.81416 -185.36521 6.44895 2.27603 -185.95554 598.53093
6000.0000 -193.01513 -186.75691 6.25823 2.24894 -186.44596 588.20701
FREEZING PROCESS: loop number 25 T-loop= 583.00000000000000
main_MD> interactions number 25 at Temperature= 583.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.29696 -1.26053 -0.07488
force_rgl> df(natom) -1.43405 -3.17492 -1.61120
6005.0000 -193.23438 -186.99732 6.23706 2.19979 -187.33541 574.72314
6010.0000 -193.57072 -187.54257 6.02815 2.17094 -187.85767 561.41878
6015.0000 -193.21217 -188.22898 4.98320 2.18249 -187.64849 552.32947
6020.0000 -192.74605 -186.99605 5.74999 2.20224 -187.29104 544.91707
6025.0000 -193.66343 -188.46188 5.20155 2.17738 -187.74101 559.49584
6030.0000 -193.85114 -187.35129 6.49985 2.18692 -187.56839 558.32375
6035.0000 -194.25094 -188.51671 5.73422 2.15453 -188.15464 554.67511
6040.0000 -192.69209 -186.31071 6.38137 2.18746 -187.55856 570.44044
6045.0000 -193.00118 -187.07666 5.92452 2.24977 -186.43094 622.10616
6050.0000 -193.45579 -186.74535 6.71045 2.21246 -187.10612 612.61374
6055.0000 -192.67081 -186.58567 6.08514 2.24555 -186.50725 608.02572
6060.0000 -192.35086 -186.19433 6.15653 2.26151 -186.21836 597.83049
6065.0000 -191.79067 -184.25756 7.53311 2.30072 -185.50871 628.37279
6070.0000 -192.95429 -186.78040 6.17389 2.30095 -185.50458 626.23489
6075.0000 -191.93853 -186.66156 5.27697 2.22674 -186.84763 580.52036
6080.0000 -191.88890 -186.00314 5.88576 2.26901 -186.08263 595.90686
6085.0000 -191.76716 -186.12175 5.64540 2.27351 -186.00117 610.48724
6090.0000 -191.06232 -185.31680 5.74552 2.29718 -185.57281 617.07395
6095.0000 -192.88950 -186.63695 6.25256 2.27931 -185.89622 624.22853
6100.0000 -191.66350 -185.77913 5.88437 2.24433 -186.52939 583.29178
6105.0000 -193.01362 -188.00652 5.00710 2.24918 -186.44160 600.28445
6110.0000 -193.01197 -186.86217 6.14980 2.20871 -187.17394 592.52449
6115.0000 -193.14243 -187.39118 5.75125 2.24870 -186.45019 634.49891
6120.0000 -193.34544 -187.12070 6.22474 2.20800 -187.18691 595.51354
6125.0000 -194.71148 -189.33067 5.38080 2.15788 -188.09398 577.23366
6130.0000 -192.41228 -186.93109 5.48120 2.18868 -187.53653 588.95681
6135.0000 -192.99403 -186.81290 6.18113 2.18874 -187.53547 575.84316
6140.0000 -193.06785 -187.15209 5.91576 2.21208 -187.11303 567.51109
6145.0000 -193.42922 -187.11127 6.31796 2.20032 -187.32587 574.56756
6150.0000 -195.00403 -189.42674 5.57729 2.13214 -188.55988 527.71077
6155.0000 -193.43344 -188.09838 5.33506 2.13548 -188.49940 531.10027
6160.0000 -193.25460 -187.70766 5.54693 2.18862 -187.53757 580.43951
6165.0000 -193.05093 -187.33759 5.71335 2.20134 -187.30746 579.73465
6170.0000 -193.40161 -187.53444 5.86717 2.15882 -188.07691 558.38802
6175.0000 -193.10778 -187.71709 5.39069 2.20449 -187.25033 580.66817
6180.0000 -192.22100 -187.04112 5.17989 2.19568 -187.40982 554.37364
6185.0000 -192.26434 -185.72019 6.54415 2.27724 -185.93375 621.52187
6190.0000 -191.73544 -185.97851 5.75694 2.29999 -185.52192 613.06215
6195.0000 -192.47412 -186.84117 5.63295 2.23788 -186.64612 597.49572
6200.0000 -192.73479 -187.54505 5.18974 2.20848 -187.17809 565.33373
6205.0000 -192.68264 -186.47611 6.20653 2.20808 -187.18534 561.40750
6210.0000 -192.14923 -186.24179 5.90744 2.26114 -186.22504 602.29231
6215.0000 -192.60202 -187.20559 5.39643 2.25200 -186.39056 586.13557
6220.0000 -192.64534 -186.63738 6.00796 2.23044 -186.78063 572.23373
6225.0000 -193.29121 -187.43281 5.85840 2.22038 -186.96286 594.01547
6230.0000 -192.79766 -186.82196 5.97570 2.26219 -186.20611 602.90217
6235.0000 -192.74247 -186.48362 6.25884 2.23240 -186.74526 585.56841
6240.0000 -193.08137 -187.54884 5.53253 2.23840 -186.63672 587.13862
6245.0000 -191.86141 -186.34997 5.51144 2.24419 -186.53191 591.56431
6250.0000 -191.94046 -185.38370 6.55676 2.29515 -185.60956 618.97727
FREEZING PROCESS: loop number 26 T-loop= 558.00000000000000
main_MD> interactions number 26 at Temperature= 558.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.32723 -0.41913 -0.64176
force_rgl> df(natom) 2.80037 0.92355 0.04237
6255.0000 -191.19313 -185.43275 5.76038 2.24277 -186.55751 581.43354
6260.0000 -192.92642 -186.82472 6.10171 2.25947 -186.25525 582.91224
6265.0000 -190.69971 -184.77732 5.92239 2.29195 -185.66735 610.24342
6270.0000 -191.76960 -186.35481 5.41479 2.29401 -185.63011 613.98464
6275.0000 -193.65733 -187.86226 5.79507 2.21538 -187.05326 576.10567
6280.0000 -192.70420 -186.67889 6.02531 2.18213 -187.65511 555.19422
6285.0000 -192.38459 -187.52144 4.86315 2.20730 -187.19955 573.22409
6290.0000 -191.96482 -186.22276 5.74206 2.23666 -186.66809 585.27028
6295.0000 -192.32129 -187.81683 4.50447 2.21146 -187.12424 544.38404
6300.0000 -192.75212 -188.00745 4.74466 2.15357 -188.17201 523.32996
6305.0000 -193.87654 -189.15222 4.72432 2.17067 -187.86242 561.34330
6310.0000 -191.98075 -186.93576 5.04499 2.13548 -188.49940 533.24873
6315.0000 -191.59930 -186.20758 5.39172 2.24083 -186.59271 597.51057
6320.0000 -192.04245 -187.15280 4.88965 2.24034 -186.60161 581.31176
6325.0000 -193.09788 -187.27956 5.81831 2.20254 -187.28567 558.86154
6330.0000 -193.13422 -187.63263 5.50159 2.18214 -187.65488 545.94249
6335.0000 -193.15948 -187.95039 5.20909 2.16834 -187.90468 547.15882
6340.0000 -194.03126 -188.41009 5.62117 2.17019 -187.87118 556.58183
6345.0000 -192.46107 -186.42725 6.03382 2.20942 -187.16122 563.64781
6350.0000 -192.57743 -186.77842 5.79901 2.27343 -186.00262 600.46770
6355.0000 -191.74514 -186.60040 5.14474 2.23657 -186.66979 592.81190
6360.0000 -193.49835 -187.52353 5.97481 2.20198 -187.29576 584.71711
6365.0000 -192.54742 -186.87323 5.67419 2.17875 -187.71620 557.20193
6370.0000 -193.28214 -188.05958 5.22256 2.16313 -187.99901 528.59363
6375.0000 -193.50725 -188.40680 5.10045 2.13912 -188.43349 532.45759
6380.0000 -193.83724 -188.84748 4.98976 2.12865 -188.62297 515.67744
6385.0000 -193.84678 -187.94674 5.90004 2.13328 -188.53930 510.84491
6390.0000 -192.14730 -185.84453 6.30277 2.24837 -186.45622 602.73083
6395.0000 -193.62093 -187.97346 5.64747 2.21287 -187.09878 565.48831
6400.0000 -192.99952 -186.50006 6.49946 2.21354 -187.08651 589.99611
6405.0000 -191.60735 -185.88977 5.71758 2.26194 -186.21060 621.62952
6410.0000 -192.37206 -186.65793 5.71413 2.24526 -186.51254 587.62359
6415.0000 -193.62463 -188.66102 4.96362 2.17361 -187.80935 537.60055
6420.0000 -194.62924 -189.62462 5.00462 2.11717 -188.83085 511.72488
6425.0000 -192.90180 -188.26929 4.63251 2.10281 -189.09073 505.76944
6430.0000 -194.03649 -187.79859 6.23790 2.16929 -187.88746 545.66896
6435.0000 -192.05963 -187.02913 5.03050 2.20435 -187.25289 578.28633
6440.0000 -193.35647 -188.07631 5.28015 2.19780 -187.37156 553.04229
6445.0000 -193.49019 -188.28293 5.20727 2.15298 -188.18278 524.49131
6450.0000 -192.09023 -187.08229 5.00793 2.17086 -187.85909 538.90680
6455.0000 -192.00463 -186.41773 5.58690 2.18738 -187.56009 565.03037
6460.0000 -192.63535 -187.78096 4.85439 2.19075 -187.49912 566.59473
6465.0000 -193.31195 -187.77366 5.53829 2.19526 -187.41744 557.23166
6470.0000 -192.91176 -187.97787 4.93389 2.19104 -187.49377 543.79025
6475.0000 -193.51508 -188.57604 4.93904 2.17357 -187.80999 541.34395
6480.0000 -192.94513 -187.95341 4.99172 2.17377 -187.80635 544.75731
6485.0000 -192.59909 -187.42937 5.16972 2.18294 -187.64038 537.95689
6490.0000 -193.24651 -187.82322 5.42329 2.19031 -187.50707 536.97223
6495.0000 -193.38287 -188.13166 5.25121 2.14297 -188.36383 527.34802
6500.0000 -192.84709 -187.64983 5.19726 2.16308 -187.99986 530.06269
FREEZING PROCESS: loop number 27 T-loop= 533.00000000000000
main_MD> interactions number 27 at Temperature= 533.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.40995 -1.10450 -3.63991
force_rgl> df(natom) -2.82525 0.18886 -0.50174
6505.0000 -192.68436 -187.31634 5.36802 2.15255 -188.19049 521.44605
6510.0000 -193.32696 -187.24575 6.08121 2.18663 -187.57369 562.41591
6515.0000 -192.85799 -187.78765 5.07034 2.19440 -187.43304 566.18134
6520.0000 -194.18416 -189.27288 4.91128 2.14998 -188.23706 526.65313
6525.0000 -193.72147 -188.40993 5.31154 2.10744 -189.00691 503.32865
6530.0000 -193.96663 -188.57247 5.39417 2.11254 -188.91462 512.68728
6535.0000 -194.00174 -188.57653 5.42521 2.12833 -188.62880 511.08642
6540.0000 -192.48960 -187.41078 5.07882 2.18445 -187.61309 559.03653
6545.0000 -193.51889 -187.03793 6.48097 2.22116 -186.94872 580.19060
6550.0000 -193.09771 -186.89698 6.20072 2.23430 -186.71090 580.53713
6555.0000 -193.47053 -187.82730 5.64323 2.19649 -187.39520 569.43014
6560.0000 -193.74728 -189.02946 4.71781 2.13469 -188.51365 544.17729
6565.0000 -193.42384 -187.04287 6.38097 2.16045 -188.04745 554.17565
6570.0000 -193.47525 -188.23659 5.23866 2.16700 -187.92902 551.27805
6575.0000 -194.63637 -190.15641 4.47996 2.09772 -189.18283 507.99704
6580.0000 -194.63344 -189.76172 4.87171 2.06838 -189.71382 485.96080
6585.0000 -194.62038 -189.87381 4.74656 2.09815 -189.17514 528.55809
6590.0000 -195.68304 -189.91309 5.76995 2.07722 -189.55387 523.65326
6595.0000 -195.52785 -190.74125 4.78660 2.03720 -190.27819 493.19749
6600.0000 -194.39951 -189.78190 4.61761 2.02185 -190.55597 495.91931
6605.0000 -195.11276 -188.82335 6.28940 2.06525 -189.77047 517.02460
6610.0000 -193.61810 -187.67667 5.94143 2.16276 -188.00569 603.72415
6615.0000 -193.06170 -187.01003 6.05167 2.18602 -187.58475 589.42959
6620.0000 -193.32410 -188.47479 4.84931 2.19677 -187.39020 584.49992
6625.0000 -193.30937 -188.27549 5.03388 2.15167 -188.20635 542.92586
6630.0000 -193.27910 -188.57186 4.70724 2.13371 -188.53143 529.58708
6635.0000 -193.28727 -187.45460 5.83266 2.18492 -187.60464 546.72075
6640.0000 -193.03624 -187.56985 5.46639 2.16900 -187.89273 543.24373
6645.0000 -193.91989 -187.72698 6.19292 2.17928 -187.70659 538.89834
6650.0000 -194.43841 -188.99064 5.44777 2.15711 -188.10801 522.77211
6655.0000 -194.94179 -189.92916 5.01263 2.09075 -189.30905 482.28448
6660.0000 -193.60357 -189.37751 4.22605 2.07619 -189.57248 481.97110
6665.0000 -193.19600 -187.80760 5.38840 2.11166 -188.93057 501.24449
6670.0000 -193.00373 -187.53953 5.46421 2.19739 -187.37883 567.46203
6675.0000 -193.19396 -187.77593 5.41803 2.19624 -187.39973 551.30146
6680.0000 -193.73178 -188.30907 5.42271 2.17055 -187.86459 548.12639
6685.0000 -193.49003 -187.91490 5.57513 2.17361 -187.80934 541.88006
6690.0000 -192.50434 -187.11730 5.38704 2.17452 -187.79276 538.64093
6695.0000 -191.89171 -187.13553 4.75618 2.21470 -187.06554 555.74579
6700.0000 -193.08120 -187.26889 5.81231 2.21561 -187.04915 560.11227
6705.0000 -193.60559 -188.34067 5.26492 2.18290 -187.64121 553.51328
6710.0000 -194.11591 -188.08685 6.02905 2.14638 -188.30210 524.63482
6715.0000 -194.50969 -188.83011 5.67957 2.13075 -188.58501 530.96598
6720.0000 -194.42755 -189.65279 4.77475 2.09911 -189.15768 521.24612
6725.0000 -195.14454 -189.70514 5.43940 2.08014 -189.50100 509.41142
6730.0000 -194.56925 -189.32306 5.24619 2.06148 -189.83878 501.17768
6735.0000 -194.90943 -188.55010 6.35933 2.12697 -188.65352 560.16071
6740.0000 -193.72139 -188.44588 5.27550 2.13514 -188.50557 576.18604
6745.0000 -194.30802 -188.03972 6.26830 2.12083 -188.76465 565.20734
6750.0000 -195.09645 -190.89068 4.20577 2.09117 -189.30142 506.89318
FREEZING PROCESS: loop number 28 T-loop= 508.00000000000000
main_MD> interactions number 28 at Temperature= 508.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.20036 -2.69453 -0.06973
force_rgl> df(natom) -0.98813 -0.56961 1.41785
6755.0000 -195.39652 -190.10147 5.29505 2.03391 -190.33779 498.84842
6760.0000 -194.84476 -190.51857 4.32619 2.05142 -190.02081 505.27127
6765.0000 -195.30827 -190.07038 5.23789 2.05930 -189.87816 508.22003
6770.0000 -195.02590 -189.12949 5.89640 2.07723 -189.55369 524.48994
6775.0000 -193.84634 -188.65638 5.18996 2.10326 -189.08266 518.01381
6780.0000 -194.44423 -188.82425 5.61999 2.11313 -188.90390 530.94517
6785.0000 -194.83860 -189.86693 4.97167 2.10176 -189.10972 549.97574
6790.0000 -195.08293 -190.41623 4.66669 2.03002 -190.40823 487.40415
6795.0000 -194.98557 -189.74601 5.23956 2.03841 -190.25632 490.74323
6800.0000 -195.31017 -190.42727 4.88291 2.04239 -190.18422 497.73907
6805.0000 -195.00839 -190.07455 4.93383 2.02898 -190.42706 484.83099
6810.0000 -194.75168 -189.33399 5.41769 2.07794 -189.54078 523.79081
6815.0000 -194.59123 -189.47363 5.11761 2.07802 -189.53935 537.04650
6820.0000 -194.66924 -189.75582 4.91343 2.07872 -189.52665 513.03500
6825.0000 -195.16103 -190.03657 5.12446 2.04892 -190.06612 498.94498
6830.0000 -194.80771 -189.94848 4.85923 2.05383 -189.97716 495.62609
6835.0000 -195.09114 -190.46453 4.62661 2.02882 -190.42989 481.38907
6840.0000 -195.45867 -189.72196 5.73671 2.06703 -189.73838 505.82659
6845.0000 -195.27510 -190.23917 5.03593 2.05606 -189.93691 491.54053
6850.0000 -194.68445 -190.02510 4.65935 2.07769 -189.54536 513.06797
6855.0000 -194.06158 -189.13768 4.92390 2.06823 -189.71667 506.76455
6860.0000 -194.05925 -188.95820 5.10106 2.10734 -189.00874 541.44553
6865.0000 -193.89698 -189.06440 4.83258 2.11701 -188.83369 548.05881
6870.0000 -195.12264 -189.19708 5.92556 2.09594 -189.21513 518.08134
6875.0000 -194.84173 -190.27367 4.56806 2.05258 -189.99990 477.10754
6880.0000 -195.00352 -190.14795 4.85557 2.05755 -189.90981 463.05712
6885.0000 -194.83888 -189.44465 5.39423 2.04917 -190.06162 490.98585
6890.0000 -194.48852 -189.23601 5.25251 2.10531 -189.04550 524.45657
6895.0000 -194.45677 -188.62297 5.83380 2.09334 -189.26218 517.89726
6900.0000 -194.72892 -189.19886 5.53006 2.11463 -188.87682 534.28795
6905.0000 -194.04700 -188.98314 5.06386 2.07026 -189.67978 510.04087
6910.0000 -195.56421 -189.94145 5.62276 2.07133 -189.66051 517.91465
6915.0000 -195.91427 -191.08994 4.82433 2.01247 -190.72580 467.97515
6920.0000 -194.93577 -190.07895 4.85682 2.03055 -190.39859 492.19547
6925.0000 -195.16426 -190.24210 4.92216 2.03722 -190.27791 485.26099
6930.0000 -194.49515 -188.80806 5.68709 2.08215 -189.46464 526.83762
6935.0000 -194.75929 -189.64185 5.11743 2.07236 -189.64179 520.20648
6940.0000 -194.24903 -189.17044 5.07860 2.07862 -189.52846 508.91494
6945.0000 -194.69225 -189.57369 5.11857 2.13194 -188.56344 568.77418
6950.0000 -194.18703 -188.52274 5.66429 2.13318 -188.54101 560.13661
6955.0000 -194.26890 -188.49384 5.77506 2.16502 -187.96484 585.85205
6960.0000 -193.68461 -189.66021 4.02440 2.07576 -189.58024 511.59555
6965.0000 -194.24278 -188.62073 5.62205 2.09476 -189.23647 514.74152
6970.0000 -193.54657 -188.01328 5.53328 2.15044 -188.22861 545.32980
6975.0000 -193.66443 -188.74321 4.92121 2.16071 -188.04283 564.12709
6980.0000 -193.73145 -188.11944 5.61202 2.13273 -188.54913 530.89789
6985.0000 -194.28937 -189.76804 4.52132 2.11953 -188.78814 507.24842
6990.0000 -193.66938 -189.56982 4.09956 2.09823 -189.17367 504.20981
6995.0000 -194.65218 -189.02397 5.62821 2.10012 -189.13949 502.74112
7000.0000 -194.19026 -189.27424 4.91602 2.08100 -189.48552 504.15366
FREEZING PROCESS: loop number 29 T-loop= 483.00000000000000
main_MD> interactions number 29 at Temperature= 483.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.09103 1.76698 2.33645
force_rgl> df(natom) -0.76633 0.99788 0.19914
7005.0000 -195.08468 -190.31281 4.77186 2.08828 -189.35362 508.84404
7010.0000 -193.91793 -189.78055 4.13738 2.05821 -189.89800 475.76998
7015.0000 -194.45417 -190.43261 4.02156 2.05636 -189.93136 462.34911
7020.0000 -194.15188 -188.61143 5.54045 2.06079 -189.85121 479.61951
7025.0000 -194.05687 -189.41715 4.63972 2.07445 -189.60401 493.34720
7030.0000 -194.57240 -190.29248 4.27992 2.07389 -189.61407 500.42247
7035.0000 -193.74809 -189.00128 4.74681 2.06652 -189.74760 480.86499
7040.0000 -194.39221 -189.44732 4.94489 2.08321 -189.44544 490.08235
7045.0000 -194.66657 -189.96987 4.69670 2.07574 -189.58071 482.44978
7050.0000 -193.30267 -188.63240 4.67028 2.11982 -188.78289 510.40492
7055.0000 -194.80668 -189.01090 5.79578 2.12707 -188.65170 514.51546
7060.0000 -194.37833 -189.32431 5.05402 2.09899 -189.15986 498.69021
7065.0000 -193.93433 -189.08693 4.84740 2.08263 -189.45597 473.72588
7070.0000 -193.95722 -188.12189 5.83533 2.12228 -188.73839 499.31405
7075.0000 -193.50930 -188.60798 4.90132 2.14252 -188.37204 511.67476
7080.0000 -194.06595 -189.37855 4.68740 2.13934 -188.42954 522.16220
7085.0000 -194.70656 -189.81612 4.89044 2.07854 -189.53007 488.11109
7090.0000 -193.88818 -189.19745 4.69073 2.08948 -189.33205 497.51412
7095.0000 -194.60134 -189.62375 4.97759 2.09161 -189.29351 482.66141
7100.0000 -194.15435 -189.24622 4.90812 2.11460 -188.87742 511.31205
7105.0000 -194.35885 -189.79701 4.56184 2.07605 -189.57500 471.70559
7110.0000 -193.71600 -189.36070 4.35530 2.09397 -189.25079 469.94585
7115.0000 -194.26147 -189.38285 4.87862 2.09391 -189.25180 480.06770
7120.0000 -194.02979 -189.72350 4.30629 2.05923 -189.87954 469.95478
7125.0000 -194.96121 -189.33923 5.62198 2.08769 -189.36444 517.80413
7130.0000 -194.19593 -189.56550 4.63042 2.08049 -189.49474 490.64651
7135.0000 -194.92396 -191.00701 3.91695 2.04990 -190.04844 468.49704
7140.0000 -194.00078 -188.85136 5.14943 2.06245 -189.82113 481.20277
7145.0000 -195.29761 -189.89721 5.40039 2.08534 -189.40696 497.60534
7150.0000 -194.78987 -189.43605 5.35382 2.07854 -189.52995 489.17041
7155.0000 -194.37697 -189.95918 4.41779 2.08802 -189.35835 491.73633
7160.0000 -193.76293 -188.06135 5.70157 2.09357 -189.25789 504.89121
7165.0000 -194.35504 -188.84132 5.51373 2.13211 -188.56049 546.16314
7170.0000 -194.72725 -190.24458 4.48267 2.07700 -189.55792 498.80668
7175.0000 -195.61551 -191.47965 4.13586 2.01864 -190.61406 459.61519
7180.0000 -194.98078 -190.22850 4.75228 2.00530 -190.85553 460.05098
7185.0000 -195.05220 -190.07982 4.97238 2.03185 -190.37496 472.46224
7190.0000 -194.70442 -190.29934 4.40507 2.03863 -190.25233 468.13290
7195.0000 -193.51873 -188.98647 4.53226 2.06014 -189.86294 470.74008
7200.0000 -194.34804 -189.85110 4.49695 2.08644 -189.38697 514.77942
7205.0000 -193.80098 -189.57958 4.22141 2.06716 -189.73590 508.18262
7210.0000 -195.10812 -190.65346 4.45466 2.04264 -190.17977 492.71566
7215.0000 -195.14921 -190.48890 4.66030 2.03012 -190.40638 484.31413
7220.0000 -194.59560 -189.55752 5.03807 2.02774 -190.44948 483.76140
7225.0000 -196.14909 -190.80643 5.34266 2.03621 -190.29607 491.49649
7230.0000 -195.86636 -191.70363 4.16273 1.97880 -191.33526 439.07349
7235.0000 -194.89771 -189.47508 5.42263 2.05042 -190.03886 498.08654
7240.0000 -194.24626 -189.45302 4.79324 2.07652 -189.56650 510.46137
7245.0000 -195.16046 -190.75835 4.40211 2.02992 -190.40993 466.03181
7250.0000 -195.04482 -190.67141 4.37341 2.01723 -190.63957 461.67969
FREEZING PROCESS: loop number 30 T-loop= 458.00000000000000
main_MD> interactions number 30 at Temperature= 458.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.08321 1.62260 0.07187
force_rgl> df(natom) -0.24511 0.35913 2.17203
7255.0000 -195.35990 -190.41677 4.94313 2.01422 -190.69408 468.61605
7260.0000 -195.80687 -191.10386 4.70302 2.01692 -190.64534 466.21320
7265.0000 -196.31549 -192.12879 4.18670 1.97846 -191.34132 451.30003
7270.0000 -195.74344 -191.06443 4.67900 1.96055 -191.66561 435.48118
7275.0000 -196.15381 -191.14034 5.01347 2.00075 -190.93795 469.48550
7280.0000 -194.56127 -189.69404 4.86723 2.03128 -190.38538 493.24721
7285.0000 -195.87783 -191.74191 4.13592 2.01992 -190.59092 477.34471
7290.0000 -195.92460 -191.89713 4.02747 1.93687 -192.09409 426.55629
7295.0000 -195.17829 -191.45389 3.72439 1.97151 -191.46713 437.57386
7300.0000 -195.38746 -191.05396 4.33351 1.97829 -191.34447 444.32208
7305.0000 -195.10225 -190.20430 4.89795 1.98757 -191.17653 450.66927
7310.0000 -195.72407 -191.99026 3.73381 2.00435 -190.87269 467.37149
7315.0000 -195.73104 -191.69695 4.03410 1.92986 -192.22091 384.87613
7320.0000 -194.40282 -190.22201 4.18080 2.00673 -190.82969 451.71574
7325.0000 -194.69128 -189.56156 5.12971 2.06886 -189.70521 496.93341
7330.0000 -195.28494 -190.49299 4.79195 2.05586 -189.94052 458.36162
7335.0000 -195.16803 -190.58421 4.58382 2.03014 -190.40606 444.01923
7340.0000 -194.09019 -189.80991 4.28028 2.03355 -190.34429 438.56375
7345.0000 -194.86748 -189.64972 5.21776 2.08522 -189.40913 492.77205
7350.0000 -195.09616 -190.62951 4.46666 2.03395 -190.33698 466.86453
7355.0000 -195.27614 -190.72140 4.55475 2.03708 -190.28036 473.45448
7360.0000 -196.02989 -191.40936 4.62054 2.00930 -190.78312 442.51680
7365.0000 -195.52178 -190.86467 4.65711 1.99684 -191.00869 440.61733
7370.0000 -195.41498 -190.78789 4.62709 2.01016 -190.76763 453.73468
7375.0000 -196.08177 -191.21732 4.86446 2.01309 -190.71451 481.12151
7380.0000 -196.08799 -191.65632 4.43167 1.96749 -191.53999 457.28356
7385.0000 -195.78184 -191.86256 3.91927 1.95433 -191.77813 464.59428
7390.0000 -195.67491 -191.64640 4.02851 1.96065 -191.66367 472.24029
7395.0000 -196.91783 -192.42547 4.49236 1.96663 -191.55555 472.49860
7400.0000 -196.47392 -192.21186 4.26206 1.92574 -192.29558 441.85747
7405.0000 -196.18454 -192.52260 3.66194 1.92775 -192.25917 448.55149
7410.0000 -196.29117 -191.72796 4.56321 1.93849 -192.06474 452.25086
7415.0000 -197.32672 -192.22044 5.10628 1.93344 -192.15621 454.94492
7420.0000 -197.59893 -193.56812 4.03080 1.88682 -192.99990 418.68744
7425.0000 -197.53336 -193.23662 4.29674 1.86478 -193.39898 396.81626
7430.0000 -195.90625 -192.06438 3.84188 1.89660 -192.82302 422.28467
7435.0000 -197.38993 -192.55633 4.83360 1.91779 -192.43947 439.51011
7440.0000 -196.60598 -192.16626 4.43972 1.92647 -192.28238 450.35265
7445.0000 -196.61443 -192.99306 3.62137 1.91140 -192.55518 428.67646
7450.0000 -196.89161 -192.56132 4.33029 1.91209 -192.54263 440.16482
7455.0000 -197.52421 -193.00070 4.52351 1.89620 -192.83025 424.02250
7460.0000 -195.94064 -191.30719 4.63345 1.91879 -192.42128 440.76128
7465.0000 -196.41558 -191.98652 4.42906 1.95837 -191.70491 475.26332
7470.0000 -196.77660 -192.47462 4.30198 1.93046 -192.21007 450.26769
7475.0000 -195.80395 -191.50975 4.29419 1.95630 -191.74251 464.76403
7480.0000 -196.86087 -192.46831 4.39256 1.93275 -192.16870 454.96819
7485.0000 -197.56297 -192.89121 4.67176 1.88162 -193.09412 414.20684
7490.0000 -196.93368 -192.28924 4.64444 1.92127 -192.37651 444.38136
7495.0000 -196.04772 -191.42128 4.62643 1.94876 -191.87892 466.13045
7500.0000 -196.94580 -192.58349 4.36231 1.95801 -191.71152 465.69327
FREEZING PROCESS: loop number 31 T-loop= 433.00000000000000
main_MD> interactions number 31 at Temperature= 433.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.54146 -1.79201 -1.16184
force_rgl> df(natom) -1.60597 -1.98170 -0.05116
7505.0000 -196.99092 -192.26430 4.72662 1.91012 -192.57836 432.66171
7510.0000 -196.89104 -192.97604 3.91501 1.89966 -192.76753 426.42444
7515.0000 -197.33593 -192.74568 4.59026 1.89208 -192.90481 414.74747
7520.0000 -196.46344 -192.11140 4.35204 1.90487 -192.67335 429.63526
7525.0000 -196.92795 -192.48834 4.43961 1.93719 -192.08831 454.21191
7530.0000 -197.27722 -192.73151 4.54571 1.91329 -192.52092 439.71710
7535.0000 -196.14854 -192.06990 4.07865 1.93242 -192.17459 441.10555
7540.0000 -196.33000 -191.95672 4.37329 1.94106 -192.01835 444.70740
7545.0000 -197.74713 -193.47077 4.27636 1.91716 -192.45086 439.40842
7550.0000 -196.60991 -192.51194 4.09797 1.89438 -192.86309 419.93087
7555.0000 -196.65917 -192.31250 4.34667 1.92623 -192.28670 448.10831
7560.0000 -196.72274 -191.23005 5.49269 1.95292 -191.80371 462.91651
7565.0000 -196.59264 -192.77978 3.81286 1.93490 -192.12971 448.53519
7570.0000 -197.58684 -192.84038 4.74647 1.89184 -192.90911 420.54011
7575.0000 -196.65418 -192.39490 4.25927 1.90780 -192.62026 432.39901
7580.0000 -197.09686 -192.72929 4.36757 1.89523 -192.84778 420.29667
7585.0000 -196.85302 -192.70458 4.14844 1.89572 -192.83885 420.69861
7590.0000 -197.00019 -193.26436 3.73583 1.89258 -192.89576 419.07255
7595.0000 -197.30950 -192.98750 4.32200 1.88631 -193.00919 406.66226
7600.0000 -196.29671 -192.49863 3.79808 1.90854 -192.60688 424.48709
7605.0000 -196.34864 -192.92922 3.41942 1.89660 -192.82303 423.59529
7610.0000 -197.35531 -192.93400 4.42130 1.87930 -193.13604 409.07590
7615.0000 -196.87411 -192.43773 4.43638 1.89914 -192.77693 426.27962
7620.0000 -196.97153 -192.61649 4.35504 1.89790 -192.79945 425.88737
7625.0000 -197.25987 -192.15767 5.10219 1.94045 -192.02940 456.78567
7630.0000 -196.25290 -191.65893 4.59397 1.93583 -192.11293 453.44743
7635.0000 -197.37263 -192.59875 4.77389 1.92894 -192.23769 450.73731
7640.0000 -197.41870 -192.39050 5.02820 1.91319 -192.52264 439.05934
7645.0000 -196.86570 -192.56125 4.30445 1.91316 -192.52326 435.87603
7650.0000 -197.27093 -193.30740 3.96353 1.88636 -193.00828 407.37051
7655.0000 -196.29209 -192.47234 3.81975 1.88505 -193.03193 417.21165
7660.0000 -195.59344 -191.17579 4.41766 1.93637 -192.10310 452.47134
7665.0000 -196.05174 -191.42875 4.62299 1.97886 -191.33412 482.61113
7670.0000 -196.76253 -192.84335 3.91917 1.92706 -192.27159 444.52567
7675.0000 -197.33497 -193.26087 4.07411 1.87033 -193.29844 398.33915
7680.0000 -196.63469 -192.27304 4.36165 1.92828 -192.24950 450.56323
7685.0000 -197.24501 -192.87141 4.37359 1.92127 -192.37640 442.93111
7690.0000 -196.75533 -192.67735 4.07798 1.90673 -192.63959 433.12814
7695.0000 -196.61324 -192.11368 4.49956 1.91880 -192.42108 439.01822
7700.0000 -197.18389 -192.40012 4.78377 1.92732 -192.26695 445.85252
7705.0000 -197.08801 -192.46765 4.62036 1.91217 -192.54115 434.89819
7710.0000 -195.91740 -191.77324 4.14415 1.92643 -192.28304 432.69993
7715.0000 -196.58463 -191.97510 4.60953 1.96198 -191.63957 454.40385
7720.0000 -197.12364 -192.87035 4.25329 1.93194 -192.18327 455.28275
7725.0000 -197.26169 -192.15586 5.10583 1.93984 -192.04036 459.07246
7730.0000 -196.53592 -192.36379 4.17212 1.95758 -191.71930 472.35847
7735.0000 -196.86866 -192.59745 4.27121 1.89667 -192.82175 424.32264
7740.0000 -196.52409 -192.20523 4.31885 1.91443 -192.50021 436.83433
7745.0000 -196.29349 -191.78767 4.50583 1.93418 -192.14281 450.39124
7750.0000 -196.08684 -191.63749 4.44935 1.93873 -192.06053 445.14732
FREEZING PROCESS: loop number 32 T-loop= 408.00000000000000
main_MD> interactions number 32 at Temperature= 408.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.75682 0.73721 -2.85738
force_rgl> df(natom) -1.04102 0.10782 -1.78852
7755.0000 -196.29841 -192.12661 4.17180 1.96627 -191.56192 469.75584
7760.0000 -196.63439 -193.11704 3.51735 1.90978 -192.58450 428.73195
7765.0000 -196.86817 -192.57463 4.29354 1.88137 -193.09871 406.21875
7770.0000 -197.45094 -193.30724 4.14370 1.88006 -193.12226 406.13713
7775.0000 -196.98684 -193.03714 3.94970 1.87209 -193.26653 405.73208
7780.0000 -197.73329 -193.10690 4.62638 1.87563 -193.20258 405.42408
7785.0000 -197.12848 -193.45164 3.67684 1.88666 -193.00291 415.67054
7790.0000 -197.53539 -193.27570 4.25969 1.85838 -193.51476 390.86517
7795.0000 -197.23143 -193.02031 4.21112 1.88300 -193.06914 415.19103
7800.0000 -196.96973 -192.66093 4.30881 1.89099 -192.92446 416.56883
7805.0000 -197.96468 -194.29898 3.66570 1.84615 -193.73609 383.10940
7810.0000 -197.70229 -193.83019 3.87210 1.82886 -194.04899 372.31860
7815.0000 -197.33738 -192.99757 4.33981 1.91677 -192.45789 442.10440
7820.0000 -197.42863 -193.16910 4.25952 1.88816 -192.97573 412.33349
7825.0000 -197.29917 -193.32575 3.97342 1.86791 -193.34224 395.16559
7830.0000 -197.21401 -193.33271 3.88130 1.88293 -193.07044 407.90054
7835.0000 -197.03385 -192.69885 4.33500 1.88482 -193.03619 415.11462
7840.0000 -198.11776 -194.74719 3.37057 1.84562 -193.74566 375.79248
7845.0000 -197.48610 -193.55875 3.92735 1.81965 -194.21573 359.33128
7850.0000 -197.44064 -193.10578 4.33486 1.88625 -193.01034 410.45919
7855.0000 -197.56499 -193.23437 4.33062 1.89173 -192.91105 421.58900
7860.0000 -196.76084 -193.53801 3.22282 1.85188 -193.63240 383.19172
7865.0000 -196.37554 -192.69192 3.68362 1.86577 -193.38102 393.58406
7870.0000 -197.09270 -192.88338 4.20932 1.90253 -192.71572 427.08645
7875.0000 -197.60452 -192.71311 4.89142 1.90975 -192.58490 431.18314
7880.0000 -196.80669 -192.18699 4.61970 1.92315 -192.34237 441.89307
7885.0000 -196.99935 -193.16631 3.83304 1.92680 -192.27642 450.64946
7890.0000 -196.68677 -192.19626 4.49051 1.89293 -192.88937 421.05107
7895.0000 -196.73720 -192.61625 4.12094 1.91045 -192.57224 427.37420
7900.0000 -197.42433 -193.05778 4.36655 1.91032 -192.57461 433.86744
7905.0000 -197.51074 -193.65932 3.85142 1.86868 -193.32824 404.41171
7910.0000 -197.83979 -193.49762 4.34217 1.85312 -193.60995 389.85133
7915.0000 -196.74126 -192.87842 3.86284 1.89520 -192.84830 418.84387
7920.0000 -197.06862 -193.07407 3.99456 1.90697 -192.63527 427.12602
7925.0000 -196.91500 -193.24451 3.67049 1.86205 -193.44826 395.63004
7930.0000 -197.06177 -193.01230 4.04947 1.85913 -193.50108 388.28339
7935.0000 -196.97600 -192.14718 4.82882 1.90229 -192.71999 422.38149
7940.0000 -196.92910 -192.51451 4.41459 1.93677 -192.09585 452.81257
7945.0000 -196.68665 -192.40091 4.28573 1.92479 -192.31277 437.95183
7950.0000 -197.58706 -193.11329 4.47376 1.89417 -192.86691 416.47895
7955.0000 -196.86947 -192.76196 4.10752 1.89527 -192.84708 416.78999
7960.0000 -197.13482 -192.79373 4.34109 1.88910 -192.95876 417.34975
7965.0000 -196.85541 -193.06207 3.79335 1.86616 -193.37398 397.31910
7970.0000 -197.84586 -193.91111 3.93475 1.86796 -193.34128 397.45652
7975.0000 -196.88824 -192.88034 4.00790 1.86655 -193.36685 401.22063
7980.0000 -197.29463 -193.56751 3.72712 1.87827 -193.15477 412.67884
7985.0000 -197.55776 -192.95682 4.60094 1.87557 -193.20358 402.26055
7990.0000 -197.25855 -194.10125 3.15730 1.85993 -193.48672 391.80641
7995.0000 -197.20738 -193.82393 3.38345 1.82126 -194.18656 363.08349
8000.0000 -197.12622 -193.51049 3.61574 1.85721 -193.53589 387.89653
FREEZING PROCESS: loop number 33 T-loop= 383.00000000000000
main_MD> interactions number 33 at Temperature= 383.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.78393 -0.93426 -0.77676
force_rgl> df(natom) 2.62201 1.45951 3.73951
8005.0000 -197.84428 -193.37539 4.46889 1.86233 -193.44321 389.14806
8010.0000 -197.42432 -193.72498 3.69935 1.86198 -193.44966 396.46161
8015.0000 -197.57200 -193.34541 4.22660 1.86514 -193.39229 397.02829
8020.0000 -196.83130 -192.75945 4.07185 1.89054 -192.93263 415.26931
8025.0000 -197.28254 -193.35256 3.92998 1.88029 -193.11808 407.84071
8030.0000 -197.30214 -193.29484 4.00730 1.87999 -193.12364 412.63489
8035.0000 -197.38035 -193.21602 4.16434 1.87535 -193.20751 400.80003
8040.0000 -197.68426 -194.17740 3.50686 1.86039 -193.47836 386.78935
8045.0000 -197.53802 -194.04229 3.49573 1.82678 -194.08675 362.84440
8050.0000 -197.31585 -193.06048 4.25536 1.84096 -193.83007 377.75483
8055.0000 -197.04103 -192.98490 4.05613 1.86738 -193.35191 398.00807
8060.0000 -197.04347 -192.92337 4.12009 1.89203 -192.90571 423.12241
8065.0000 -197.47526 -193.85594 3.61932 1.86367 -193.41907 393.67233
8070.0000 -197.22415 -193.10705 4.11710 1.85646 -193.54948 388.95484
8075.0000 -197.50755 -193.43561 4.07194 1.86050 -193.47629 388.47830
8080.0000 -197.81740 -193.61633 4.20107 1.84260 -193.80033 377.93274
8085.0000 -197.45182 -193.37778 4.07404 1.87314 -193.24765 400.18045
8090.0000 -196.93961 -193.17394 3.76567 1.87736 -193.17115 407.15714
8095.0000 -197.42677 -193.69591 3.73086 1.86304 -193.43032 394.30215
8100.0000 -197.46112 -194.10957 3.35155 1.84529 -193.75165 379.04437
8105.0000 -198.04345 -193.58510 4.45834 1.83366 -193.96215 371.02573
8110.0000 -197.78683 -193.94232 3.84450 1.85589 -193.55976 388.66151
8115.0000 -197.46410 -194.19638 3.26772 1.84207 -193.80986 379.27917
8120.0000 -198.34695 -194.37538 3.97157 1.80845 -194.41836 349.41051
8125.0000 -197.87617 -193.97205 3.90412 1.80010 -194.56954 342.95839
8130.0000 -197.02769 -193.58721 3.44049 1.85225 -193.62558 385.12931
8135.0000 -197.27420 -193.25077 4.02343 1.84249 -193.80234 377.62681
8140.0000 -198.02826 -194.02839 3.99986 1.84696 -193.72146 384.54598
8145.0000 -197.63876 -193.64469 3.99407 1.86384 -193.41593 396.31464
8150.0000 -197.92620 -193.73850 4.18771 1.84979 -193.67012 380.81639
8155.0000 -196.77498 -192.66140 4.11358 1.89037 -192.93564 418.28038
8160.0000 -197.27286 -193.66826 3.60460 1.86835 -193.33429 401.13684
8165.0000 -197.56994 -193.90574 3.66420 1.84550 -193.74792 379.67853
8170.0000 -197.79921 -194.12627 3.67295 1.81617 -194.27862 357.89534
8175.0000 -197.63425 -194.16313 3.47112 1.82506 -194.11773 365.83843
8180.0000 -197.27010 -193.13374 4.13636 1.84035 -193.84102 382.60234
8185.0000 -197.87681 -194.31823 3.55857 1.83591 -193.92140 371.08609
8190.0000 -197.89846 -194.86353 3.03493 1.78960 -194.75954 336.21683
8195.0000 -197.86018 -193.98950 3.87068 1.80734 -194.43853 345.32169
8200.0000 -197.42797 -193.54375 3.88422 1.84033 -193.84149 374.91812
8205.0000 -196.97790 -192.99782 3.98008 1.86007 -193.48419 390.71045
8210.0000 -197.73856 -193.86655 3.87202 1.86596 -193.37754 402.31251
8215.0000 -197.27549 -193.01860 4.25689 1.86299 -193.43122 399.19433
8220.0000 -197.81985 -193.78353 4.03632 1.85563 -193.56441 390.05484
8225.0000 -197.35586 -193.76238 3.59348 1.84731 -193.71503 378.66504
8230.0000 -197.40793 -193.74674 3.66120 1.85238 -193.62330 382.85572
8235.0000 -197.84026 -193.98781 3.85246 1.85011 -193.66438 386.78443
8240.0000 -197.52869 -193.70990 3.81879 1.84854 -193.69278 384.39433
8245.0000 -197.65201 -193.27414 4.37786 1.87119 -193.28279 400.46326
8250.0000 -197.24110 -193.42046 3.82064 1.85485 -193.57867 391.45001
FREEZING PROCESS: loop number 34 T-loop= 358.00000000000000
main_MD> interactions number 34 at Temperature= 358.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.77859 1.66608 -0.80069
force_rgl> df(natom) -0.62924 -1.94451 -0.59073
8255.0000 -197.75138 -194.27196 3.47943 1.85769 -193.52715 390.82421
8260.0000 -197.93944 -194.05003 3.88942 1.83453 -193.94632 370.15092
8265.0000 -198.07137 -194.66884 3.40254 1.80789 -194.42847 348.81898
8270.0000 -197.67475 -194.53832 3.13643 1.79349 -194.68920 337.66355
8275.0000 -198.44649 -194.97825 3.46824 1.76657 -195.17637 317.26702
8280.0000 -198.26858 -194.80293 3.46565 1.78986 -194.75482 335.47575
8285.0000 -197.97467 -194.76869 3.20599 1.78418 -194.85774 330.16528
8290.0000 -198.18205 -194.31391 3.86814 1.80408 -194.49754 347.28155
8295.0000 -196.75778 -193.63904 3.11874 1.84406 -193.77396 375.82760
8300.0000 -198.11754 -194.92708 3.19046 1.79224 -194.71180 338.10899
8305.0000 -197.38500 -193.46111 3.92389 1.81010 -194.38853 357.95218
8310.0000 -197.16728 -193.47501 3.69226 1.85878 -193.50749 391.94631
8315.0000 -198.37918 -194.27843 4.10075 1.82473 -194.12376 364.18713
8320.0000 -197.47079 -193.92684 3.54395 1.83993 -193.84872 375.70770
8325.0000 -197.23913 -193.69643 3.54270 1.84115 -193.82655 379.41912
8330.0000 -197.69907 -193.99272 3.70635 1.84495 -193.75785 380.55612
8335.0000 -197.98018 -194.16812 3.81206 1.80961 -194.39746 349.91420
8340.0000 -197.84572 -194.71994 3.12578 1.79808 -194.60606 339.36661
8345.0000 -197.85167 -194.62497 3.22670 1.79107 -194.73307 332.89224
8350.0000 -197.67567 -193.93078 3.74489 1.81572 -194.28689 358.03185
8355.0000 -198.02127 -195.03179 2.98948 1.78815 -194.78584 331.59300
8360.0000 -198.25112 -194.58459 3.66653 1.79629 -194.63852 341.68329
8365.0000 -198.04863 -194.68060 3.36803 1.81010 -194.38846 350.53084
8370.0000 -198.58864 -195.15171 3.43692 1.78623 -194.82060 332.44897
8375.0000 -198.26745 -194.93955 3.32789 1.76537 -195.19819 316.45407
8380.0000 -198.42497 -195.45141 2.97356 1.78911 -194.76854 335.17216
8385.0000 -198.32924 -194.85777 3.47147 1.77690 -194.98954 325.10779
8390.0000 -197.70892 -194.50440 3.20452 1.81651 -194.27256 354.97193
8395.0000 -198.18426 -194.46515 3.71911 1.79214 -194.71368 335.83319
8400.0000 -198.03319 -194.84512 3.18807 1.78283 -194.88213 328.86376
8405.0000 -197.93252 -194.06126 3.87126 1.81496 -194.30052 355.63655
8410.0000 -198.67520 -195.23323 3.44197 1.81180 -194.35782 352.27752
8415.0000 -198.20106 -194.61196 3.58910 1.78824 -194.78420 336.72093
8420.0000 -197.92347 -194.54570 3.37778 1.79448 -194.67128 341.03303
8425.0000 -198.21624 -194.81040 3.40584 1.79074 -194.73901 337.04630
8430.0000 -197.91803 -194.66654 3.25149 1.79623 -194.63960 341.62567
8435.0000 -197.52603 -193.78137 3.74466 1.82504 -194.11812 366.83672
8440.0000 -197.50791 -193.87664 3.63127 1.83520 -193.93426 375.53250
8445.0000 -197.29244 -193.41608 3.87635 1.85223 -193.62604 386.49697
8450.0000 -196.94777 -192.54011 4.40766 1.89091 -192.92596 417.44839
8455.0000 -197.73274 -194.04595 3.68679 1.86607 -193.37562 396.68190
8460.0000 -197.77855 -194.45042 3.32813 1.80657 -194.45239 349.08284
8465.0000 -198.37225 -195.14517 3.22708 1.80121 -194.54949 345.04165
8470.0000 -198.25018 -194.53774 3.71244 1.79452 -194.67053 342.18264
8475.0000 -196.99961 -193.87355 3.12606 1.81555 -194.28993 354.54548
8480.0000 -198.41347 -194.33166 4.08180 1.81750 -194.25458 357.73479
8485.0000 -198.33053 -194.54208 3.78845 1.81280 -194.33975 354.56685
8490.0000 -198.17611 -194.93793 3.23818 1.80027 -194.56639 345.58071
8495.0000 -198.23385 -194.94852 3.28533 1.79593 -194.64509 338.11956
8500.0000 -197.68483 -194.18698 3.49784 1.81007 -194.38902 353.93223
FREEZING PROCESS: loop number 35 T-loop= 333.00000000000000
main_MD> interactions number 35 at Temperature= 333.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.20246 -1.05721 1.83290
force_rgl> df(natom) 0.73601 0.16726 -1.90335
8505.0000 -197.76451 -194.29479 3.46972 1.81630 -194.27638 358.57154
8510.0000 -197.66043 -194.55411 3.10632 1.80366 -194.50515 348.96526
8515.0000 -197.76392 -193.99198 3.77194 1.82053 -194.19970 357.54055
8520.0000 -197.58307 -194.29385 3.28922 1.81962 -194.21623 359.81729
8525.0000 -197.83309 -194.86230 2.97079 1.78516 -194.83987 329.53818
8530.0000 -197.88425 -194.40348 3.48077 1.80410 -194.49713 347.32084
8535.0000 -198.16424 -194.57638 3.58786 1.82125 -194.18675 360.83204
8540.0000 -197.84893 -194.24381 3.60511 1.79956 -194.57927 343.40857
8545.0000 -198.10645 -195.01113 3.09532 1.80414 -194.49649 346.37064
8550.0000 -197.59553 -194.20705 3.38848 1.79177 -194.72025 342.34884
8555.0000 -198.01775 -194.61857 3.39918 1.79968 -194.57712 345.09049
8560.0000 -197.57402 -194.39651 3.17751 1.79032 -194.74654 332.89680
8565.0000 -198.07043 -194.53734 3.53309 1.80827 -194.42174 353.24495
8570.0000 -197.91014 -195.08472 2.82542 1.78602 -194.82440 334.50747
8575.0000 -198.38486 -195.23971 3.14515 1.76146 -195.26886 310.03631
8580.0000 -197.97534 -195.22773 2.74762 1.77474 -195.02857 320.90323
8585.0000 -197.87029 -194.37455 3.49573 1.78501 -194.84269 336.74468
8590.0000 -198.02297 -194.87361 3.14936 1.79477 -194.66605 338.88607
8595.0000 -197.48574 -194.23482 3.25092 1.80116 -194.55039 345.89121
8600.0000 -197.51110 -194.29290 3.21820 1.81538 -194.29306 358.22899
8605.0000 -197.65661 -194.04456 3.61204 1.83107 -194.00903 369.81374
8610.0000 -198.14901 -194.44480 3.70421 1.82695 -194.08360 366.09615
8615.0000 -197.04484 -193.83548 3.20936 1.81235 -194.34783 352.51339
8620.0000 -197.98027 -194.67423 3.30604 1.80835 -194.42028 348.10544
8625.0000 -198.35006 -195.61170 2.73837 1.75259 -195.42937 303.36720
8630.0000 -198.39612 -194.79226 3.60386 1.77533 -195.01782 322.57130
8635.0000 -197.78146 -194.58402 3.19744 1.80717 -194.44151 350.93348
8640.0000 -198.53298 -195.70488 2.82809 1.76760 -195.15778 315.97027
8645.0000 -198.34778 -195.14762 3.20015 1.76764 -195.15704 316.40948
8650.0000 -198.39722 -195.73535 2.66187 1.76268 -195.24673 312.46968
8655.0000 -198.12976 -195.30075 2.82901 1.74391 -195.58650 296.75681
8660.0000 -198.22185 -195.87311 2.34874 1.76834 -195.14434 315.85274
8665.0000 -198.49440 -195.09493 3.39947 1.76684 -195.17146 314.38419
8670.0000 -197.92234 -194.70322 3.21912 1.75646 -195.35937 307.59067
8675.0000 -198.03645 -194.58756 3.44889 1.78295 -194.88004 331.26621
8680.0000 -198.15124 -194.79915 3.35209 1.80067 -194.55929 343.93565
8685.0000 -197.48687 -193.86801 3.61886 1.80059 -194.56070 345.83513
8690.0000 -197.59975 -194.02206 3.57769 1.83797 -193.88418 372.84297
8695.0000 -197.44530 -193.90319 3.54211 1.83109 -194.00872 371.19292
8700.0000 -198.07366 -194.79847 3.27519 1.78984 -194.75517 334.10640
8705.0000 -198.51784 -195.19813 3.31971 1.77373 -195.04688 322.04250
8710.0000 -198.88212 -195.73005 3.15207 1.75598 -195.36811 306.60104
8715.0000 -198.62645 -195.74254 2.88391 1.72908 -195.85497 282.19607
8720.0000 -198.38810 -195.38550 3.00259 1.75449 -195.39506 302.28229
8725.0000 -198.09926 -195.15305 2.94621 1.76154 -195.26749 311.08395
8730.0000 -198.45717 -194.84224 3.61493 1.77081 -195.09959 319.52499
8735.0000 -198.63988 -195.60566 3.03422 1.76323 -195.23690 312.19486
8740.0000 -197.74610 -194.65083 3.09527 1.78446 -194.85258 331.69247
8745.0000 -197.75147 -194.45190 3.29956 1.77881 -194.95488 324.16226
8750.0000 -198.10818 -194.74848 3.35970 1.79967 -194.57724 350.99511
FREEZING PROCESS: loop number 36 T-loop= 308.00000000000000
main_MD> interactions number 36 at Temperature= 308.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.73629 0.20943 0.09398
force_rgl> df(natom) 1.88820 0.92339 1.00054
8755.0000 -198.24399 -195.13105 3.11293 1.76037 -195.28861 311.51123
8760.0000 -198.43793 -195.49396 2.94397 1.76192 -195.26049 309.67919
8765.0000 -199.01861 -195.89248 3.12613 1.74923 -195.49032 299.16059
8770.0000 -197.94117 -194.34962 3.59154 1.76016 -195.29245 311.31016
8775.0000 -198.42215 -194.93537 3.48679 1.76719 -195.16519 316.15465
8780.0000 -198.54568 -195.58384 2.96184 1.76236 -195.25262 309.63113
8785.0000 -198.38707 -195.11616 3.27092 1.75955 -195.30353 308.56268
8790.0000 -198.62227 -195.57200 3.05028 1.76552 -195.19548 313.97230
8795.0000 -198.18293 -195.56023 2.62270 1.75625 -195.36327 307.23483
8800.0000 -198.49870 -195.13108 3.36762 1.75048 -195.46757 303.28178
8805.0000 -198.00682 -195.02135 2.98547 1.76854 -195.14079 315.78524
8810.0000 -199.09369 -196.06807 3.02562 1.73676 -195.71595 290.80055
8815.0000 -198.80251 -196.31728 2.48523 1.72465 -195.93520 278.47606
8820.0000 -198.56138 -195.40158 3.15980 1.71462 -196.11672 269.95354
8825.0000 -198.66219 -195.79844 2.86375 1.74577 -195.55288 297.51856
8830.0000 -198.43458 -195.46438 2.97020 1.74647 -195.54015 298.05127
8835.0000 -197.78639 -194.85882 2.92756 1.74673 -195.53556 299.75440
8840.0000 -198.79841 -195.65472 3.14369 1.76997 -195.11492 317.80112
8845.0000 -198.41917 -195.26793 3.15124 1.74333 -195.59707 297.79589
8850.0000 -198.06632 -194.85748 3.20884 1.76739 -195.16158 315.15892
8855.0000 -198.31570 -194.99032 3.32538 1.75901 -195.31325 312.37508
8860.0000 -198.21700 -195.84033 2.37666 1.74451 -195.57572 295.65076
8865.0000 -198.41399 -195.34160 3.07238 1.73946 -195.66705 295.01875
8870.0000 -198.54921 -195.74415 2.80507 1.74321 -195.59928 295.43204
8875.0000 -198.40685 -194.70098 3.70587 1.74751 -195.52146 299.87741
8880.0000 -198.33705 -195.34680 2.99025 1.77661 -194.99462 324.94186
8885.0000 -198.74836 -196.17895 2.56941 1.73740 -195.70440 290.05101
8890.0000 -198.39518 -194.99075 3.40444 1.73790 -195.69537 291.50948
8895.0000 -198.34717 -195.70883 2.63835 1.74382 -195.58813 293.58982
8900.0000 -198.84656 -195.60637 3.24019 1.73222 -195.79813 284.29167
8905.0000 -198.28838 -194.76139 3.52699 1.75886 -195.31602 309.29180
8910.0000 -198.97533 -195.36755 3.60778 1.76266 -195.24724 310.48941
8915.0000 -198.38430 -195.44405 2.94024 1.74756 -195.52041 299.29311
8920.0000 -198.03932 -194.85841 3.18092 1.77057 -195.10407 316.68026
8925.0000 -197.97971 -194.76537 3.21434 1.79308 -194.69660 338.11654
8930.0000 -197.67148 -194.25967 3.41181 1.79566 -194.64996 339.10842
8935.0000 -198.55605 -195.48342 3.07262 1.77074 -195.10103 320.92624
8940.0000 -197.90547 -194.67140 3.23407 1.77457 -195.03154 322.57502
8945.0000 -198.36800 -195.61016 2.75783 1.76265 -195.24741 310.62930
8950.0000 -198.86756 -195.64322 3.22434 1.73891 -195.67703 290.89811
8955.0000 -197.81987 -195.31335 2.50653 1.74520 -195.56324 296.09273
8960.0000 -197.98369 -194.63566 3.34803 1.79543 -194.65398 337.65532
8965.0000 -198.07419 -195.42904 2.64515 1.77112 -195.09404 319.55968
8970.0000 -198.93957 -196.11662 2.82295 1.74779 -195.51641 300.10327
8975.0000 -198.32178 -195.25439 3.06740 1.72678 -195.89661 280.59282
8980.0000 -198.38295 -195.43781 2.94514 1.74580 -195.55236 298.63929
8985.0000 -198.19756 -195.05549 3.14208 1.75704 -195.34883 306.29379
8990.0000 -198.34414 -195.27787 3.06628 1.76443 -195.21521 313.49655
8995.0000 -198.58011 -195.52790 3.05221 1.75833 -195.32563 304.95527
9000.0000 -198.19714 -195.47680 2.72033 1.76380 -195.22646 310.38376
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 14 [min], 16.9489281 [s].
main_MD> Deallocating global variables
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