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nanoparticlesims/growth_Melting_Silver_ICO_3269/freezeSims/run_72/freeze.log

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main_MD> Reading input file
read_input> Process type: freezing
Read_input> Process caloric with a T-change of 25.000000000000000 [K] and a rate of 9.9999999999999992E+022 [K/ns]
read_input> Input for metadynamics has been read
read_input> Metadynamics has not been chosen.
read_input> Reading initial positions fromtoFreeze_72.xyz
read_input> Finish reading initial positions
read_input> Validating positions
read_input> Initializing random number generator
read_input> Checking program
read_rgl> START READING FILE ../pot.pot
read_rgl>> END READING FILE ../pot.pot
READ_RGL>> atomic speciesAgAg imet1 4 imet2 4
READ_RGL>> atomic radius 1.4450000999999999 1.4450000999999999
read_rgl> PARAMETERS SELECTION
FOR IMET1 :: Ag 4
ECOH :: 2.9500000000000002 A :: 0.10308871000000000 QSI :: 1.1895434899999999
p :: 10.850000000000000 q :: 3.1800000000000002
ATOMIC RADIUS :: 1.4450000999999999
choice_pot> values:
frac = 0.12062503764379931 arete = 4.0870774781009569
choice_pot> mass is== 108.00000000000000 for elem1=
read_input> ntipo1 = 72 ntipo2 = 0
read_input> Finish reading input
main_MD> Allocating global variables
main_MD> Number of outputs that will be created: 1900
main_MD> Size of nv and nvoiz: 72 7200
main_MD> Size of nv and nvoiz: 72 7200
main_MD> Number of time-steps (npas) = 50000
main_MD> Number of CVs (num_cv) = 1
main_MD> Max allowed number of atoms = 2900
main_MD> Max number of atoms = 72
main_MD> Consider changing parameter nsiz in module_parameters.f90 for performance
main_MD> collvar_wanted = F
main_MD> INPUT AND POTENTIAL FILE READING IS DONE
main_MD> THERMALIZATION IS STARTING
init> 1.4550651437465787E-002 3.0916196720064525E-003 5.1211588536900540E-002 initial drift of cluster / NP1 for coalescence
init> 0.28187349381750199 0.32831150228833433 0.31369633443742012 scaling for velocity /for coalescence NP1
init.f90 > facguy = 3.8004773519122246E-003
preparo> IN BIGVOI : LIMIT 1.2247448652052084 1.2247448652052084 1.2247448652052084
preparo> END t=0 TIME STEP
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.00797 -2.91228 0.08372
force_rgl> df(natom) 0.31341 3.30209 2.23934
preparo> THERMALIZATION PROCESS AT 1246.9152753844824
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -162.08235626104090 9.4314144039020160 -171.51377066494291 6.1945225304951021E-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 38
FREEZING PROCESS: loop number 1 T-loop= 1228.0000000000000
main_MD> interactions number 1 at Temperature= 1228.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.85982 -0.31162 -0.66984
force_rgl> df(natom) -3.04393 -0.45835 -1.28472
5.0000 -170.03317 -157.66677 12.36641 3.00539 -160.38567 1098.15243
10.0000 -169.80564 -157.02604 12.77960 3.17809 -157.39678 1235.44869
15.0000 -170.65981 -158.52134 12.13847 3.15228 -157.84352 1224.47363
20.0000 -170.17709 -158.30730 11.86979 3.17341 -157.47787 1219.45551
25.0000 -166.11152 -155.70418 10.40734 3.16783 -157.57444 1174.87718
30.0000 -167.89221 -157.04088 10.85133 3.23250 -156.45521 1269.88186
35.0000 -171.06115 -159.40355 11.65760 3.19139 -157.16654 1234.89933
40.0000 -169.92067 -157.94802 11.97266 3.18701 -157.24244 1264.87417
45.0000 -167.85734 -156.92784 10.92950 3.13611 -158.12344 1155.85759
50.0000 -169.09395 -158.00016 11.09379 3.19699 -157.06964 1254.16253
55.0000 -170.46549 -157.96514 12.50034 3.18756 -157.23292 1228.12327
60.0000 -170.86372 -159.88177 10.98195 3.08900 -158.93863 1190.52620
65.0000 -168.99861 -157.60824 11.39038 3.10497 -158.66238 1177.24571
70.0000 -168.08439 -155.46170 12.62269 3.19756 -157.05984 1252.55605
75.0000 -168.44042 -158.01283 10.42759 3.19422 -157.11766 1225.72492
80.0000 -168.15524 -156.08669 12.06856 3.22613 -156.56540 1254.59437
85.0000 -168.15874 -158.06298 10.09576 3.19655 -157.07741 1204.25901
90.0000 -167.67983 -157.22881 10.45102 3.13646 -158.11727 1195.74041
95.0000 -169.31910 -158.96054 10.35856 3.16065 -157.69860 1225.85506
100.0000 -169.35503 -155.62947 13.72555 3.17184 -157.50498 1238.72896
105.0000 -172.04607 -159.78465 12.26142 3.18138 -157.33992 1220.86461
110.0000 -169.94582 -159.02516 10.92066 3.06195 -159.40687 1156.79407
115.0000 -170.49230 -159.17850 11.31380 3.09866 -158.77145 1195.96584
120.0000 -170.64403 -160.34723 10.29680 3.05342 -159.55448 1159.19176
125.0000 -169.65107 -159.03079 10.62028 3.16408 -157.63928 1237.71436
130.0000 -171.51292 -160.13222 11.38070 3.07584 -159.16643 1180.85320
135.0000 -170.63480 -159.08619 11.54861 3.05353 -159.55264 1152.35515
140.0000 -171.21950 -159.15371 12.06579 3.15281 -157.83434 1178.23306
145.0000 -168.75538 -158.45276 10.30261 3.12555 -158.30607 1206.52767
150.0000 -170.88408 -159.70014 11.18393 3.08175 -159.06413 1213.27309
155.0000 -171.75117 -159.34746 12.40370 3.04002 -159.78636 1145.56277
160.0000 -168.77939 -157.94958 10.82981 3.09487 -158.83713 1161.43756
165.0000 -170.00648 -157.48931 12.51717 3.14412 -157.98475 1203.30390
170.0000 -168.22398 -156.06993 12.15405 3.19055 -157.18125 1248.50750
175.0000 -166.19249 -156.88762 9.30487 3.25721 -156.02757 1275.77645
180.0000 -167.40809 -154.96695 12.44114 3.22512 -156.58288 1224.93615
185.0000 -168.25398 -158.74736 9.50662 3.22437 -156.59586 1257.12301
190.0000 -169.04219 -158.39387 10.64832 3.08789 -158.95793 1183.49645
195.0000 -167.42271 -155.27596 12.14676 3.19263 -157.14510 1224.91930
200.0000 -167.99890 -155.83722 12.16169 3.26252 -155.93564 1276.90112
205.0000 -169.44941 -158.38504 11.06437 3.20305 -156.96492 1219.53287
210.0000 -166.01642 -154.84097 11.17545 3.18070 -157.35169 1216.53842
215.0000 -171.23520 -158.26948 12.96572 3.23337 -156.44005 1266.12615
220.0000 -170.32823 -158.65524 11.67298 3.05182 -159.58213 1173.21450
225.0000 -168.12605 -156.78637 11.33968 3.21602 -156.74044 1251.71887
230.0000 -169.37700 -157.88058 11.49642 3.20625 -156.90946 1247.10111
235.0000 -170.56202 -159.49034 11.07168 3.07866 -159.11771 1151.53313
240.0000 -169.78817 -158.74534 11.04283 3.03408 -159.88922 1123.79101
245.0000 -168.53330 -158.85134 9.68196 3.12784 -158.26648 1198.61153
250.0000 -168.84428 -157.38549 11.45879 3.11799 -158.43702 1163.37645
FREEZING PROCESS: loop number 2 T-loop= 1203.0000000000000
main_MD> interactions number 2 at Temperature= 1203.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -5.05810 5.88478 -5.55116
force_rgl> df(natom) -1.59287 2.49865 0.14940
255.0000 -170.03299 -159.24871 10.78428 3.10381 -158.68240 1181.70365
260.0000 -169.92452 -160.06823 9.85629 3.06740 -159.31256 1157.09298
265.0000 -170.16165 -160.10796 10.05369 2.97316 -160.94349 1089.54379
270.0000 -169.35107 -158.25440 11.09667 3.02861 -159.98387 1102.09498
275.0000 -169.16565 -155.23104 13.93461 3.23981 -156.32869 1249.59298
280.0000 -171.85096 -160.35906 11.49190 3.14794 -157.91861 1230.01222
285.0000 -170.89155 -161.04183 9.84973 3.03394 -159.89158 1108.71940
290.0000 -171.55141 -160.16280 11.38861 2.95513 -161.25563 1090.68878
295.0000 -171.55528 -160.61113 10.94415 3.07014 -159.26502 1121.46913
300.0000 -170.15004 -159.32069 10.82935 2.97570 -160.89957 1106.18365
305.0000 -172.70371 -160.70198 12.00173 3.00113 -160.45938 1108.94123
310.0000 -170.33413 -160.69635 9.63778 2.96535 -161.07876 1104.85986
315.0000 -168.52144 -159.56198 8.95947 3.00964 -160.31214 1147.93345
320.0000 -170.77860 -158.59950 12.17910 3.09661 -158.80702 1156.79489
325.0000 -169.18575 -156.97889 12.20686 3.19580 -157.09031 1262.44735
330.0000 -170.04698 -159.86112 10.18585 3.05516 -159.52439 1123.65791
335.0000 -167.89318 -157.50617 10.38702 3.05645 -159.50208 1110.95841
340.0000 -169.66859 -156.90813 12.76046 3.12929 -158.24137 1180.61419
345.0000 -170.99287 -160.11804 10.87482 3.08729 -158.96828 1145.60429
350.0000 -169.81966 -159.00176 10.81790 2.99272 -160.60494 1099.14916
355.0000 -167.64238 -157.75152 9.89085 3.11667 -158.45978 1155.08865
360.0000 -167.91455 -158.09230 9.82225 3.14483 -157.97237 1186.38459
365.0000 -168.94743 -160.80248 8.14495 3.11587 -158.47364 1190.35093
370.0000 -171.70936 -159.25499 12.45437 3.09226 -158.88220 1167.06069
375.0000 -169.14536 -157.83017 11.31519 3.10333 -158.69062 1116.69841
380.0000 -170.78799 -159.06471 11.72328 3.18857 -157.21537 1250.86199
385.0000 -168.10023 -158.49456 9.60567 3.15923 -157.72318 1241.84830
390.0000 -169.89828 -157.46493 12.43335 3.17907 -157.37979 1191.01985
395.0000 -167.83915 -156.84054 10.99862 3.15852 -157.73548 1234.13834
400.0000 -170.00874 -160.06991 9.93883 3.12936 -158.24012 1201.38475
405.0000 -168.44574 -157.02885 11.41690 3.07918 -159.10862 1185.43521
410.0000 -169.52986 -158.59237 10.93748 3.17442 -157.46029 1198.45244
415.0000 -169.38073 -157.18112 12.19961 3.18032 -157.35825 1229.59616
420.0000 -170.62759 -159.30499 11.32259 3.24986 -156.15474 1282.49765
425.0000 -170.35618 -159.34222 11.01396 3.02000 -160.13292 1117.74972
430.0000 -169.38976 -158.10378 11.28598 3.05691 -159.49413 1153.75719
435.0000 -166.67432 -155.63361 11.04071 3.20291 -156.96725 1243.92652
440.0000 -167.17474 -155.35098 11.82377 3.24093 -156.30922 1250.97627
445.0000 -168.56679 -157.07033 11.49646 3.20415 -156.94588 1237.22119
450.0000 -167.39523 -156.53467 10.86057 3.20100 -157.00038 1231.85712
455.0000 -170.08654 -157.98778 12.09876 3.19699 -157.06973 1206.59175
460.0000 -169.20891 -158.81310 10.39581 3.16527 -157.61877 1204.74930
465.0000 -170.37296 -159.87458 10.49838 3.07602 -159.16337 1155.60718
470.0000 -172.37184 -162.12495 10.24689 2.97297 -160.94685 1086.85825
475.0000 -168.39404 -157.31416 11.07988 3.05553 -159.51791 1127.52236
480.0000 -168.11163 -156.40590 11.70573 3.21673 -156.72813 1252.39486
485.0000 -168.06955 -157.79098 10.27857 3.21677 -156.72730 1266.39405
490.0000 -168.53423 -156.02483 12.50940 3.21708 -156.72200 1261.31367
495.0000 -168.69020 -157.18514 11.50506 3.22864 -156.52188 1265.27165
500.0000 -170.56634 -159.41583 11.15051 3.14116 -158.03603 1212.11981
FREEZING PROCESS: loop number 3 T-loop= 1178.0000000000000
main_MD> interactions number 3 at Temperature= 1178.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.10161 0.24652 -1.51018
force_rgl> df(natom) -0.34738 -0.61831 -1.69671
505.0000 -171.45573 -161.13001 10.32572 2.96129 -161.14896 1100.06567
510.0000 -173.02654 -161.00498 12.02156 3.02987 -159.96206 1139.26428
515.0000 -169.84757 -159.48883 10.35874 3.01681 -160.18800 1143.46449
520.0000 -169.18580 -159.31384 9.87195 2.98257 -160.78073 1073.74482
525.0000 -169.86951 -159.80528 10.06423 3.02274 -160.08551 1108.87246
530.0000 -170.27454 -160.45251 9.82203 3.01831 -160.16205 1102.42561
535.0000 -171.14433 -160.94558 10.19875 2.93911 -161.53292 1061.43366
540.0000 -170.92140 -161.21465 9.70675 2.93054 -161.68111 1079.57434
545.0000 -169.81620 -161.23451 8.58169 2.96387 -161.10425 1062.56105
550.0000 -171.29907 -159.28465 12.01441 3.07721 -159.14283 1190.95418
555.0000 -170.35943 -160.93781 9.42162 3.02254 -160.08892 1129.53694
560.0000 -168.22245 -157.94357 10.27888 3.04984 -159.61640 1121.20600
565.0000 -171.77602 -161.33727 10.43875 2.96832 -161.02733 1096.47189
570.0000 -169.11177 -157.70218 11.40959 3.00596 -160.37579 1106.16847
575.0000 -166.88909 -156.01821 10.87088 3.20519 -156.92787 1197.70585
580.0000 -167.98841 -157.34159 10.64681 3.15047 -157.87480 1153.58844
585.0000 -169.17573 -157.40940 11.76633 3.13666 -158.11383 1145.20994
590.0000 -167.76202 -156.22120 11.54082 3.20105 -156.99948 1241.50540
595.0000 -167.64881 -157.57815 10.07066 3.18420 -157.29104 1210.86962
600.0000 -168.27695 -155.69628 12.58067 3.17952 -157.37201 1210.61359
605.0000 -169.00870 -158.30331 10.70539 3.17543 -157.44288 1217.62069
610.0000 -169.21785 -160.11437 9.10348 3.04592 -159.68421 1130.99992
615.0000 -170.36989 -159.33590 11.03399 3.10623 -158.64047 1177.53713
620.0000 -167.78563 -157.18599 10.59964 3.17992 -157.36519 1216.07712
625.0000 -168.39228 -158.19920 10.19308 3.13703 -158.10745 1192.83002
630.0000 -170.12710 -159.11961 11.00749 3.09409 -158.85065 1157.74717
635.0000 -170.03816 -159.04939 10.98876 3.01538 -160.21277 1108.32509
640.0000 -171.11137 -160.99056 10.12081 2.97203 -160.96314 1096.92046
645.0000 -172.13210 -160.90083 11.23127 3.02168 -160.10376 1125.86875
650.0000 -170.54405 -158.12613 12.41792 3.06240 -159.39910 1154.28083
655.0000 -170.91352 -158.13859 12.77493 3.15817 -157.74163 1247.10801
660.0000 -169.83246 -159.87819 9.95427 3.10780 -158.61325 1186.63008
665.0000 -169.86852 -157.13800 12.73052 3.11568 -158.47701 1188.89969
670.0000 -168.53081 -157.19744 11.33337 3.21323 -156.78859 1246.29679
675.0000 -170.88764 -159.35962 11.52802 3.10699 -158.62734 1183.23205
680.0000 -170.00127 -159.56772 10.43355 3.05604 -159.50915 1110.17117
685.0000 -169.36248 -157.47053 11.89195 3.19019 -157.18747 1254.21882
690.0000 -168.42972 -157.95585 10.47386 3.15793 -157.74577 1193.09543
695.0000 -166.80041 -155.04770 11.75271 3.23503 -156.41137 1209.71193
700.0000 -170.32005 -159.69946 10.62059 3.15072 -157.87046 1199.09170
705.0000 -169.49001 -158.99788 10.49213 3.08522 -159.00405 1176.96566
710.0000 -168.82848 -157.44405 11.38444 3.19185 -157.15863 1245.46096
715.0000 -168.56410 -156.62476 11.93934 3.22939 -156.50899 1254.47432
720.0000 -170.61480 -158.28709 12.32771 3.18795 -157.22612 1254.07266
725.0000 -171.56761 -159.81088 11.75673 3.09199 -158.88702 1156.44879
730.0000 -170.07928 -159.12140 10.95788 3.11571 -158.47636 1197.26948
735.0000 -170.23289 -158.33726 11.89562 3.03307 -159.90660 1101.10645
740.0000 -167.98641 -156.40442 11.58198 3.18318 -157.30868 1230.75071
745.0000 -168.00089 -156.47734 11.52355 3.19516 -157.10135 1221.51273
750.0000 -168.07834 -156.86736 11.21098 3.16322 -157.65419 1209.89388
FREEZING PROCESS: loop number 4 T-loop= 1153.0000000000000
main_MD> interactions number 4 at Temperature= 1153.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.69279 0.79048 -2.56586
force_rgl> df(natom) -1.17375 -2.27917 -0.32932
755.0000 -168.72392 -157.26092 11.46300 3.21364 -156.78150 1245.74245
760.0000 -168.40489 -157.08604 11.31885 3.24833 -156.18120 1245.29416
765.0000 -170.08459 -158.01232 12.07227 3.14239 -158.01470 1161.41664
770.0000 -169.32754 -157.88036 11.44718 3.11647 -158.46331 1206.16678
775.0000 -168.90344 -157.58443 11.31902 3.15954 -157.71790 1193.40611
780.0000 -167.80644 -155.09947 12.70697 3.23248 -156.45552 1241.90267
785.0000 -168.97688 -158.25838 10.71850 3.27485 -155.72223 1274.39900
790.0000 -169.80186 -160.92309 8.87877 3.00600 -160.37519 1121.99846
795.0000 -170.46890 -159.60329 10.86562 3.02068 -160.12114 1115.53863
800.0000 -171.97727 -160.37390 11.60337 3.00631 -160.36981 1105.59748
805.0000 -170.15529 -159.39539 10.75990 3.03435 -159.88453 1146.14990
810.0000 -170.98955 -160.27851 10.71104 3.05370 -159.54958 1120.77355
815.0000 -171.17731 -160.87962 10.29769 3.00100 -160.46164 1122.98757
820.0000 -171.77997 -160.70051 11.07946 3.00650 -160.36646 1128.83345
825.0000 -170.29089 -160.14987 10.14102 3.05594 -159.51082 1173.48792
830.0000 -171.44312 -160.12937 11.31376 2.96881 -161.01886 1089.08836
835.0000 -169.63913 -158.86063 10.77850 3.00493 -160.39362 1100.80212
840.0000 -170.89578 -160.42523 10.47055 3.00324 -160.42299 1128.24582
845.0000 -171.74511 -160.75159 10.99352 2.93458 -161.61116 1096.04942
850.0000 -171.56215 -161.78567 9.77647 3.03385 -159.89323 1180.13361
855.0000 -169.63755 -158.26421 11.37334 2.98019 -160.82187 1106.50985
860.0000 -168.43505 -154.91010 13.52496 3.24165 -156.29675 1260.43523
865.0000 -170.12487 -158.25622 11.86866 3.14636 -157.94589 1184.15300
870.0000 -170.56302 -160.46934 10.09367 3.08174 -159.06441 1197.75720
875.0000 -170.12502 -158.27073 11.85429 3.03548 -159.86503 1114.46500
880.0000 -170.34043 -160.73659 9.60383 3.09976 -158.75241 1189.40844
885.0000 -170.30514 -161.04022 9.26492 3.04123 -159.76544 1123.63551
890.0000 -170.28590 -158.49423 11.79167 3.06750 -159.31082 1118.86833
895.0000 -168.46348 -156.66540 11.79808 3.15908 -157.72585 1217.15754
900.0000 -170.67707 -159.97209 10.70498 3.13765 -158.09672 1168.78543
905.0000 -170.40325 -160.55626 9.84699 3.05467 -159.53288 1133.00391
910.0000 -169.17469 -156.97015 12.20454 3.13372 -158.16480 1220.71921
915.0000 -168.17171 -156.12319 12.04852 3.18371 -157.29953 1240.65514
920.0000 -170.27797 -162.07756 8.20041 3.05098 -159.59670 1141.20854
925.0000 -173.14739 -162.30772 10.83967 2.99284 -160.60290 1060.46578
930.0000 -170.96560 -159.52839 11.43721 2.94341 -161.45836 1085.77600
935.0000 -170.21718 -159.59460 10.62259 3.10336 -158.69018 1173.15763
940.0000 -170.45372 -160.34610 10.10762 3.04095 -159.77037 1152.39421
945.0000 -168.34483 -159.38077 8.96407 3.07237 -159.22659 1131.28725
950.0000 -169.31956 -158.00211 11.31745 3.12146 -158.37696 1232.76599
955.0000 -169.40750 -159.75370 9.65380 3.06133 -159.41750 1189.43475
960.0000 -171.91160 -161.73335 10.17824 2.98488 -160.74072 1110.85800
965.0000 -170.36781 -158.04761 12.32021 3.03337 -159.90154 1154.37823
970.0000 -164.55057 -153.43594 11.11464 3.24104 -156.30740 1249.26292
975.0000 -166.85827 -157.00956 9.84871 3.20103 -156.99976 1208.33457
980.0000 -170.30476 -159.65655 10.64821 3.16245 -157.66748 1216.72452
985.0000 -169.68420 -158.81583 10.86836 3.07882 -159.11486 1191.78576
990.0000 -171.64426 -162.29753 9.34673 2.95282 -161.29551 1081.29436
995.0000 -171.95483 -160.91294 11.04188 2.92681 -161.74574 1090.42207
1000.0000 -171.47474 -161.79568 9.67906 2.98046 -160.81724 1114.56329
FREEZING PROCESS: loop number 5 T-loop= 1128.0000000000000
main_MD> interactions number 5 at Temperature= 1128.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.09072 -1.12764 -1.37615
force_rgl> df(natom) 2.69585 -3.64838 -1.82905
1005.0000 -170.39401 -159.20740 11.18661 3.00639 -160.36835 1104.82688
1010.0000 -168.74384 -157.16324 11.58059 3.15385 -157.81632 1203.15703
1015.0000 -168.02075 -156.38733 11.63341 3.14067 -158.04443 1190.86146
1020.0000 -169.71470 -157.19276 12.52194 3.20625 -156.90943 1243.34513
1025.0000 -169.08676 -157.03430 12.05246 3.15142 -157.85839 1188.93739
1030.0000 -169.19965 -158.50250 10.69714 3.23492 -156.41317 1247.52263
1035.0000 -169.32072 -160.39218 8.92854 3.09128 -158.89923 1170.54088
1040.0000 -169.03728 -161.04703 7.99025 2.96407 -161.10084 1067.54948
1045.0000 -171.17218 -159.41492 11.75725 3.05155 -159.58678 1168.79485
1050.0000 -171.96410 -158.84277 13.12134 3.05405 -159.54350 1150.37871
1055.0000 -171.64900 -160.14068 11.50831 3.05671 -159.49750 1112.28481
1060.0000 -173.26929 -163.36583 9.90345 2.95291 -161.29406 1050.02795
1065.0000 -170.65953 -162.34497 8.31456 2.87112 -162.70950 1010.85320
1070.0000 -171.69144 -161.64294 10.04851 2.92840 -161.71827 1045.86906
1075.0000 -170.67805 -160.03834 10.63972 2.97752 -160.86806 1097.15740
1080.0000 -171.51775 -158.93398 12.58377 3.02833 -159.98872 1147.04109
1085.0000 -170.53326 -159.48631 11.04694 3.05306 -159.56064 1159.40024
1090.0000 -170.20530 -158.36543 11.83987 3.10182 -158.71690 1184.93651
1095.0000 -170.40937 -159.09322 11.31616 3.11073 -158.56270 1164.79500
1100.0000 -171.31162 -160.68610 10.62552 3.02133 -160.10984 1092.47636
1105.0000 -169.89344 -160.81122 9.08221 3.01717 -160.18179 1115.59196
1110.0000 -171.46468 -162.85436 8.61032 2.92131 -161.84087 1044.68960
1115.0000 -170.72526 -160.86154 9.86371 2.89753 -162.25250 1026.24423
1120.0000 -171.59157 -160.70716 10.88442 2.95537 -161.25150 1078.25700
1125.0000 -171.01353 -161.20696 9.80657 2.91121 -162.01570 1038.20435
1130.0000 -169.79726 -158.97020 10.82706 2.99378 -160.58670 1107.17083
1135.0000 -170.66700 -159.20646 11.46055 3.13421 -158.15627 1212.45193
1140.0000 -172.18879 -162.84352 9.34526 2.93810 -161.55038 1085.51797
1145.0000 -173.36062 -164.93642 8.42420 2.78922 -164.12694 970.34972
1150.0000 -171.77500 -161.66590 10.10910 2.82058 -163.58428 1009.98645
1155.0000 -171.51283 -160.41973 11.09310 2.98806 -160.68560 1098.19948
1160.0000 -169.68256 -158.63592 11.04664 3.11316 -158.52060 1199.35401
1165.0000 -170.08165 -158.21578 11.86587 3.07791 -159.13064 1179.73370
1170.0000 -168.45821 -159.05090 9.40732 3.15469 -157.80186 1194.66376
1175.0000 -168.11729 -155.52426 12.59303 3.17294 -157.48590 1214.92542
1180.0000 -169.55997 -157.44093 12.11904 3.17273 -157.48958 1227.39077
1185.0000 -169.68644 -159.63621 10.05023 3.08075 -159.08149 1162.41612
1190.0000 -170.59972 -160.93968 9.66004 2.96512 -161.08273 1049.16627
1195.0000 -168.66749 -158.66124 10.00625 3.00882 -160.32636 1119.10957
1200.0000 -171.25313 -160.29372 10.95941 3.06924 -159.28068 1106.08288
1205.0000 -171.86298 -161.65562 10.20735 2.89950 -162.21833 1069.10401
1210.0000 -171.29347 -161.44816 9.84531 2.94421 -161.44465 1079.33176
1215.0000 -172.06458 -162.52822 9.53636 2.95203 -161.30927 1053.92527
1220.0000 -170.48865 -159.70102 10.78764 3.00497 -160.39299 1097.90565
1225.0000 -170.08512 -160.68614 9.39898 3.00823 -160.33659 1143.82431
1230.0000 -170.82992 -159.92469 10.90523 2.96057 -161.16137 1058.72168
1235.0000 -170.13658 -159.27249 10.86409 3.07672 -159.15119 1144.19978
1240.0000 -170.53114 -160.58111 9.95002 3.07398 -159.19864 1156.60107
1245.0000 -170.46317 -161.37905 9.08413 2.99055 -160.64263 1093.88041
1250.0000 -170.03430 -160.98799 9.04631 2.97052 -160.98922 1062.16918
FREEZING PROCESS: loop number 6 T-loop= 1103.0000000000000
main_MD> interactions number 6 at Temperature= 1103.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.65255 0.41420 -2.90052
force_rgl> df(natom) 2.10245 -2.54617 -1.96786
1255.0000 -171.35192 -159.83866 11.51327 3.04350 -159.72616 1106.83425
1260.0000 -170.68572 -160.37223 10.31349 3.04476 -159.70441 1108.77171
1265.0000 -170.53332 -159.55525 10.97808 2.96387 -161.10431 1054.77958
1270.0000 -170.89916 -159.85920 11.03996 3.01576 -160.20628 1115.90621
1275.0000 -170.95664 -160.07428 10.88236 3.00857 -160.33062 1121.13718
1280.0000 -170.92857 -161.27543 9.65314 3.00257 -160.43458 1131.38239
1285.0000 -170.74837 -161.51630 9.23207 2.93828 -161.54712 1077.16312
1290.0000 -172.00109 -162.47579 9.52530 2.93107 -161.67207 1067.71373
1295.0000 -171.77898 -163.75805 8.02093 2.87127 -162.70694 1021.81805
1300.0000 -170.59457 -160.50469 10.08988 2.88556 -162.45969 1009.55666
1305.0000 -170.98530 -160.45547 10.52983 2.98010 -160.82346 1080.27742
1310.0000 -169.16997 -159.25931 9.91065 3.01668 -160.19035 1108.44934
1315.0000 -170.93681 -161.30904 9.62777 3.01387 -160.23902 1116.24729
1320.0000 -171.58008 -162.70274 8.87735 2.94508 -161.42955 1059.64962
1325.0000 -172.63394 -161.66110 10.97284 2.92456 -161.78466 1042.99924
1330.0000 -170.45061 -162.02142 8.42919 2.96407 -161.10081 1097.55903
1335.0000 -172.44572 -164.71673 7.72899 2.83715 -163.29743 995.74282
1340.0000 -169.23847 -158.52847 10.71000 2.92268 -161.81727 1057.03127
1345.0000 -170.72583 -162.12630 8.59954 2.99199 -160.61764 1106.44877
1350.0000 -171.20203 -161.65777 9.54426 2.92778 -161.72895 1060.71189
1355.0000 -170.29864 -160.66167 9.63698 2.99873 -160.50106 1056.19226
1360.0000 -169.65490 -159.85690 9.79800 2.98907 -160.66812 1079.02311
1365.0000 -170.38787 -159.69933 10.68855 3.08872 -158.94355 1161.03445
1370.0000 -172.44368 -161.51900 10.92468 2.93993 -161.51864 1056.38232
1375.0000 -169.82698 -159.96378 9.86320 2.94830 -161.37376 1094.74354
1380.0000 -168.18345 -159.31775 8.86569 3.05684 -159.49536 1137.69234
1385.0000 -168.88016 -159.19004 9.69012 3.14258 -158.01143 1209.98445
1390.0000 -170.10449 -159.48130 10.62319 3.00637 -160.36873 1126.87948
1395.0000 -171.28579 -159.97331 11.31249 3.02931 -159.97168 1147.47266
1400.0000 -170.13394 -160.01555 10.11839 2.99745 -160.52309 1124.62269
1405.0000 -170.84948 -161.74801 9.10147 2.94044 -161.50980 1094.36127
1410.0000 -171.29286 -162.12823 9.16463 2.89563 -162.28536 1040.53984
1415.0000 -172.37496 -163.82469 8.55028 2.86477 -162.81938 995.54357
1420.0000 -170.38139 -159.93579 10.44560 2.93796 -161.55274 1066.50240
1425.0000 -170.83970 -161.41233 9.42737 2.96587 -161.06969 1121.18812
1430.0000 -173.40962 -162.20676 11.20285 2.87884 -162.57587 1042.68818
1435.0000 -170.06895 -160.43338 9.63557 2.94880 -161.36518 1093.96182
1440.0000 -173.03472 -162.10869 10.92602 2.94403 -161.44763 1074.02484
1445.0000 -169.62596 -160.52137 9.10459 2.95198 -161.31010 1067.19927
1450.0000 -172.75908 -161.67098 11.08810 2.91655 -161.92335 1045.87474
1455.0000 -170.93412 -160.25071 10.68341 3.01543 -160.21191 1120.19291
1460.0000 -170.17664 -160.35043 9.82621 3.00711 -160.35592 1096.38279
1465.0000 -172.19678 -162.58327 9.61352 2.95745 -161.21539 1062.88406
1470.0000 -172.12195 -162.81208 9.30987 2.86243 -162.86001 1009.87306
1475.0000 -172.99780 -164.45497 8.54284 2.81937 -163.60515 974.81112
1480.0000 -172.26766 -162.99798 9.26969 2.75081 -164.79171 932.58507
1485.0000 -172.13585 -162.47898 9.65687 2.82101 -163.57679 1012.12504
1490.0000 -171.73970 -160.54254 11.19717 2.99987 -160.48135 1117.11105
1495.0000 -172.32380 -162.00804 10.31576 2.97032 -160.99271 1066.96190
1500.0000 -172.09613 -163.02479 9.07135 2.79397 -164.04475 963.20429
FREEZING PROCESS: loop number 7 T-loop= 1078.0000000000000
main_MD> interactions number 7 at Temperature= 1078.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.68877 2.66576 -1.16861
force_rgl> df(natom) 2.03621 -0.71937 -0.30467
1505.0000 -172.98292 -162.97755 10.00537 2.91242 -161.99468 1050.99010
1510.0000 -173.52412 -162.47578 11.04834 2.84309 -163.19461 1002.55859
1515.0000 -171.72189 -163.10076 8.62113 2.85633 -162.96556 1014.32901
1520.0000 -170.25132 -161.62681 8.62452 2.93852 -161.54302 1054.20776
1525.0000 -173.94942 -163.21909 10.73033 2.86592 -162.79950 999.15925
1530.0000 -171.52578 -163.98377 7.54201 2.81952 -163.60264 1008.89156
1535.0000 -172.86095 -162.98992 9.87102 2.79950 -163.94915 971.27724
1540.0000 -169.55274 -158.95920 10.59355 2.97050 -160.98955 1074.23145
1545.0000 -171.29785 -161.04074 10.25712 3.00569 -160.38052 1124.93474
1550.0000 -169.49624 -161.84458 7.65166 2.92300 -161.81173 1041.00991
1555.0000 -171.50085 -161.57727 9.92358 2.96206 -161.13558 1071.67064
1560.0000 -171.42235 -162.53933 8.88303 2.92821 -161.72152 1040.41651
1565.0000 -171.90415 -161.75306 10.15109 2.91036 -162.03038 1020.50048
1570.0000 -169.92782 -159.43072 10.49711 2.98283 -160.77621 1099.79200
1575.0000 -169.02746 -157.19274 11.83472 3.13387 -158.16207 1191.20459
1580.0000 -170.31088 -160.07287 10.23802 3.10904 -158.59186 1176.46413
1585.0000 -168.97212 -158.68975 10.28237 3.10621 -158.64078 1176.90931
1590.0000 -172.17548 -160.76940 11.40608 3.06085 -159.42596 1152.43958
1595.0000 -172.01589 -163.05130 8.96458 2.95965 -161.17742 1112.15820
1600.0000 -172.59915 -164.42776 8.17139 2.91560 -161.93965 1037.31733
1605.0000 -173.46168 -163.98712 9.47456 2.75905 -164.64920 948.49128
1610.0000 -172.15991 -160.73588 11.42403 2.86727 -162.77620 1046.18125
1615.0000 -172.69882 -163.49674 9.20208 2.97664 -160.88325 1087.80126
1620.0000 -171.84540 -163.63217 8.21323 2.79516 -164.02425 953.50167
1625.0000 -172.22167 -161.39634 10.82533 2.85497 -162.98911 1010.60707
1630.0000 -171.67834 -160.35183 11.32651 2.95865 -161.19458 1082.28811
1635.0000 -170.58448 -161.32572 9.25876 3.00846 -160.33263 1107.41051
1640.0000 -171.10755 -161.47104 9.63651 2.91834 -161.89228 1049.54700
1645.0000 -169.34011 -157.94933 11.39078 3.09791 -158.78440 1174.81920
1650.0000 -169.94836 -158.39610 11.55227 3.10389 -158.68105 1131.87051
1655.0000 -170.87645 -157.95017 12.92628 3.12501 -158.31543 1160.95275
1660.0000 -170.66335 -158.96241 11.70094 3.06524 -159.34998 1165.07473
1665.0000 -171.57511 -160.31428 11.26083 3.05111 -159.59438 1114.93013
1670.0000 -173.29065 -164.00262 9.28803 2.86047 -162.89378 1011.55139
1675.0000 -174.04929 -165.30783 8.74147 2.74011 -164.97686 939.65285
1680.0000 -174.63509 -164.79121 9.84389 2.73319 -165.09668 959.04932
1685.0000 -174.43326 -166.04625 8.38701 2.73337 -165.09360 935.22731
1690.0000 -173.14454 -163.17028 9.97427 2.81309 -163.71381 989.43885
1695.0000 -169.58818 -158.88004 10.70813 2.91434 -161.96148 1038.34703
1700.0000 -171.93101 -160.83869 11.09232 3.01448 -160.22848 1110.33132
1705.0000 -172.33278 -162.14929 10.18350 2.96716 -161.04735 1099.00726
1710.0000 -170.37415 -159.34694 11.02720 2.94562 -161.42012 1064.52108
1715.0000 -170.45982 -158.90326 11.55656 3.08333 -159.03688 1159.44812
1720.0000 -171.08190 -159.95201 11.12989 3.04686 -159.66804 1122.42176
1725.0000 -170.10501 -160.89791 9.20710 2.95534 -161.25198 1054.90582
1730.0000 -169.85352 -161.02731 8.82621 2.98855 -160.67711 1124.77436
1735.0000 -170.27446 -160.37775 9.89672 2.98902 -160.66908 1096.43185
1740.0000 -168.28709 -158.28944 9.99765 3.06677 -159.32339 1124.60563
1745.0000 -170.26741 -160.40600 9.86140 3.05038 -159.60704 1104.27446
1750.0000 -170.83624 -162.37678 8.45946 3.01109 -160.28711 1102.84588
FREEZING PROCESS: loop number 8 T-loop= 1053.0000000000000
main_MD> interactions number 8 at Temperature= 1053.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -4.28555 -3.42488 -0.68387
force_rgl> df(natom) 2.61642 -1.80060 -0.63993
1755.0000 -170.62161 -161.00014 9.62147 2.92519 -161.77378 1050.25619
1760.0000 -172.32897 -162.04944 10.27953 2.88889 -162.40197 1047.83704
1765.0000 -172.93022 -163.42492 9.50530 2.82662 -163.47978 1009.41131
1770.0000 -171.86747 -159.97275 11.89473 2.94135 -161.49414 1079.47346
1775.0000 -171.35578 -163.57625 7.77953 2.94772 -161.38390 1091.03803
1780.0000 -173.01061 -162.37354 10.63706 2.81639 -163.65680 999.08489
1785.0000 -171.35394 -161.75577 9.59817 2.91497 -161.95055 1054.44314
1790.0000 -170.90316 -160.65821 10.24496 2.90542 -162.11586 1025.27735
1795.0000 -171.41671 -159.92390 11.49281 2.94915 -161.35901 1076.24216
1800.0000 -171.41407 -161.73023 9.68384 2.99191 -160.61897 1116.02264
1805.0000 -172.37134 -162.83721 9.53413 2.88361 -162.49344 1024.02593
1810.0000 -172.09648 -161.54452 10.55196 2.87912 -162.57112 1053.40819
1815.0000 -169.63829 -159.90332 9.73497 2.95263 -161.29888 1064.79381
1820.0000 -170.38025 -161.32217 9.05808 3.03680 -159.84215 1122.86661
1825.0000 -170.37258 -160.95597 9.41661 2.95809 -161.20433 1070.06275
1830.0000 -170.58058 -160.71454 9.86603 2.97677 -160.88108 1086.66023
1835.0000 -170.23476 -160.77771 9.45705 2.93425 -161.61688 1038.58350
1840.0000 -172.07322 -161.77216 10.30106 2.91066 -162.02527 1042.37958
1845.0000 -170.34575 -160.74183 9.60392 2.97029 -160.99313 1099.14140
1850.0000 -169.77659 -157.85858 11.91802 3.04753 -159.65637 1111.72802
1855.0000 -171.40905 -162.20819 9.20085 3.02033 -160.12723 1159.15284
1860.0000 -171.14795 -162.48987 8.65808 2.84906 -163.09128 1010.95689
1865.0000 -172.32848 -162.38368 9.94480 2.88637 -162.44566 1015.16214
1870.0000 -171.23101 -161.13800 10.09301 2.94875 -161.36603 1048.44188
1875.0000 -171.35745 -161.34228 10.01517 3.00528 -160.38772 1115.28929
1880.0000 -171.70712 -162.64981 9.05731 2.96322 -161.11562 1065.76950
1885.0000 -172.58838 -163.47298 9.11540 2.83422 -163.34820 996.19544
1890.0000 -172.38475 -163.86423 8.52052 2.82662 -163.47967 965.01835
1895.0000 -172.97019 -164.63157 8.33862 2.80701 -163.81913 978.19705
1900.0000 -175.90518 -167.18908 8.71609 2.73171 -165.12237 949.24012
1905.0000 -172.83600 -163.57241 9.26358 2.69579 -165.74406 891.95129
1910.0000 -171.52665 -161.06035 10.46629 2.89614 -162.27646 1020.29272
1915.0000 -172.47355 -161.95720 10.51635 2.95815 -161.20334 1053.36908
1920.0000 -168.75241 -157.73165 11.02076 3.02518 -160.04325 1105.02500
1925.0000 -169.39457 -158.83745 10.55712 3.10772 -158.61471 1170.03654
1930.0000 -169.96133 -159.48661 10.47472 3.08395 -159.02616 1175.88483
1935.0000 -172.13486 -163.90165 8.23320 3.01212 -160.26924 1142.59325
1940.0000 -172.29236 -163.95249 8.33986 2.76284 -164.58347 936.36053
1945.0000 -171.40197 -159.49409 11.90789 2.87074 -162.71608 1027.41282
1950.0000 -170.84918 -161.51880 9.33038 3.05272 -159.56662 1139.57293
1955.0000 -171.67681 -162.97623 8.70058 2.94011 -161.51559 1046.10202
1960.0000 -170.68746 -160.26605 10.42142 2.95143 -161.31962 1087.15766
1965.0000 -172.29833 -161.97669 10.32164 3.00627 -160.37043 1114.70293
1970.0000 -171.94090 -161.55446 10.38644 2.92559 -161.76679 1074.12882
1975.0000 -173.03765 -163.99627 9.04138 2.90473 -162.12780 1048.66819
1980.0000 -173.62888 -164.21893 9.40995 2.83278 -163.37305 988.10170
1985.0000 -173.00350 -162.12492 10.87858 2.81977 -163.59819 989.76929
1990.0000 -173.44726 -163.21743 10.22984 2.84540 -163.15469 1008.44899
1995.0000 -169.62405 -161.01962 8.60443 2.87625 -162.62071 1042.43720
2000.0000 -169.67545 -158.13920 11.53625 3.06685 -159.32208 1159.90540
FREEZING PROCESS: loop number 9 T-loop= 1028.0000000000000
main_MD> interactions number 9 at Temperature= 1028.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.37929 2.45623 -1.22743
force_rgl> df(natom) 4.54818 -1.42786 -3.64141
2005.0000 -169.98825 -158.05726 11.93099 3.10251 -158.70495 1169.30055
2010.0000 -170.30027 -160.87875 9.42152 3.05244 -159.57139 1135.08883
2015.0000 -170.11456 -161.24256 8.87200 2.95254 -161.30046 1037.57802
2020.0000 -169.99987 -160.72930 9.27057 2.98510 -160.73697 1061.46351
2025.0000 -170.13977 -160.68857 9.45120 3.00266 -160.43298 1070.59809
2030.0000 -171.34569 -163.35212 7.99357 2.89330 -162.32559 1031.43906
2035.0000 -172.85868 -162.79548 10.06320 2.82881 -163.44173 1001.90812
2040.0000 -170.86044 -159.51836 11.34208 2.98524 -160.73450 1124.97130
2045.0000 -169.25352 -159.02287 10.23065 3.04291 -159.73630 1144.26492
2050.0000 -171.42131 -159.66061 11.76069 3.05706 -159.49150 1125.07321
2055.0000 -172.24562 -162.77240 9.47322 2.87393 -162.66085 1015.13791
2060.0000 -169.88717 -161.80724 8.07993 2.88269 -162.50938 1040.45796
2065.0000 -171.30267 -161.49057 9.81211 2.93213 -161.65369 1062.40116
2070.0000 -171.03865 -160.42629 10.61235 2.95478 -161.26157 1073.86458
2075.0000 -171.58635 -162.46591 9.12044 2.90915 -162.05134 1028.20346
2080.0000 -170.67795 -160.33149 10.34646 2.98397 -160.75653 1088.15283
2085.0000 -173.04803 -163.47668 9.57135 2.90095 -162.19324 1032.48747
2090.0000 -172.25938 -163.36438 8.89500 2.78382 -164.22048 984.62472
2095.0000 -172.93664 -163.89225 9.04440 2.79701 -163.99217 986.26422
2100.0000 -172.86441 -164.55216 8.31224 2.77729 -164.33351 930.25812
2105.0000 -174.69550 -165.17908 9.51642 2.75075 -164.79280 972.94984
2110.0000 -171.17666 -163.11027 8.06639 2.81707 -163.64494 989.82107
2115.0000 -172.75680 -162.78477 9.97202 2.83327 -163.36468 988.96596
2120.0000 -171.82997 -162.20592 9.62405 2.92748 -161.73406 1056.05741
2125.0000 -171.34385 -161.78033 9.56352 2.92107 -161.84504 1043.00615
2130.0000 -168.83870 -158.48456 10.35414 2.96062 -161.16064 1076.22581
2135.0000 -171.25132 -162.61166 8.63966 3.00534 -160.38657 1158.97386
2140.0000 -172.23943 -163.06046 9.17896 2.85196 -163.04118 1004.15101
2145.0000 -171.42206 -161.96883 9.45323 2.90424 -162.13640 1040.84829
2150.0000 -171.65703 -160.20942 11.44761 2.96436 -161.09586 1096.27118
2155.0000 -173.23507 -163.64819 9.58688 2.93078 -161.67699 1074.36943
2160.0000 -173.83002 -163.37538 10.45464 2.81940 -163.60470 974.28556
2165.0000 -172.43209 -161.78833 10.64376 2.86862 -162.75287 1032.47943
2170.0000 -170.36595 -159.63688 10.72907 2.99420 -160.57944 1115.75429
2175.0000 -172.28268 -163.45512 8.82756 2.95180 -161.31325 1106.73241
2180.0000 -170.47919 -160.92236 9.55683 2.85446 -162.99787 1017.66719
2185.0000 -172.35427 -162.80516 9.54911 2.96995 -160.99912 1102.94474
2190.0000 -174.26701 -165.03493 9.23208 2.81789 -163.63085 1009.83176
2195.0000 -174.48897 -165.60361 8.88536 2.73838 -165.00685 956.38272
2200.0000 -172.60483 -163.19944 9.40538 2.75850 -164.65857 945.47497
2205.0000 -171.96788 -162.94697 9.02091 2.88734 -162.42875 1029.91689
2210.0000 -169.04683 -159.11568 9.93116 2.94460 -161.43789 1080.72004
2215.0000 -170.70302 -159.76972 10.93330 3.06538 -159.34754 1152.23512
2220.0000 -171.62232 -161.79359 9.82873 2.91638 -161.92625 1061.46657
2225.0000 -172.26098 -160.51383 11.74715 2.94846 -161.37098 1090.37356
2230.0000 -171.99818 -161.93450 10.06368 2.94366 -161.45408 1037.93779
2235.0000 -173.48227 -164.26237 9.21989 2.85748 -162.94567 1016.11580
2240.0000 -171.40060 -161.77418 9.62642 2.82567 -163.49616 993.13080
2245.0000 -170.86916 -162.15638 8.71278 2.95423 -161.27111 1050.34403
2250.0000 -173.78355 -164.11961 9.66394 2.84970 -163.08031 1010.43087
FREEZING PROCESS: loop number 10 T-loop= 1003.0000000000000
main_MD> interactions number 10 at Temperature= 1003.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.03933 -3.26147 -7.09919
force_rgl> df(natom) 2.87043 0.37437 -1.96024
2255.0000 -174.80897 -165.75961 9.04936 2.79138 -164.08965 1017.56707
2260.0000 -172.68523 -163.11961 9.56562 2.78047 -164.27843 964.25889
2265.0000 -174.64994 -164.85569 9.79425 2.84395 -163.17985 993.89108
2270.0000 -173.47779 -163.63048 9.84732 2.80981 -163.77064 984.40161
2275.0000 -172.10709 -160.80087 11.30622 2.91889 -161.88274 1070.70044
2280.0000 -172.60793 -161.71011 10.89782 2.96807 -161.03155 1106.95985
2285.0000 -172.26889 -163.88712 8.38177 2.85607 -162.96998 1020.24615
2290.0000 -173.44843 -164.03775 9.41068 2.78875 -164.13506 956.23751
2295.0000 -172.60378 -163.82030 8.78348 2.77982 -164.28967 985.73831
2300.0000 -174.55399 -163.89505 10.65894 2.76548 -164.53790 960.45107
2305.0000 -173.18843 -165.29865 7.88978 2.80052 -163.93141 992.60071
2310.0000 -173.10341 -163.92271 9.18070 2.82384 -163.52790 970.48363
2315.0000 -174.81017 -166.31273 8.49744 2.75341 -164.74668 946.99453
2320.0000 -175.63909 -166.22338 9.41571 2.64622 -166.60190 892.43772
2325.0000 -172.74951 -163.88398 8.86553 2.72120 -165.30413 957.22551
2330.0000 -173.82306 -163.21520 10.60786 2.78795 -164.14900 1002.89718
2335.0000 -172.37381 -161.61932 10.75449 2.89129 -162.36038 1038.37751
2340.0000 -171.91033 -162.13432 9.77602 2.91933 -161.87518 1062.43964
2345.0000 -172.53176 -163.42201 9.10975 2.89397 -162.31401 1018.73779
2350.0000 -170.35787 -159.97749 10.38038 2.96352 -161.11038 1059.15741
2355.0000 -171.59445 -161.38478 10.20967 3.02422 -160.05977 1120.69940
2360.0000 -172.75970 -162.01526 10.74444 2.89288 -162.33302 1073.07011
2365.0000 -174.28257 -165.81188 8.47069 2.77610 -164.35411 992.91366
2370.0000 -173.55209 -163.88055 9.67155 2.71034 -165.49209 941.32222
2375.0000 -172.79860 -162.92843 9.87017 2.84999 -163.07529 1024.91218
2380.0000 -172.96996 -165.01252 7.95745 2.80765 -163.80808 980.72118
2385.0000 -172.04299 -162.45660 9.58639 2.79235 -164.07283 944.48653
2390.0000 -171.48898 -162.12222 9.36676 2.91521 -161.94646 1006.72059
2395.0000 -172.07823 -162.79412 9.28411 2.89432 -162.30796 1029.12903
2400.0000 -172.82797 -163.17697 9.65100 2.87087 -162.71379 1004.38004
2405.0000 -173.22139 -162.48672 10.73466 2.87171 -162.69929 1048.86508
2410.0000 -170.13717 -161.06360 9.07357 2.93408 -161.61997 1087.01789
2415.0000 -174.01432 -163.89394 10.12038 2.90995 -162.03744 1046.60436
2420.0000 -172.70494 -162.76747 9.93747 2.79997 -163.94097 974.26164
2425.0000 -173.25865 -164.77256 8.48609 2.81711 -163.64425 959.27066
2430.0000 -172.37058 -162.74523 9.62535 2.79246 -164.07091 965.56457
2435.0000 -173.44362 -164.01517 9.42845 2.85660 -162.96077 998.71265
2440.0000 -173.52102 -162.58665 10.93437 2.85464 -162.99478 998.92401
2445.0000 -173.61652 -162.79851 10.81801 2.85064 -163.06397 1029.79625
2450.0000 -173.73479 -165.51139 8.22340 2.79928 -163.95293 998.12534
2455.0000 -172.80348 -163.32608 9.47739 2.77475 -164.37749 992.61651
2460.0000 -174.48290 -164.83708 9.64582 2.88498 -162.46968 1011.71668
2465.0000 -173.85857 -164.14428 9.71429 2.79559 -164.01666 961.90326
2470.0000 -173.82611 -163.87658 9.94953 2.83684 -163.30281 1006.65199
2475.0000 -171.90106 -163.88869 8.01237 2.81472 -163.68567 977.03659
2480.0000 -173.55320 -163.48925 10.06395 2.76325 -164.57648 950.46168
2485.0000 -171.31647 -163.96993 7.34653 2.76852 -164.48519 934.15915
2490.0000 -173.10147 -163.43163 9.66984 2.82553 -163.49852 1004.19173
2495.0000 -171.17307 -162.00608 9.16699 2.84060 -163.23776 1010.38517
2500.0000 -171.05793 -161.68605 9.37188 2.90010 -162.20797 1073.21524
FREEZING PROCESS: loop number 11 T-loop= 978.00000000000000
main_MD> interactions number 11 at Temperature= 978.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.53214 1.57258 -1.93212
force_rgl> df(natom) 1.21430 -0.65918 -0.69305
2505.0000 -172.42065 -162.56778 9.85287 2.89891 -162.22864 1066.51876
2510.0000 -174.11491 -166.55405 7.56086 2.80848 -163.79372 987.33301
2515.0000 -172.93042 -163.32759 9.60283 2.72642 -165.21381 912.47603
2520.0000 -172.75114 -163.71318 9.03796 2.79429 -164.03916 961.15597
2525.0000 -172.72656 -164.49555 8.23101 2.81613 -163.66131 995.50478
2530.0000 -174.95174 -168.05282 6.89893 2.64634 -166.59973 857.43638
2535.0000 -172.84725 -165.05069 7.79656 2.65579 -166.43623 846.83065
2540.0000 -175.13238 -165.69745 9.43493 2.76617 -164.52584 971.43351
2545.0000 -174.41224 -166.40045 8.01178 2.68573 -165.91808 906.07257
2550.0000 -175.21125 -165.23038 9.98087 2.73023 -165.14797 935.69642
2555.0000 -172.84452 -164.75953 8.08499 2.78710 -164.16359 961.72918
2560.0000 -173.50485 -163.90197 9.60288 2.76531 -164.54075 968.16416
2565.0000 -172.20504 -163.89855 8.30649 2.81534 -163.67490 956.90665
2570.0000 -174.23343 -165.69022 8.54321 2.73546 -165.05732 922.80070
2575.0000 -174.12118 -165.40306 8.71812 2.76358 -164.57068 955.95308
2580.0000 -172.92110 -163.13465 9.78644 2.80203 -163.90534 947.83785
2585.0000 -174.47563 -165.56411 8.91152 2.80218 -163.90269 976.45769
2590.0000 -172.24032 -163.76113 8.47920 2.79378 -164.04810 973.95565
2595.0000 -173.04099 -165.48558 7.55542 2.75272 -164.75861 927.50116
2600.0000 -176.36900 -167.03087 9.33812 2.67298 -166.13871 922.64267
2605.0000 -174.24013 -165.18224 9.05789 2.64034 -166.70359 875.75692
2610.0000 -172.76373 -164.78563 7.97811 2.73389 -165.08457 954.25508
2615.0000 -173.04381 -164.47684 8.56697 2.73567 -165.05377 935.58413
2620.0000 -173.85515 -163.72462 10.13053 2.74230 -164.93907 948.20234
2625.0000 -173.76322 -165.99859 7.76462 2.73000 -165.15197 927.53101
2630.0000 -174.39802 -165.97844 8.41958 2.71587 -165.39637 927.23540
2635.0000 -173.60062 -166.15873 7.44190 2.67895 -166.03536 916.74368
2640.0000 -173.24078 -164.54016 8.70062 2.73453 -165.07343 943.13835
2645.0000 -173.81353 -164.73346 9.08007 2.78108 -164.26784 977.38448
2650.0000 -172.91746 -162.63995 10.27751 2.77334 -164.40190 975.55799
2655.0000 -171.43225 -162.23333 9.19892 2.90214 -162.17268 1051.72245
2660.0000 -171.78141 -163.22652 8.55489 2.90423 -162.13650 1002.46909
2665.0000 -173.79677 -164.43509 9.36168 2.82273 -163.54709 982.31960
2670.0000 -173.79115 -165.03130 8.75985 2.73994 -164.97986 948.71776
2675.0000 -174.44680 -165.90225 8.54455 2.74175 -164.94848 925.64479
2680.0000 -174.50538 -164.10343 10.40195 2.74947 -164.81492 944.06720
2685.0000 -174.20905 -165.16486 9.04420 2.78642 -164.17537 981.38586
2690.0000 -173.94428 -165.23424 8.71004 2.70256 -165.62688 905.79244
2695.0000 -171.96295 -163.88384 8.07911 2.79905 -163.95683 986.88013
2700.0000 -172.23655 -163.53398 8.70257 2.86802 -162.76325 1050.00624
2705.0000 -172.27375 -162.99506 9.27869 2.81686 -163.64867 992.88551
2710.0000 -173.47345 -165.06230 8.41115 2.83107 -163.40276 972.70041
2715.0000 -171.51786 -163.22602 8.29184 2.81919 -163.60821 981.48612
2720.0000 -173.00187 -163.58571 9.41616 2.80432 -163.86572 985.32635
2725.0000 -172.58944 -163.23548 9.35396 2.82558 -163.49772 982.55604
2730.0000 -173.63887 -164.34048 9.29840 2.83553 -163.32557 1028.54772
2735.0000 -171.95529 -162.88297 9.07232 2.82098 -163.57731 999.76839
2740.0000 -172.29746 -163.63550 8.66196 2.83314 -163.36693 984.86897
2745.0000 -171.63949 -163.45654 8.18295 2.84548 -163.15335 1008.29296
2750.0000 -173.27835 -164.18590 9.09245 2.80645 -163.82883 951.64656
FREEZING PROCESS: loop number 12 T-loop= 953.00000000000000
main_MD> interactions number 12 at Temperature= 953.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.52954 0.84261 1.70916
force_rgl> df(natom) -0.34225 1.56050 3.67517
2755.0000 -172.07022 -163.74451 8.32571 2.81682 -163.64937 967.94772
2760.0000 -174.70112 -166.24009 8.46103 2.71815 -165.35705 909.65326
2765.0000 -174.87732 -166.67082 8.20650 2.66358 -166.30139 862.43776
2770.0000 -174.46078 -165.48209 8.97869 2.65418 -166.46404 857.18647
2775.0000 -171.40999 -163.16014 8.24985 2.78741 -164.15835 969.12263
2780.0000 -174.13404 -164.40731 9.72673 2.73724 -165.02658 923.04843
2785.0000 -174.21724 -164.40221 9.81503 2.82421 -163.52149 1003.26896
2790.0000 -173.89691 -165.09036 8.80655 2.75301 -164.75360 951.87029
2795.0000 -173.85056 -165.03625 8.81432 2.72719 -165.20057 909.27614
2800.0000 -174.00214 -163.78614 10.21600 2.75969 -164.63799 954.14039
2805.0000 -173.48251 -165.13336 8.34915 2.76134 -164.60956 951.28805
2810.0000 -174.31989 -165.25636 9.06354 2.77520 -164.36962 921.64756
2815.0000 -173.49378 -163.70749 9.78629 2.78742 -164.15819 970.73637
2820.0000 -172.55281 -164.28317 8.26963 2.84318 -163.19316 988.05017
2825.0000 -172.39331 -164.69342 7.69989 2.73431 -165.07730 943.95671
2830.0000 -173.76563 -164.65358 9.11205 2.72532 -165.23298 916.52721
2835.0000 -175.11391 -164.96684 10.14707 2.76515 -164.54351 971.90350
2840.0000 -175.16817 -165.35641 9.81177 2.74355 -164.91744 925.35207
2845.0000 -174.60074 -166.04398 8.55677 2.64836 -166.56490 882.70458
2850.0000 -173.84566 -163.89464 9.95102 2.80436 -163.86492 973.19992
2855.0000 -174.19859 -166.05099 8.14760 2.72457 -165.24587 901.18431
2860.0000 -173.06842 -165.01318 8.05525 2.71907 -165.34108 892.05874
2865.0000 -173.19959 -165.94031 7.25928 2.71205 -165.46253 938.82517
2870.0000 -172.65273 -163.16269 9.49004 2.70012 -165.66902 908.22557
2875.0000 -172.22067 -162.06060 10.16007 2.88888 -162.40219 1054.88015
2880.0000 -172.78711 -163.82080 8.96631 2.84286 -163.19867 989.31530
2885.0000 -175.38670 -166.95191 8.43480 2.72411 -165.25378 923.62098
2890.0000 -173.86763 -165.60707 8.26056 2.67958 -166.02449 914.64178
2895.0000 -173.83600 -165.68815 8.14785 2.69528 -165.75276 929.77348
2900.0000 -173.45092 -163.26715 10.18377 2.79034 -164.10757 963.34265
2905.0000 -172.18964 -163.40792 8.78172 2.78586 -164.18506 963.05962
2910.0000 -173.18554 -164.93502 8.25051 2.78235 -164.24583 961.88923
2915.0000 -174.76531 -164.53962 10.22569 2.77730 -164.33327 969.14323
2920.0000 -173.56229 -163.20508 10.35721 2.80008 -163.93902 976.17140
2925.0000 -171.30371 -161.35938 9.94433 2.86535 -162.80937 1030.90912
2930.0000 -171.54503 -163.19181 8.35322 2.87238 -162.68768 1026.30807
2935.0000 -172.15932 -163.25828 8.90104 2.79044 -164.10586 957.20920
2940.0000 -172.41571 -163.29232 9.12338 2.83726 -163.29564 1019.04744
2945.0000 -172.71500 -163.58008 9.13491 2.79168 -164.08434 999.23939
2950.0000 -172.04726 -162.61972 9.42755 2.84441 -163.17186 1023.01879
2955.0000 -171.40020 -162.33112 9.06909 2.86250 -162.85873 1029.48845
2960.0000 -174.42719 -165.72098 8.70620 2.79274 -164.06608 973.72700
2965.0000 -173.91817 -164.59463 9.32354 2.67750 -166.06044 906.90106
2970.0000 -173.87547 -164.54288 9.33259 2.75707 -164.68336 935.20508
2975.0000 -174.37929 -165.30998 9.06931 2.74642 -164.86780 958.82771
2980.0000 -174.01139 -165.93682 8.07457 2.69800 -165.70577 903.85390
2985.0000 -173.70521 -164.25762 9.44759 2.68599 -165.91355 885.20178
2990.0000 -173.68214 -164.45627 9.22587 2.81350 -163.70681 982.54314
2995.0000 -172.09735 -164.29495 7.80240 2.78115 -164.26663 971.36444
3000.0000 -173.26424 -165.35711 7.90713 2.71566 -165.40014 887.32555
FREEZING PROCESS: loop number 13 T-loop= 928.00000000000000
main_MD> interactions number 13 at Temperature= 928.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.81569 -8.66111 0.93750
force_rgl> df(natom) -0.35539 3.61681 -1.94210
3005.0000 -174.75387 -165.84490 8.90896 2.74519 -164.88910 931.61489
3010.0000 -174.46958 -165.10232 9.36726 2.70364 -165.60817 911.27620
3015.0000 -173.72756 -164.97947 8.74808 2.72309 -165.27147 921.66629
3020.0000 -172.64699 -164.15401 8.49298 2.79753 -163.98324 964.45442
3025.0000 -171.68838 -163.34695 8.34143 2.81096 -163.75074 994.85834
3030.0000 -172.53507 -164.23441 8.30067 2.84903 -163.09189 978.98045
3035.0000 -172.75632 -163.51379 9.24253 2.74280 -164.93039 937.81516
3040.0000 -171.11707 -163.02444 8.09263 2.79554 -164.01756 910.02851
3045.0000 -175.22098 -165.11591 10.10507 2.76448 -164.55521 960.43659
3050.0000 -173.82710 -166.22830 7.59879 2.72226 -165.28582 919.83609
3055.0000 -172.56759 -164.67272 7.89487 2.69047 -165.83609 912.21406
3060.0000 -173.57522 -164.44983 9.12540 2.74237 -164.93786 942.91163
3065.0000 -176.35910 -168.75042 7.60867 2.60615 -167.29543 854.48339
3070.0000 -173.81248 -164.60531 9.20717 2.66865 -166.21370 891.86458
3075.0000 -175.01345 -166.28994 8.72351 2.69869 -165.69375 934.43238
3080.0000 -174.98390 -166.88354 8.10036 2.64439 -166.63352 867.53677
3085.0000 -174.47614 -166.75298 7.72316 2.62411 -166.98451 840.32230
3090.0000 -173.60359 -164.30641 9.29718 2.71096 -165.48151 918.98788
3095.0000 -172.71808 -162.78863 9.92945 2.84855 -163.10010 1007.20915
3100.0000 -173.07227 -163.60827 9.46400 2.87185 -162.69689 1027.10987
3105.0000 -173.88835 -165.27302 8.61533 2.81541 -163.67378 993.50216
3110.0000 -175.18821 -166.23578 8.95242 2.72640 -165.21420 966.02114
3115.0000 -174.48949 -165.99272 8.49677 2.65554 -166.44054 864.45168
3120.0000 -174.57969 -166.20082 8.37888 2.67309 -166.13681 885.85524
3125.0000 -174.71956 -165.25064 9.46892 2.70674 -165.55453 900.80400
3130.0000 -173.73694 -164.91967 8.81727 2.72924 -165.16509 941.96570
3135.0000 -174.95122 -167.47506 7.47616 2.65126 -166.51470 865.48546
3140.0000 -174.76493 -165.97121 8.79372 2.64638 -166.59916 867.16362
3145.0000 -173.92104 -165.69974 8.22130 2.63371 -166.81837 840.32449
3150.0000 -174.85801 -165.35014 9.50786 2.66832 -166.21948 870.95181
3155.0000 -174.68151 -165.86800 8.81351 2.73234 -165.11142 927.82797
3160.0000 -173.77238 -164.05854 9.71385 2.78204 -164.25133 953.21636
3165.0000 -172.39594 -163.82454 8.57141 2.81381 -163.70140 1029.63413
3170.0000 -172.27157 -164.02868 8.24289 2.79084 -164.09897 981.03430
3175.0000 -172.04737 -163.65955 8.38782 2.78650 -164.17407 961.66758
3180.0000 -174.53718 -166.31274 8.22444 2.77794 -164.32226 943.44279
3185.0000 -172.82988 -164.75091 8.07897 2.70945 -165.50754 925.21097
3190.0000 -172.68085 -164.04953 8.63132 2.74600 -164.87506 918.80776
3195.0000 -173.60295 -164.46593 9.13702 2.80177 -163.90981 989.07242
3200.0000 -172.48098 -162.64814 9.83284 2.78900 -164.13076 951.14603
3205.0000 -174.53366 -166.38050 8.15315 2.75241 -164.76401 947.03083
3210.0000 -177.14054 -169.18095 7.95959 2.56926 -167.93379 828.45850
3215.0000 -176.82341 -168.71721 8.10619 2.57283 -167.87201 843.98680
3220.0000 -176.41056 -167.98778 8.42278 2.54880 -168.28796 821.83263
3225.0000 -173.62414 -164.43418 9.18996 2.63942 -166.71958 849.56931
3230.0000 -174.72646 -164.97221 9.75425 2.75439 -164.72978 958.66845
3235.0000 -172.60903 -163.25452 9.35451 2.82880 -163.44206 991.37582
3240.0000 -172.29846 -162.71881 9.57965 2.87917 -162.57025 1019.00034
3245.0000 -172.46991 -163.85827 8.61163 2.83233 -163.38094 990.68269
3250.0000 -174.79645 -165.00462 9.79184 2.77237 -164.41866 955.70157
FREEZING PROCESS: loop number 14 T-loop= 903.00000000000000
main_MD> interactions number 14 at Temperature= 903.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.95724 0.37925 1.53459
force_rgl> df(natom) 4.76513 -4.59040 2.86852
3255.0000 -173.43485 -166.66220 6.77265 2.67086 -166.17548 879.12405
3260.0000 -175.74917 -166.97265 8.77652 2.59284 -167.52567 859.12795
3265.0000 -174.70567 -166.18602 8.51965 2.60928 -167.24113 867.05147
3270.0000 -172.92372 -165.01768 7.90604 2.68840 -165.87180 885.39336
3275.0000 -175.00007 -166.88927 8.11081 2.71749 -165.36841 918.17734
3280.0000 -174.41956 -167.92535 6.49421 2.60570 -167.30322 840.61394
3285.0000 -175.47323 -167.19565 8.27757 2.58769 -167.61492 830.97814
3290.0000 -174.62930 -165.56183 9.06746 2.62983 -166.88554 869.40822
3295.0000 -174.46103 -166.28082 8.18021 2.68991 -165.84566 885.59071
3300.0000 -174.56488 -166.26160 8.30328 2.66020 -166.35989 878.59402
3305.0000 -174.15725 -166.34083 7.81642 2.68306 -165.96424 930.31344
3310.0000 -175.48251 -165.96572 9.51679 2.67547 -166.09568 904.95030
3315.0000 -174.11814 -165.57112 8.54702 2.68619 -165.91010 904.10189
3320.0000 -175.71315 -167.21522 8.49793 2.59178 -167.54414 822.26950
3325.0000 -175.90231 -168.00978 7.89253 2.54265 -168.39443 811.90459
3330.0000 -175.36180 -166.77924 8.58257 2.63175 -166.85238 881.82895
3335.0000 -173.52937 -164.89959 8.62977 2.66667 -166.24796 895.97933
3340.0000 -175.09293 -166.53851 8.55442 2.70561 -165.57394 912.67710
3345.0000 -176.48982 -167.87488 8.61494 2.65663 -166.42172 881.22427
3350.0000 -176.50919 -167.53361 8.97558 2.56572 -167.99503 836.11040
3355.0000 -174.93454 -166.08741 8.84713 2.66601 -166.25940 897.48375
3360.0000 -175.37799 -165.75096 9.62702 2.72553 -165.22919 910.75869
3365.0000 -173.20880 -165.28408 7.92472 2.71575 -165.39854 915.60988
3370.0000 -172.48943 -165.21856 7.27087 2.69824 -165.70149 899.26817
3375.0000 -173.66194 -165.29773 8.36422 2.70917 -165.51245 893.27675
3380.0000 -173.14006 -165.06946 8.07060 2.74585 -164.87760 925.40729
3385.0000 -175.39857 -166.68058 8.71799 2.69313 -165.79001 914.97413
3390.0000 -175.33551 -167.99011 7.34540 2.61236 -167.18786 846.03932
3395.0000 -174.38044 -166.02740 8.35304 2.60440 -167.32563 838.85207
3400.0000 -175.13021 -166.00337 9.12685 2.69393 -165.77625 910.59026
3405.0000 -171.86223 -163.88144 7.98079 2.75025 -164.80150 952.13825
3410.0000 -174.29303 -166.19734 8.09569 2.78115 -164.26661 959.37403
3415.0000 -174.33578 -166.39560 7.94018 2.63417 -166.81041 841.75610
3420.0000 -174.98911 -165.63449 9.35463 2.70630 -165.56215 930.30333
3425.0000 -175.18009 -167.24658 7.93351 2.63957 -166.71694 849.44152
3430.0000 -176.30100 -168.37221 7.92879 2.59642 -167.46375 845.71760
3435.0000 -175.83006 -168.05897 7.77109 2.55692 -168.14733 807.59072
3440.0000 -174.61521 -165.24722 9.36799 2.58941 -167.58511 828.65614
3445.0000 -174.67923 -167.06242 7.61681 2.64379 -166.64386 873.23160
3450.0000 -173.43638 -165.17743 8.25896 2.68961 -165.85092 902.01172
3455.0000 -174.52016 -165.52607 8.99409 2.74050 -164.97025 919.22270
3460.0000 -172.52243 -164.36366 8.15877 2.71830 -165.35431 905.37675
3465.0000 -173.20573 -165.55114 7.65459 2.75443 -164.72904 942.69846
3470.0000 -173.39004 -164.92600 8.46405 2.74020 -164.97533 944.60808
3475.0000 -175.75139 -167.71712 8.03427 2.62333 -166.99799 842.71684
3480.0000 -174.72293 -167.06011 7.66282 2.62973 -166.88729 867.34191
3485.0000 -173.18722 -166.47360 6.71362 2.65250 -166.49327 867.91586
3490.0000 -171.69158 -164.06138 7.63020 2.69634 -165.73448 877.75592
3495.0000 -173.14386 -165.03690 8.10696 2.77783 -164.32414 934.82233
3500.0000 -173.95313 -165.97846 7.97466 2.74134 -164.95558 938.68796
FREEZING PROCESS: loop number 15 T-loop= 878.00000000000000
main_MD> interactions number 15 at Temperature= 878.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.19647 0.48436 2.47283
force_rgl> df(natom) -1.13716 -1.11987 -0.08109
3505.0000 -172.74688 -165.83643 6.91045 2.72255 -165.28080 944.88171
3510.0000 -175.08103 -166.61609 8.46494 2.69267 -165.79802 904.01099
3515.0000 -174.72258 -166.40568 8.31691 2.60376 -167.33668 868.93719
3520.0000 -175.86913 -166.94018 8.92895 2.68919 -165.85822 934.02269
3525.0000 -175.12385 -166.99557 8.12828 2.61796 -167.09091 863.02354
3530.0000 -173.70928 -165.12089 8.58839 2.69655 -165.73076 910.81557
3535.0000 -174.70443 -167.07141 7.63302 2.67407 -166.11980 861.10160
3540.0000 -174.65056 -165.68982 8.96074 2.65507 -166.44870 860.21682
3545.0000 -172.92274 -164.36497 8.55777 2.74471 -164.89735 960.64245
3550.0000 -175.68974 -166.49389 9.19585 2.71243 -165.45597 898.07295
3555.0000 -174.68211 -166.34183 8.34028 2.65288 -166.48661 880.84293
3560.0000 -174.81096 -168.42875 6.38220 2.59277 -167.52689 832.41835
3565.0000 -173.18064 -164.93490 8.24574 2.65051 -166.52762 866.45057
3570.0000 -174.45246 -165.80382 8.64864 2.76567 -164.53461 948.61061
3575.0000 -175.46102 -166.39216 9.06887 2.69717 -165.72005 918.42335
3580.0000 -176.14722 -167.69207 8.45515 2.59689 -167.45556 830.12672
3585.0000 -173.94232 -166.32989 7.61243 2.62114 -167.03595 831.14064
3590.0000 -174.25983 -166.50469 7.75514 2.65460 -166.45690 830.41817
3595.0000 -173.80175 -164.11682 9.68493 2.74629 -164.86997 908.07858
3600.0000 -172.95879 -164.09546 8.86333 2.80617 -163.83366 968.53601
3605.0000 -172.51821 -163.94981 8.56840 2.80466 -163.85970 983.66225
3610.0000 -174.01537 -165.64793 8.36744 2.71529 -165.40646 879.72368
3615.0000 -175.17316 -168.23561 6.93755 2.61435 -167.15340 878.87781
3620.0000 -174.36156 -168.03437 6.32720 2.59984 -167.40456 866.00736
3625.0000 -175.46733 -167.47125 7.99607 2.56465 -168.01362 824.70582
3630.0000 -174.91949 -168.32652 6.59296 2.58909 -167.59057 870.44584
3635.0000 -176.30285 -168.32728 7.97557 2.55813 -168.12651 794.71213
3640.0000 -175.60978 -168.20639 7.40339 2.54680 -168.32260 824.11663
3645.0000 -174.85533 -165.81967 9.03567 2.62779 -166.92093 864.41917
3650.0000 -174.28799 -166.36329 7.92470 2.67597 -166.08697 869.61047
3655.0000 -175.34354 -167.43269 7.91085 2.60678 -167.28439 858.42470
3660.0000 -176.46012 -168.75321 7.70691 2.57335 -167.86308 821.03001
3665.0000 -174.94918 -167.74964 7.19954 2.56986 -167.92353 829.26154
3670.0000 -174.84508 -167.53470 7.31038 2.56014 -168.09173 827.31185
3675.0000 -175.53405 -168.64347 6.89058 2.54709 -168.31750 796.27950
3680.0000 -175.19162 -167.64238 7.54924 2.55854 -168.11939 774.91800
3685.0000 -175.49713 -167.70718 7.78994 2.61334 -167.17101 853.71379
3690.0000 -177.50888 -169.68128 7.82760 2.50975 -168.96373 810.82385
3695.0000 -175.74846 -166.91127 8.83719 2.56587 -167.99251 832.45902
3700.0000 -173.93894 -165.15550 8.78344 2.70012 -165.66906 899.28176
3705.0000 -174.15022 -164.25922 9.89100 2.75386 -164.73889 934.11729
3710.0000 -175.93230 -167.14385 8.78845 2.72251 -165.28152 909.44665
3715.0000 -174.70221 -166.41733 8.28488 2.66244 -166.32113 887.40758
3720.0000 -172.70452 -162.85393 9.85059 2.74538 -164.88576 923.53130
3725.0000 -172.53603 -164.17102 8.36502 2.80404 -163.87047 993.71149
3730.0000 -174.03312 -163.86400 10.16913 2.80325 -163.88411 982.91977
3735.0000 -174.78700 -166.30736 8.47964 2.74781 -164.84372 948.19591
3740.0000 -176.44444 -167.28859 9.15584 2.67943 -166.02710 921.52736
3745.0000 -174.32957 -166.78032 7.54924 2.61718 -167.10450 864.53490
3750.0000 -174.22082 -166.37944 7.84138 2.68556 -165.92100 884.49622
FREEZING PROCESS: loop number 16 T-loop= 853.00000000000000
main_MD> interactions number 16 at Temperature= 853.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 4.67877 -0.62898 -4.96351
force_rgl> df(natom) 0.49750 0.23550 2.23577
3755.0000 -177.38336 -167.47413 9.90923 2.62008 -167.05421 856.37632
3760.0000 -175.89629 -168.41130 7.48499 2.58485 -167.66393 822.16775
3765.0000 -175.14589 -166.32526 8.82062 2.58632 -167.63861 859.05159
3770.0000 -175.56554 -167.23553 8.33000 2.65895 -166.38157 895.95039
3775.0000 -176.11466 -167.95788 8.15678 2.55442 -168.19064 822.93728
3780.0000 -176.17221 -167.16021 9.01200 2.56170 -168.06467 819.12971
3785.0000 -175.07851 -167.94669 7.13182 2.57538 -167.82798 825.30613
3790.0000 -175.46990 -168.46903 7.00087 2.57858 -167.77259 819.87848
3795.0000 -175.71411 -167.79866 7.91545 2.54329 -168.38327 788.08446
3800.0000 -176.01717 -166.41095 9.60621 2.63993 -166.71082 870.74849
3805.0000 -176.14216 -167.90664 8.23552 2.60816 -167.26060 844.54931
3810.0000 -173.91102 -165.92407 7.98695 2.65501 -166.44973 884.89757
3815.0000 -175.89541 -167.24071 8.65470 2.64995 -166.53725 865.03567
3820.0000 -173.72048 -166.51992 7.20056 2.65439 -166.46050 849.87056
3825.0000 -174.36586 -164.94317 9.42269 2.66702 -166.24194 879.24227
3830.0000 -174.11690 -164.34695 9.76995 2.73417 -165.07974 926.73249
3835.0000 -174.98664 -167.57614 7.41050 2.66194 -166.32980 870.06126
3840.0000 -175.96139 -167.51355 8.44783 2.59706 -167.45265 833.33910
3845.0000 -171.64161 -163.21375 8.42786 2.69531 -165.75227 859.44393
3850.0000 -174.66846 -165.42965 9.23882 2.74631 -164.86960 931.11401
3855.0000 -174.14738 -165.92309 8.22429 2.69056 -165.83443 908.91995
3860.0000 -175.66926 -168.09014 7.57913 2.63615 -166.77622 886.58871
3865.0000 -175.27771 -167.30017 7.97754 2.59604 -167.47028 836.10971
3870.0000 -174.75553 -165.68756 9.06797 2.68270 -165.97052 903.17060
3875.0000 -175.80429 -167.12086 8.68343 2.60886 -167.24848 843.97589
3880.0000 -176.11735 -167.78498 8.33237 2.62945 -166.89212 861.19979
3885.0000 -175.72909 -167.01816 8.71093 2.57447 -167.84373 830.90356
3890.0000 -176.17612 -167.93869 8.23743 2.59901 -167.41898 846.23723
3895.0000 -175.07485 -166.75603 8.31882 2.63731 -166.75608 888.98744
3900.0000 -173.95383 -166.24842 7.70541 2.64798 -166.57149 883.72624
3905.0000 -174.83600 -166.74324 8.09275 2.64376 -166.64440 871.87356
3910.0000 -176.64392 -168.37728 8.26664 2.59695 -167.45455 834.46179
3915.0000 -175.51428 -167.99774 7.51654 2.52664 -168.67147 791.19717
3920.0000 -175.38579 -168.20701 7.17878 2.57655 -167.80767 834.17427
3925.0000 -174.90514 -167.40567 7.49947 2.59390 -167.50740 844.46813
3930.0000 -173.22725 -164.98723 8.24003 2.60992 -167.23017 836.86310
3935.0000 -175.00626 -167.50056 7.50570 2.64864 -166.56004 834.88645
3940.0000 -175.97832 -168.05566 7.92266 2.56604 -167.98949 840.31937
3945.0000 -175.72599 -168.25160 7.47439 2.58320 -167.69253 836.45862
3950.0000 -174.54214 -166.82306 7.71908 2.58341 -167.68895 823.02691
3955.0000 -174.66585 -166.82571 7.84014 2.64743 -166.58086 846.32380
3960.0000 -174.88079 -166.40861 8.47218 2.65995 -166.36418 873.98793
3965.0000 -174.46974 -167.10072 7.36902 2.66867 -166.21341 876.79368
3970.0000 -175.90807 -168.90818 6.99989 2.53668 -168.49766 772.24978
3975.0000 -176.19225 -168.00135 8.19089 2.56828 -167.95076 814.29420
3980.0000 -174.35909 -166.32001 8.03909 2.65669 -166.42074 870.45712
3985.0000 -174.47646 -166.03531 8.44116 2.67541 -166.09673 886.24126
3990.0000 -173.01114 -166.11918 6.89197 2.65982 -166.36651 881.79200
3995.0000 -173.87655 -166.06957 7.80698 2.66335 -166.30541 855.76952
4000.0000 -174.88163 -166.74603 8.13560 2.65494 -166.45092 880.60753
FREEZING PROCESS: loop number 17 T-loop= 828.00000000000000
main_MD> interactions number 17 at Temperature= 828.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.42173 -4.80554 0.97599
force_rgl> df(natom) -2.06186 -1.45865 0.32150
4005.0000 -175.72939 -166.58578 9.14361 2.65318 -166.48140 905.04968
4010.0000 -174.91501 -167.75444 7.16057 2.58563 -167.65060 857.48305
4015.0000 -175.32889 -167.64019 7.68870 2.56244 -168.05182 816.81512
4020.0000 -175.40814 -166.79852 8.60962 2.58825 -167.60511 841.99240
4025.0000 -175.12238 -165.92369 9.19869 2.65541 -166.44284 905.42054
4030.0000 -173.99278 -165.87553 8.11725 2.70924 -165.51128 912.06213
4035.0000 -174.95564 -166.20797 8.74767 2.69444 -165.76742 899.42041
4040.0000 -175.67600 -168.59495 7.08106 2.58540 -167.65450 853.35687
4045.0000 -174.64088 -166.73531 7.90557 2.65906 -166.37975 894.56561
4050.0000 -176.24775 -168.46686 7.78090 2.63985 -166.71207 849.16399
4055.0000 -177.51756 -168.32997 9.18760 2.54257 -168.39584 825.49232
4060.0000 -175.04557 -167.24770 7.79787 2.58116 -167.72792 830.86782
4065.0000 -175.17091 -165.91101 9.25991 2.66797 -166.22547 898.91283
4070.0000 -175.72890 -167.89628 7.83262 2.59201 -167.54010 822.04452
4075.0000 -175.11377 -167.14205 7.97172 2.62135 -167.03226 853.23313
4080.0000 -175.08479 -166.65369 8.43111 2.63582 -166.78185 858.61439
4085.0000 -176.34354 -168.55700 7.78654 2.58193 -167.71464 856.34439
4090.0000 -176.02583 -168.26730 7.75853 2.53752 -168.48316 804.24347
4095.0000 -175.55365 -167.26083 8.29282 2.54367 -168.37667 789.87608
4100.0000 -175.42876 -167.93382 7.49494 2.58577 -167.64809 826.66461
4105.0000 -175.45569 -167.83923 7.61646 2.54832 -168.29628 815.31874
4110.0000 -176.15699 -167.75957 8.39742 2.59106 -167.55662 827.79792
4115.0000 -176.41299 -168.68693 7.72605 2.54271 -168.39335 824.99726
4120.0000 -176.36418 -169.05365 7.31053 2.51904 -168.80294 818.31817
4125.0000 -175.50176 -166.65451 8.84725 2.55452 -168.18897 834.61188
4130.0000 -175.27129 -167.08453 8.18675 2.66313 -166.30920 899.82626
4135.0000 -175.70105 -168.62444 7.07661 2.52551 -168.69099 805.56247
4140.0000 -174.75844 -167.64789 7.11054 2.54718 -168.31595 791.10174
4145.0000 -175.17618 -167.34790 7.82828 2.60154 -167.37513 826.10490
4150.0000 -176.69898 -169.01606 7.68292 2.60208 -167.36588 857.62352
4155.0000 -175.74324 -168.14069 7.60256 2.55987 -168.09631 823.09593
4160.0000 -174.34262 -166.95757 7.38505 2.58438 -167.67212 832.53631
4165.0000 -176.83478 -169.26747 7.56731 2.55566 -168.16917 813.81901
4170.0000 -175.99599 -168.70347 7.29252 2.51595 -168.85650 769.93683
4175.0000 -175.05067 -168.87835 6.17232 2.49443 -169.22897 778.77426
4180.0000 -175.49951 -168.06164 7.43787 2.54940 -168.27754 804.57465
4185.0000 -175.39003 -167.13489 8.25514 2.60745 -167.27289 813.03283
4190.0000 -174.81218 -166.91391 7.89827 2.64437 -166.63395 859.03221
4195.0000 -175.71033 -169.41826 6.29206 2.55163 -168.23902 821.54712
4200.0000 -176.04336 -168.08965 7.95371 2.54632 -168.33091 786.03854
4205.0000 -174.75045 -167.25400 7.49644 2.54765 -168.30789 802.89173
4210.0000 -176.09361 -167.73683 8.35678 2.59886 -167.42163 844.95649
4215.0000 -175.24502 -168.66548 6.57953 2.56206 -168.05844 823.61766
4220.0000 -175.68695 -168.79560 6.89136 2.52959 -168.62046 796.14592
4225.0000 -175.60699 -166.54117 9.06582 2.56373 -168.02957 831.19231
4230.0000 -175.52159 -168.44227 7.07932 2.62977 -166.88661 868.97748
4235.0000 -175.45120 -167.61270 7.83850 2.57227 -167.88179 841.69638
4240.0000 -174.79633 -167.32779 7.46855 2.58444 -167.67113 845.82913
4245.0000 -177.89298 -170.17560 7.71738 2.49851 -169.15825 750.23777
4250.0000 -176.07335 -169.16401 6.90934 2.46921 -169.66532 762.25054
FREEZING PROCESS: loop number 18 T-loop= 803.00000000000000
main_MD> interactions number 18 at Temperature= 803.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.67373 3.04905 3.20249
force_rgl> df(natom) -0.85205 -1.73779 -1.68806
4255.0000 -174.10497 -167.19687 6.90810 2.55170 -168.23771 820.12519
4260.0000 -175.15536 -167.58483 7.57053 2.60619 -167.29469 840.35130
4265.0000 -176.23351 -167.87429 8.35922 2.61848 -167.08198 867.16842
4270.0000 -176.54484 -168.69988 7.84497 2.54186 -168.40797 795.32498
4275.0000 -177.19122 -169.51645 7.67477 2.49693 -169.18562 757.64561
4280.0000 -178.16773 -171.33652 6.83121 2.43393 -170.27600 737.71372
4285.0000 -176.08056 -168.00553 8.07504 2.47784 -169.51605 778.16131
4290.0000 -176.14306 -169.56941 6.57364 2.52477 -168.70381 809.31052
4295.0000 -176.22030 -168.30986 7.91044 2.48379 -169.41302 791.59370
4300.0000 -175.44889 -168.26028 7.18861 2.54220 -168.40209 799.53438
4305.0000 -176.23264 -168.13469 8.09795 2.55131 -168.24455 789.70294
4310.0000 -175.35189 -168.24227 7.10961 2.54532 -168.34821 827.12008
4315.0000 -175.67705 -167.89560 7.78146 2.55573 -168.16807 817.66969
4320.0000 -176.48982 -168.61852 7.87130 2.53345 -168.55360 815.28477
4325.0000 -175.95472 -168.80752 7.14720 2.55527 -168.17590 799.20448
4330.0000 -175.94827 -167.57843 8.36984 2.54629 -168.33139 793.81861
4335.0000 -177.10399 -169.81098 7.29301 2.52275 -168.73882 803.67254
4340.0000 -177.89710 -170.72167 7.17543 2.46854 -169.67708 770.19155
4345.0000 -176.95975 -169.93566 7.02409 2.40599 -170.75959 727.76790
4350.0000 -175.29134 -167.56558 7.72575 2.52649 -168.67409 788.68423
4355.0000 -175.70628 -168.42702 7.27926 2.55005 -168.26635 799.94695
4360.0000 -177.02948 -169.85739 7.17209 2.51263 -168.91393 778.86631
4365.0000 -176.78309 -170.12856 6.65453 2.46666 -169.70960 736.00860
4370.0000 -176.39127 -169.89181 6.49946 2.48056 -169.46898 740.65545
4375.0000 -176.90116 -168.27339 8.62776 2.51116 -168.93936 779.31329
4380.0000 -176.41807 -168.45837 7.95970 2.53568 -168.51495 806.61906
4385.0000 -175.70233 -168.81920 6.88313 2.47987 -169.48094 748.89415
4390.0000 -174.34043 -165.99794 8.34249 2.63161 -166.85475 841.27347
4395.0000 -174.31427 -166.22516 8.08911 2.65819 -166.39469 883.13328
4400.0000 -174.00121 -166.77013 7.23108 2.66605 -166.25868 887.69714
4405.0000 -174.10655 -167.11038 6.99617 2.64417 -166.63736 840.33529
4410.0000 -175.97081 -168.57868 7.39213 2.61253 -167.18490 842.63407
4415.0000 -177.39034 -169.14185 8.24849 2.56275 -168.04645 819.62830
4420.0000 -174.90060 -166.24848 8.65212 2.57448 -167.84342 825.16226
4425.0000 -175.63710 -167.64588 7.99122 2.62198 -167.02138 847.91445
4430.0000 -176.31475 -169.76243 6.55233 2.51951 -168.79485 795.48954
4435.0000 -177.29714 -170.11710 7.18004 2.49832 -169.16155 775.16178
4440.0000 -176.29380 -169.19895 7.09484 2.48112 -169.45922 771.39005
4445.0000 -179.01396 -171.23626 7.77770 2.42935 -170.35520 747.45910
4450.0000 -177.00175 -170.33645 6.66529 2.41286 -170.64065 745.84562
4455.0000 -178.16843 -171.22736 6.94107 2.39241 -170.99458 714.99458
4460.0000 -176.31299 -170.02740 6.28560 2.43318 -170.28902 727.76115
4465.0000 -175.43761 -168.41297 7.02464 2.50151 -169.10640 770.37227
4470.0000 -175.04190 -167.40159 7.64031 2.55635 -168.15729 816.40577
4475.0000 -174.85826 -167.24109 7.61716 2.60407 -167.33134 838.66286
4480.0000 -174.43081 -167.28145 7.14936 2.61713 -167.10529 845.87053
4485.0000 -175.25686 -166.29233 8.96453 2.60507 -167.31401 814.13077
4490.0000 -175.63790 -168.20823 7.42967 2.61187 -167.19637 853.11667
4495.0000 -175.68583 -169.37160 6.31423 2.47725 -169.52626 746.00082
4500.0000 -176.01932 -168.62806 7.39125 2.49831 -169.16172 756.58554
FREEZING PROCESS: loop number 19 T-loop= 778.00000000000000
main_MD> interactions number 19 at Temperature= 778.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.95549 1.77358 1.43803
force_rgl> df(natom) -0.27993 -2.25655 -1.81498
4505.0000 -176.97810 -168.68507 8.29303 2.53143 -168.58851 816.08809
4510.0000 -176.04728 -168.91549 7.13179 2.53669 -168.49752 773.91829
4515.0000 -177.66806 -170.67215 6.99590 2.44000 -170.17100 731.89424
4520.0000 -174.70600 -168.75104 5.95495 2.46474 -169.74280 720.13745
4525.0000 -176.39827 -168.74717 7.65110 2.47484 -169.56791 779.30682
4530.0000 -177.25662 -170.11689 7.13973 2.46611 -169.71911 774.05030
4535.0000 -176.78359 -169.97501 6.80858 2.44679 -170.05347 724.57307
4540.0000 -175.64032 -167.61647 8.02385 2.47950 -169.48738 758.28254
4545.0000 -176.32977 -169.75121 6.57856 2.52702 -168.66492 800.02382
4550.0000 -178.08445 -169.78262 8.30183 2.46552 -169.72928 762.78406
4555.0000 -175.81955 -167.28056 8.53899 2.50144 -169.10766 775.89281
4560.0000 -176.45831 -168.41094 8.04737 2.56060 -168.08374 816.85620
4565.0000 -175.61647 -168.84863 6.76784 2.50678 -169.01524 776.64022
4570.0000 -176.49979 -170.25147 6.24832 2.45763 -169.86579 713.03353
4575.0000 -178.25248 -171.56556 6.68692 2.42762 -170.38524 718.77687
4580.0000 -176.23682 -169.82933 6.40748 2.41285 -170.64089 702.80347
4585.0000 -175.01756 -168.53396 6.48359 2.47526 -169.56065 723.76492
4590.0000 -175.51232 -169.04272 6.46960 2.48449 -169.40088 748.94627
4595.0000 -178.15601 -170.80002 7.35599 2.43088 -170.32878 734.38004
4600.0000 -176.29745 -168.88465 7.41280 2.46717 -169.70075 779.74229
4605.0000 -175.49077 -168.87009 6.62068 2.52588 -168.68468 796.17860
4610.0000 -175.62657 -167.54861 8.07796 2.57483 -167.83736 793.34556
4615.0000 -175.47023 -168.43694 7.03330 2.54437 -168.36466 793.71593
4620.0000 -175.53967 -168.34875 7.19093 2.53872 -168.46237 809.16992
4625.0000 -177.67406 -170.79567 6.87839 2.47664 -169.53673 770.89302
4630.0000 -177.16320 -171.00629 6.15691 2.42623 -170.40923 730.01096
4635.0000 -178.04036 -171.55645 6.48391 2.37500 -171.29585 688.36324
4640.0000 -176.65863 -170.00116 6.65748 2.42593 -170.41441 732.01276
4645.0000 -175.59067 -170.12496 5.46571 2.40429 -170.78899 731.10586
4650.0000 -176.59037 -169.43399 7.15638 2.47399 -169.58265 754.68315
4655.0000 -175.64957 -168.86266 6.78691 2.52413 -168.71490 800.92585
4660.0000 -176.71533 -169.00919 7.70614 2.53866 -168.46346 799.53497
4665.0000 -175.33608 -168.75025 6.58583 2.52769 -168.65325 803.88358
4670.0000 -176.58463 -170.04160 6.54303 2.45632 -169.88843 720.19701
4675.0000 -175.96591 -168.58376 7.38215 2.52057 -168.77656 774.52358
4680.0000 -176.09098 -169.69469 6.39629 2.48344 -169.41919 743.19324
4685.0000 -176.46894 -169.16696 7.30198 2.47232 -169.61163 733.31124
4690.0000 -177.38349 -169.57355 7.80994 2.46369 -169.76087 742.45576
4695.0000 -176.31498 -169.90154 6.41344 2.44761 -170.03924 734.31170
4700.0000 -175.19509 -168.38184 6.81325 2.47867 -169.50162 753.84788
4705.0000 -175.36267 -168.51490 6.84777 2.57308 -167.86766 796.17908
4710.0000 -174.72465 -166.52942 8.19522 2.62561 -166.95864 871.52645
4715.0000 -174.54660 -168.37138 6.17521 2.58724 -167.62270 829.75356
4720.0000 -175.33107 -167.96107 7.37000 2.56118 -168.07363 791.51764
4725.0000 -175.61210 -168.77102 6.84108 2.54413 -168.36880 793.50346
4730.0000 -175.41227 -167.55313 7.85914 2.55441 -168.19075 785.36479
4735.0000 -176.08775 -167.94538 8.14237 2.58042 -167.74068 832.21604
4740.0000 -175.56156 -168.12152 7.44004 2.61751 -167.09869 845.03744
4745.0000 -177.73767 -170.12032 7.61735 2.53839 -168.46813 770.30512
4750.0000 -177.19890 -169.41847 7.78043 2.46699 -169.70384 769.40083
FREEZING PROCESS: loop number 20 T-loop= 753.00000000000000
main_MD> interactions number 20 at Temperature= 753.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.38475 -1.80585 1.73458
force_rgl> df(natom) 3.79894 -0.24565 -3.49804
4755.0000 -176.52028 -170.36636 6.15392 2.43347 -170.28391 745.29392
4760.0000 -177.63173 -168.09978 9.53195 2.51848 -168.81272 783.40641
4765.0000 -177.10473 -169.48658 7.61814 2.52924 -168.62648 796.12599
4770.0000 -175.65498 -168.92767 6.72731 2.49169 -169.27629 757.59235
4775.0000 -175.11971 -167.31346 7.80625 2.56702 -167.97261 805.04948
4780.0000 -175.33437 -167.68520 7.64917 2.60067 -167.39018 840.44327
4785.0000 -175.49847 -167.50584 7.99263 2.57025 -167.91678 833.90696
4790.0000 -174.79533 -166.93649 7.85884 2.59113 -167.55529 850.00036
4795.0000 -176.62466 -168.82174 7.80291 2.53491 -168.52833 780.38325
4800.0000 -175.85821 -169.19735 6.66085 2.52795 -168.64885 786.20765
4805.0000 -177.63667 -170.81056 6.82611 2.46419 -169.75231 740.21042
4810.0000 -176.36200 -170.22051 6.14148 2.42268 -170.47073 722.88128
4815.0000 -177.57432 -171.37792 6.19640 2.44354 -170.10968 739.75482
4820.0000 -177.41213 -170.19316 7.21897 2.41588 -170.58836 702.55445
4825.0000 -177.29591 -169.40088 7.89502 2.44808 -170.03106 733.06630
4830.0000 -176.74908 -169.22547 7.52361 2.48521 -169.38853 771.03748
4835.0000 -175.79497 -170.17489 5.62008 2.45726 -169.87222 721.28785
4840.0000 -176.35815 -169.12656 7.23159 2.47148 -169.62606 735.25859
4845.0000 -176.15410 -168.73769 7.41642 2.50160 -169.10481 767.90865
4850.0000 -176.11464 -168.53778 7.57686 2.53462 -168.53330 744.90049
4855.0000 -177.77200 -170.66049 7.11151 2.45515 -169.90876 753.39720
4860.0000 -177.64900 -170.42230 7.22670 2.39888 -170.88254 706.66256
4865.0000 -177.20999 -170.39324 6.81675 2.44107 -170.15235 725.69087
4870.0000 -177.00308 -169.73912 7.26396 2.44569 -170.07246 744.04966
4875.0000 -176.97251 -171.22316 5.74935 2.41176 -170.65975 709.63413
4880.0000 -176.45401 -169.24800 7.20601 2.41547 -170.59554 722.86387
4885.0000 -175.70561 -167.74685 7.95877 2.54856 -168.29204 780.10283
4890.0000 -177.03942 -170.93908 6.10034 2.45269 -169.95134 746.84083
4895.0000 -177.97580 -171.08128 6.89452 2.40932 -170.70198 719.42750
4900.0000 -175.03081 -168.34491 6.68591 2.47933 -169.49028 752.72184
4905.0000 -176.80489 -169.89068 6.91420 2.47971 -169.48372 731.97446
4910.0000 -177.55034 -170.03076 7.51958 2.40106 -170.84481 708.41780
4915.0000 -177.17901 -171.12390 6.05511 2.42383 -170.45082 727.11977
4920.0000 -177.16459 -170.16633 6.99826 2.42169 -170.48778 702.64172
4925.0000 -177.57986 -170.33789 7.24197 2.43643 -170.23279 737.69676
4930.0000 -176.16008 -170.22207 5.93800 2.37895 -171.22756 686.39411
4935.0000 -177.81145 -171.00847 6.80298 2.43477 -170.26143 721.92434
4940.0000 -176.02589 -169.60004 6.42585 2.43309 -170.29053 725.24228
4945.0000 -176.19461 -168.90526 7.28934 2.46979 -169.65542 762.31903
4950.0000 -176.41886 -170.14220 6.27665 2.49624 -169.19753 788.22012
4955.0000 -177.67806 -170.51636 7.16171 2.41865 -170.54039 747.61384
4960.0000 -176.32045 -168.90919 7.41126 2.45505 -169.91046 742.19349
4965.0000 -176.76262 -169.68350 7.07911 2.48143 -169.45386 764.07786
4970.0000 -176.87734 -169.79655 7.08079 2.46985 -169.65434 757.87577
4975.0000 -176.68154 -169.81462 6.86692 2.45155 -169.97107 768.75135
4980.0000 -175.30940 -169.22284 6.08656 2.46863 -169.67550 758.13938
4985.0000 -176.17624 -169.12198 7.05426 2.49430 -169.23117 748.37162
4990.0000 -176.82089 -169.44206 7.37882 2.47944 -169.48834 737.78327
4995.0000 -176.49035 -170.13930 6.35105 2.46158 -169.79744 735.62085
5000.0000 -177.08116 -170.47552 6.60564 2.47965 -169.48478 761.47061
FREEZING PROCESS: loop number 21 T-loop= 728.00000000000000
main_MD> interactions number 21 at Temperature= 728.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.51137 -0.95652 1.50537
force_rgl> df(natom) -1.51207 -1.26878 1.84084
5005.0000 -178.09143 -170.00069 8.09074 2.42818 -170.37551 747.54544
5010.0000 -177.79141 -170.98326 6.80815 2.43448 -170.26640 723.67615
5015.0000 -177.61995 -170.48093 7.13902 2.40437 -170.78760 709.03024
5020.0000 -176.72131 -169.58199 7.13932 2.41642 -170.57911 707.90345
5025.0000 -176.86272 -170.08595 6.77677 2.42005 -170.51621 715.46264
5030.0000 -177.82535 -170.19253 7.63282 2.45516 -169.90851 721.16079
5035.0000 -176.48681 -168.95859 7.52823 2.49445 -169.22853 794.06930
5040.0000 -177.02784 -169.06560 7.96224 2.45534 -169.90545 741.01365
5045.0000 -176.78666 -169.00725 7.77941 2.49862 -169.15634 785.38584
5050.0000 -177.44300 -170.68014 6.76286 2.44225 -170.13194 756.84316
5055.0000 -176.88452 -168.32478 8.55974 2.45137 -169.97417 743.06864
5060.0000 -177.17791 -169.86848 7.30943 2.50807 -168.99281 796.39982
5065.0000 -177.34879 -169.93734 7.41145 2.45719 -169.87340 741.58360
5070.0000 -176.54855 -168.78583 7.76272 2.49942 -169.14248 780.26616
5075.0000 -175.48155 -168.21120 7.27035 2.52881 -168.63390 797.47890
5080.0000 -176.64387 -170.49087 6.15300 2.50050 -169.12381 785.52761
5085.0000 -178.10383 -171.88002 6.22381 2.40278 -170.81511 720.85749
5090.0000 -179.50849 -172.11271 7.39578 2.32688 -172.12862 706.33360
5095.0000 -177.33637 -172.00375 5.33262 2.32248 -172.20482 681.56562
5100.0000 -177.28287 -170.57133 6.71154 2.39777 -170.90186 713.62867
5105.0000 -175.84844 -169.59278 6.25566 2.44863 -170.02166 744.35443
5110.0000 -177.24086 -170.85120 6.38966 2.44493 -170.08563 753.38134
5115.0000 -177.72964 -171.04899 6.68065 2.39584 -170.93517 718.81667
5120.0000 -177.91332 -170.29556 7.61776 2.43875 -170.19258 727.19203
5125.0000 -176.80583 -169.25258 7.55325 2.44697 -170.05022 772.62719
5130.0000 -177.19621 -170.84728 6.34893 2.40916 -170.70473 741.67466
5135.0000 -176.78498 -170.44739 6.33760 2.40930 -170.70231 715.86289
5140.0000 -176.10658 -170.44189 5.66469 2.40803 -170.72428 721.01512
5145.0000 -177.28117 -169.09378 8.18739 2.49971 -169.13756 791.31742
5150.0000 -175.79233 -170.44188 5.35045 2.49640 -169.19475 772.31183
5155.0000 -176.66739 -170.03669 6.63070 2.41325 -170.63387 671.93546
5160.0000 -176.66345 -169.92296 6.74048 2.40753 -170.73295 725.23872
5165.0000 -177.83987 -170.68640 7.15347 2.47610 -169.54611 741.24128
5170.0000 -178.05650 -171.86484 6.19166 2.38609 -171.10391 708.27424
5175.0000 -178.00519 -172.09611 5.90908 2.34795 -171.76396 678.02078
5180.0000 -178.18654 -171.96139 6.22514 2.31390 -172.35328 648.33207
5185.0000 -179.36567 -172.72461 6.64105 2.30467 -172.51316 650.70798
5190.0000 -177.59553 -170.59042 7.00512 2.34645 -171.79009 693.09791
5195.0000 -176.19379 -170.46773 5.72606 2.42379 -170.45145 725.02075
5200.0000 -177.01058 -170.14178 6.86880 2.41320 -170.63475 713.75200
5205.0000 -177.58102 -171.22720 6.35382 2.42020 -170.51359 717.98934
5210.0000 -177.07498 -170.50625 6.56873 2.36408 -171.48481 678.74753
5215.0000 -177.92261 -171.44705 6.47555 2.39226 -170.99721 720.34372
5220.0000 -177.42533 -172.07857 5.34676 2.35795 -171.59092 692.77163
5225.0000 -178.65293 -172.35709 6.29584 2.36189 -171.52283 693.14116
5230.0000 -178.49506 -172.53193 5.96313 2.35150 -171.70255 672.62437
5235.0000 -178.06282 -171.31254 6.75028 2.33265 -172.02882 670.56461
5240.0000 -176.93959 -172.20031 4.73928 2.35683 -171.61029 690.55262
5245.0000 -178.70770 -171.76195 6.94575 2.34030 -171.89648 700.18537
5250.0000 -177.68888 -172.06270 5.62617 2.36382 -171.48943 702.56751
FREEZING PROCESS: loop number 22 T-loop= 703.00000000000000
main_MD> interactions number 22 at Temperature= 703.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.18987 1.20522 -1.33995
force_rgl> df(natom) 0.35905 -2.93794 -0.72175
5255.0000 -177.56887 -170.90989 6.65898 2.40934 -170.70150 739.85716
5260.0000 -176.17072 -170.04597 6.12476 2.44781 -170.03581 745.67567
5265.0000 -176.29969 -170.06316 6.23653 2.42885 -170.36397 737.05301
5270.0000 -176.29659 -169.67867 6.61792 2.46183 -169.79305 785.79837
5275.0000 -177.32371 -169.53368 7.79003 2.46228 -169.78536 756.88640
5280.0000 -178.31090 -171.43418 6.87672 2.41418 -170.61779 717.14327
5285.0000 -178.62642 -170.84021 7.78620 2.35616 -171.62193 703.08332
5290.0000 -179.31329 -172.30262 7.01067 2.34313 -171.84745 684.09548
5295.0000 -176.63417 -171.45975 5.17442 2.31910 -172.26335 661.32596
5300.0000 -177.15083 -170.39609 6.75474 2.39904 -170.87991 706.15634
5305.0000 -178.29832 -172.20345 6.09487 2.38672 -171.09298 701.13729
5310.0000 -177.60464 -171.21050 6.39415 2.36623 -171.44771 696.15890
5315.0000 -177.63569 -171.29905 6.33664 2.36519 -171.46568 678.44770
5320.0000 -177.10464 -170.12950 6.97514 2.42905 -170.36046 725.89129
5325.0000 -179.07918 -172.32709 6.75209 2.38298 -171.15779 708.94533
5330.0000 -178.40940 -171.77742 6.63198 2.36565 -171.45766 684.74635
5335.0000 -177.33391 -170.98681 6.34710 2.40917 -170.70446 710.27093
5340.0000 -177.49891 -171.88315 5.61576 2.34374 -171.83692 681.33814
5345.0000 -178.06092 -171.21013 6.85079 2.36271 -171.50861 714.84406
5350.0000 -177.71278 -171.33144 6.38134 2.34783 -171.76607 701.06561
5355.0000 -178.74713 -172.63547 6.11166 2.35463 -171.64838 691.74823
5360.0000 -177.87915 -172.39982 5.47932 2.30880 -172.44169 639.23662
5365.0000 -178.49178 -173.03301 5.45877 2.33076 -172.06156 645.46262
5370.0000 -178.94376 -172.32096 6.62280 2.32239 -172.20640 652.51272
5375.0000 -177.60800 -171.17332 6.43467 2.32668 -172.13216 672.01631
5380.0000 -178.45216 -171.59204 6.86012 2.34200 -171.86710 673.66157
5385.0000 -178.28850 -171.62027 6.66823 2.35912 -171.57068 703.86437
5390.0000 -176.59310 -170.25544 6.33767 2.42057 -170.50718 730.48786
5395.0000 -177.44086 -170.57973 6.86112 2.44048 -170.16265 744.36044
5400.0000 -176.71820 -170.04730 6.67090 2.40474 -170.78123 734.45545
5405.0000 -178.66546 -172.77838 5.88708 2.41798 -170.55205 711.45367
5410.0000 -177.73803 -171.11299 6.62504 2.34788 -171.76532 683.77933
5415.0000 -177.99646 -170.22151 7.77494 2.42294 -170.46618 749.26282
5420.0000 -179.22645 -172.42456 6.80189 2.40158 -170.83586 694.03526
5425.0000 -178.19122 -171.52693 6.66430 2.33659 -171.96072 691.23807
5430.0000 -179.77562 -173.46631 6.30931 2.30447 -172.51653 659.67796
5435.0000 -177.38775 -171.44333 5.94442 2.32788 -172.11136 673.49660
5440.0000 -176.97483 -170.89480 6.08004 2.41148 -170.66459 696.48088
5445.0000 -176.03044 -169.37698 6.65346 2.41721 -170.56531 720.70153
5450.0000 -178.00318 -171.06007 6.94311 2.37230 -171.34261 698.04269
5455.0000 -177.12988 -171.10651 6.02338 2.37206 -171.34682 713.73631
5460.0000 -179.33722 -173.09765 6.23957 2.33417 -172.00255 671.17280
5465.0000 -178.07776 -171.39659 6.68117 2.31229 -172.38124 643.96367
5470.0000 -177.23752 -170.47531 6.76221 2.39822 -170.89410 720.01408
5475.0000 -178.37683 -172.26815 6.10868 2.35122 -171.70743 698.63012
5480.0000 -178.72676 -173.09502 5.63174 2.32551 -172.15247 688.47759
5485.0000 -177.37453 -169.43449 7.94004 2.34671 -171.78556 690.99796
5490.0000 -177.64417 -171.32873 6.31544 2.42192 -170.48393 713.53155
5495.0000 -178.60660 -171.85618 6.75041 2.33035 -172.06873 678.88682
5500.0000 -178.97648 -171.64840 7.32807 2.36182 -171.52401 713.33299
FREEZING PROCESS: loop number 23 T-loop= 678.00000000000000
main_MD> interactions number 23 at Temperature= 678.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.13547 -1.05351 -2.02491
force_rgl> df(natom) -0.72783 1.39077 1.51728
5505.0000 -177.01536 -170.70646 6.30890 2.38224 -171.17053 724.33614
5510.0000 -177.51180 -170.49481 7.01699 2.45446 -169.92066 762.99926
5515.0000 -177.56022 -170.97541 6.58481 2.38608 -171.10407 706.46140
5520.0000 -177.55356 -170.39557 7.15799 2.44678 -170.05356 729.62718
5525.0000 -178.67831 -171.84672 6.83159 2.40387 -170.79618 734.39031
5530.0000 -176.62862 -170.16163 6.46699 2.40853 -170.71557 739.77864
5535.0000 -177.79646 -171.89595 5.90051 2.37452 -171.30417 692.64154
5540.0000 -178.31347 -171.88042 6.43305 2.29784 -172.63122 620.39369
5545.0000 -177.60754 -171.63719 5.97035 2.33022 -172.07094 666.80812
5550.0000 -177.40108 -171.42489 5.97618 2.34888 -171.74787 666.41760
5555.0000 -177.10734 -172.11508 4.99227 2.38419 -171.13688 697.61862
5560.0000 -178.34637 -172.56511 5.78126 2.32640 -172.13704 656.04140
5565.0000 -179.22909 -172.77758 6.45151 2.25344 -173.39968 607.73609
5570.0000 -177.95171 -170.88078 7.07093 2.35932 -171.56734 693.70010
5575.0000 -178.80266 -172.20348 6.59918 2.39932 -170.87493 718.02777
5580.0000 -178.36498 -171.40014 6.96484 2.34826 -171.75865 678.75260
5585.0000 -179.67160 -172.77981 6.89179 2.29356 -172.70534 633.88296
5590.0000 -178.87816 -171.83604 7.04213 2.25871 -173.30844 619.31285
5595.0000 -177.00428 -169.73109 7.27319 2.42106 -170.49879 728.91347
5600.0000 -176.79100 -170.61221 6.17879 2.45902 -169.84168 741.12401
5605.0000 -177.38274 -171.50227 5.88047 2.39270 -170.98964 713.22388
5610.0000 -177.65331 -171.30002 6.35329 2.36803 -171.41651 681.82700
5615.0000 -177.90113 -171.49150 6.40963 2.36070 -171.54339 688.18748
5620.0000 -178.42952 -172.12494 6.30458 2.31780 -172.28589 665.20971
5625.0000 -178.45015 -171.70464 6.74551 2.38730 -171.08296 700.74156
5630.0000 -178.44705 -173.14477 5.30228 2.32515 -172.15870 676.33402
5635.0000 -178.42639 -173.08718 5.33920 2.31383 -172.35462 666.63178
5640.0000 -179.14837 -173.02711 6.12126 2.30769 -172.46077 631.42592
5645.0000 -179.19688 -173.18972 6.00716 2.27059 -173.10288 633.37407
5650.0000 -178.90960 -173.05953 5.85006 2.26146 -173.26093 609.80161
5655.0000 -178.05101 -171.46664 6.58437 2.32485 -172.16377 677.40155
5660.0000 -178.57950 -172.21621 6.36329 2.35272 -171.68154 680.13316
5665.0000 -177.88007 -170.91346 6.96662 2.40587 -170.76162 699.59214
5670.0000 -177.63775 -171.05286 6.58489 2.38040 -171.20243 687.90202
5675.0000 -176.81705 -170.84049 5.97657 2.41367 -170.62667 747.03415
5680.0000 -178.63090 -170.83736 7.79354 2.39209 -171.00010 723.73424
5685.0000 -178.51472 -172.24662 6.26810 2.36850 -171.40834 726.06345
5690.0000 -178.99073 -172.89931 6.09142 2.29987 -172.59608 650.07768
5695.0000 -177.94919 -171.46277 6.48642 2.30915 -172.43552 661.30954
5700.0000 -178.23159 -171.67240 6.55919 2.38270 -171.16258 718.06179
5705.0000 -177.75848 -171.77844 5.98004 2.33092 -172.05883 645.60822
5710.0000 -177.95512 -170.71283 7.24229 2.36698 -171.43476 696.06624
5715.0000 -178.16743 -172.38086 5.78657 2.35566 -171.63057 699.14078
5720.0000 -178.57902 -172.57637 6.00265 2.30434 -172.51876 642.24121
5725.0000 -179.09037 -173.84029 5.25007 2.31395 -172.35242 656.21822
5730.0000 -178.42531 -172.66574 5.75957 2.27820 -172.97119 652.56372
5735.0000 -178.47298 -172.23995 6.23303 2.30253 -172.55013 650.09661
5740.0000 -178.29501 -171.98615 6.30886 2.37319 -171.32718 686.48349
5745.0000 -177.21092 -172.39674 4.81418 2.33424 -172.00137 670.94720
5750.0000 -178.93108 -171.88423 7.04685 2.30952 -172.42922 666.66873
FREEZING PROCESS: loop number 24 T-loop= 653.00000000000000
main_MD> interactions number 24 at Temperature= 653.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.82586 -2.16278 0.28420
force_rgl> df(natom) -1.30038 0.66231 -1.22249
5755.0000 -177.91055 -170.63191 7.27864 2.35603 -171.62426 691.68465
5760.0000 -177.59315 -170.95383 6.63932 2.37641 -171.27153 699.69287
5765.0000 -178.38692 -172.52491 5.86201 2.36051 -171.54659 660.28936
5770.0000 -178.20734 -171.56867 6.63867 2.30525 -172.50301 634.93252
5775.0000 -178.92805 -172.13067 6.79739 2.30420 -172.52116 633.71620
5780.0000 -178.59129 -172.72660 5.86469 2.31923 -172.26112 669.92582
5785.0000 -178.02524 -172.18375 5.84149 2.29654 -172.65383 637.00864
5790.0000 -180.11017 -174.37059 5.73957 2.22379 -173.91280 596.91930
5795.0000 -178.79909 -173.58501 5.21408 2.22157 -173.95135 602.00863
5800.0000 -178.82106 -172.43347 6.38758 2.28356 -172.87849 640.51861
5805.0000 -179.20414 -172.41198 6.79216 2.32281 -172.19917 687.29561
5810.0000 -177.74863 -172.14798 5.60064 2.34549 -171.80661 679.07748
5815.0000 -178.22907 -170.89596 7.33312 2.36520 -171.46558 708.89205
5820.0000 -178.08035 -172.42322 5.65713 2.35536 -171.63574 689.80062
5825.0000 -177.81141 -172.46805 5.34336 2.32490 -172.16289 665.37766
5830.0000 -178.51118 -172.89459 5.61658 2.27741 -172.98480 606.34311
5835.0000 -177.45021 -171.29551 6.15471 2.31918 -172.26189 639.00237
5840.0000 -178.79899 -172.41666 6.38233 2.34251 -171.85817 657.57624
5845.0000 -177.63158 -171.79191 5.83967 2.31001 -172.42068 616.59938
5850.0000 -177.43790 -171.13223 6.30567 2.34334 -171.84385 683.98396
5855.0000 -179.71327 -174.44270 5.27057 2.34027 -171.89694 690.63780
5860.0000 -178.48142 -173.48255 4.99887 2.24454 -173.55381 599.69335
5865.0000 -178.57615 -172.78560 5.79055 2.27137 -173.08938 635.10915
5870.0000 -178.25276 -172.88775 5.36502 2.25367 -173.39569 616.82991
5875.0000 -179.17583 -172.55535 6.62048 2.31348 -172.36059 678.66434
5880.0000 -177.70588 -171.76089 5.94499 2.31509 -172.33282 653.04467
5885.0000 -178.32576 -172.17846 6.14729 2.33233 -172.03432 649.25149
5890.0000 -177.19545 -172.28193 4.91351 2.34496 -171.81575 673.23318
5895.0000 -178.08775 -172.45384 5.63391 2.32379 -172.18218 655.42072
5900.0000 -178.31824 -172.51489 5.80334 2.30820 -172.45205 658.59346
5905.0000 -177.94343 -171.07320 6.87022 2.35204 -171.69333 690.20012
5910.0000 -178.10750 -171.45523 6.65227 2.38838 -171.06427 697.51337
5915.0000 -178.79259 -172.28791 6.50468 2.31525 -172.32995 647.93580
5920.0000 -176.60700 -169.94899 6.65801 2.37774 -171.24840 716.30291
5925.0000 -178.31903 -171.98872 6.33031 2.38992 -171.03772 685.70960
5930.0000 -179.15566 -172.30625 6.84941 2.30562 -172.49668 642.96624
5935.0000 -178.32016 -172.40320 5.91696 2.30776 -172.45959 655.15006
5940.0000 -178.85069 -171.98291 6.86778 2.33554 -171.97887 694.40360
5945.0000 -178.33579 -171.23377 7.10202 2.33582 -171.97401 682.20616
5950.0000 -178.16722 -172.06317 6.10406 2.38131 -171.18671 690.74925
5955.0000 -178.27967 -172.68103 5.59864 2.29518 -172.67735 629.01093
5960.0000 -178.63095 -173.23266 5.39829 2.28243 -172.89796 608.92837
5965.0000 -179.56293 -174.05683 5.50610 2.21592 -174.04916 577.31491
5970.0000 -178.26491 -172.78418 5.48073 2.24042 -173.62501 615.77557
5975.0000 -178.33503 -171.63342 6.70160 2.32471 -172.16630 659.77900
5980.0000 -178.09883 -172.35144 5.74740 2.35003 -171.72802 683.59805
5985.0000 -180.22566 -173.63685 6.58881 2.25874 -173.30805 634.42159
5990.0000 -178.97733 -173.50746 5.46987 2.26554 -173.19038 620.15789
5995.0000 -179.27053 -173.45130 5.81924 2.24533 -173.54015 608.73137
6000.0000 -179.21745 -173.24286 5.97459 2.27695 -172.99291 630.35490
FREEZING PROCESS: loop number 25 T-loop= 628.00000000000000
main_MD> interactions number 25 at Temperature= 628.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.07026 0.85047 -2.27102
force_rgl> df(natom) -1.20411 2.27336 2.32179
6005.0000 -180.08489 -173.83021 6.25468 2.25156 -173.43220 622.24157
6010.0000 -179.41316 -173.04350 6.36966 2.23640 -173.69470 618.94638
6015.0000 -178.84413 -173.91039 4.93374 2.27273 -173.06592 653.18561
6020.0000 -178.70957 -172.92344 5.78613 2.27669 -172.99737 637.71141
6025.0000 -178.57830 -172.55226 6.02604 2.27427 -173.03915 636.91751
6030.0000 -178.23346 -172.37670 5.85677 2.30202 -172.55901 650.69798
6035.0000 -178.99034 -172.30088 6.68946 2.32342 -172.18858 666.09299
6040.0000 -179.79186 -173.62961 6.16224 2.26996 -173.11373 616.12229
6045.0000 -180.53198 -175.51428 5.01771 2.19641 -174.38674 600.33265
6050.0000 -180.64707 -175.43571 5.21136 2.12289 -175.65923 528.60450
6055.0000 -179.23343 -172.73755 6.49588 2.22181 -173.94718 590.87388
6060.0000 -178.40459 -172.44519 5.95940 2.28625 -172.83188 659.75831
6065.0000 -178.30277 -172.67299 5.62978 2.31865 -172.27108 656.39236
6070.0000 -179.33307 -173.04443 6.28864 2.31111 -172.40156 646.73637
6075.0000 -178.66556 -172.49622 6.16933 2.30268 -172.54752 639.42546
6080.0000 -178.80853 -173.94971 4.85882 2.26744 -173.15748 638.25488
6085.0000 -178.84763 -172.69802 6.14961 2.27188 -173.08056 629.88979
6090.0000 -179.20703 -173.17231 6.03471 2.26888 -173.13259 611.94012
6095.0000 -178.68081 -172.55482 6.12599 2.28423 -172.86684 643.23026
6100.0000 -178.49386 -173.21756 5.27630 2.23650 -173.69297 604.23673
6105.0000 -177.60432 -172.27139 5.33293 2.32279 -172.19941 651.06453
6110.0000 -178.45974 -172.75310 5.70663 2.29030 -172.76181 636.99048
6115.0000 -177.47153 -171.70883 5.76269 2.29037 -172.76057 621.55605
6120.0000 -177.71432 -171.56487 6.14945 2.37562 -171.28512 713.88963
6125.0000 -178.23093 -172.52260 5.70833 2.30107 -172.57540 645.82070
6130.0000 -178.24722 -173.00147 5.24575 2.30451 -172.51585 652.34860
6135.0000 -179.42982 -173.36329 6.06654 2.29091 -172.75116 637.41626
6140.0000 -179.36422 -172.91758 6.44665 2.27913 -172.95517 649.14202
6145.0000 -179.54569 -172.96086 6.58483 2.28074 -172.92733 623.29024
6150.0000 -177.98546 -171.74840 6.23705 2.33180 -172.04362 661.85742
6155.0000 -178.79953 -172.87281 5.92672 2.30141 -172.56942 647.36360
6160.0000 -179.03032 -172.48440 6.54592 2.29201 -172.73216 633.29325
6165.0000 -178.20502 -172.55051 5.65451 2.29963 -172.60039 646.42425
6170.0000 -180.65446 -175.63048 5.02398 2.20848 -174.17783 592.63435
6175.0000 -178.62164 -172.90169 5.71994 2.23194 -173.77176 588.65438
6180.0000 -178.37560 -171.86157 6.51403 2.32994 -172.07577 667.99000
6185.0000 -178.62042 -172.38392 6.23650 2.27439 -173.03719 620.48486
6190.0000 -178.51471 -172.67936 5.83534 2.28406 -172.86976 627.75253
6195.0000 -178.46002 -173.23952 5.22050 2.28884 -172.78707 608.28781
6200.0000 -178.09011 -172.61166 5.47845 2.28872 -172.78911 649.17604
6205.0000 -179.56301 -173.58390 5.97912 2.30530 -172.50217 675.97575
6210.0000 -178.67048 -173.09510 5.57537 2.26547 -173.19144 631.67093
6215.0000 -179.13412 -172.86373 6.27039 2.26440 -173.20996 616.19435
6220.0000 -178.66150 -172.52139 6.14011 2.29499 -172.68058 642.55658
6225.0000 -179.22803 -172.57885 6.64918 2.29132 -172.74417 657.40439
6230.0000 -180.08162 -172.20873 7.87289 2.36156 -171.52852 702.09305
6235.0000 -179.50214 -173.25059 6.25156 2.30821 -172.45187 661.15164
6240.0000 -179.30600 -171.99801 7.30799 2.30559 -172.49710 670.41685
6245.0000 -178.14911 -171.60602 6.54309 2.28381 -172.87406 667.00229
6250.0000 -179.87915 -174.20938 5.66976 2.27918 -172.95419 681.98627
FREEZING PROCESS: loop number 26 T-loop= 603.00000000000000
main_MD> interactions number 26 at Temperature= 603.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.45641 -0.38606 -1.94415
force_rgl> df(natom) 1.58730 -1.01253 4.18714
6255.0000 -180.82384 -175.61129 5.21255 2.13048 -175.52777 572.56338
6260.0000 -179.48011 -173.67658 5.80353 2.18337 -174.61244 614.31729
6265.0000 -179.47669 -173.90613 5.57056 2.22494 -173.89291 607.81446
6270.0000 -179.49925 -173.44500 6.05425 2.24539 -173.53901 612.65837
6275.0000 -179.41189 -174.47559 4.93629 2.27494 -173.02762 652.09716
6280.0000 -179.94846 -174.45144 5.49702 2.21144 -174.12664 611.37366
6285.0000 -180.04863 -174.19215 5.85648 2.22366 -173.91518 618.31049
6290.0000 -179.20585 -172.73868 6.46718 2.24535 -173.53969 638.79691
6295.0000 -179.80306 -173.16820 6.63486 2.22834 -173.83405 611.51871
6300.0000 -179.42520 -173.76320 5.66200 2.28094 -172.92373 632.19890
6305.0000 -179.74495 -174.68225 5.06270 2.23754 -173.67497 605.92592
6310.0000 -179.45252 -174.32108 5.13145 2.20319 -174.26940 575.23483
6315.0000 -179.35010 -173.60640 5.74370 2.21972 -173.98326 612.12757
6320.0000 -179.27244 -173.31777 5.95467 2.30124 -172.57251 657.13050
6325.0000 -178.53086 -172.61571 5.91516 2.23657 -173.69169 588.77392
6330.0000 -179.40815 -174.13174 5.27641 2.27410 -173.04216 621.21202
6335.0000 -180.26467 -174.33112 5.93355 2.18308 -174.61743 552.47213
6340.0000 -179.44548 -174.93724 4.50824 2.21551 -174.05612 591.12643
6345.0000 -178.94621 -174.41338 4.53283 2.19968 -174.33010 592.28749
6350.0000 -179.44456 -173.94249 5.50207 2.21253 -174.10778 602.57928
6355.0000 -179.84405 -174.46910 5.37495 2.19898 -174.34229 602.54536
6360.0000 -180.40167 -175.00525 5.39642 2.18605 -174.56607 576.32681
6365.0000 -180.11740 -174.62313 5.49426 2.16801 -174.87819 569.82605
6370.0000 -179.98117 -174.96061 5.02056 2.17679 -174.72626 572.37847
6375.0000 -180.35261 -174.08488 6.26773 2.20705 -174.20258 607.52307
6380.0000 -179.50168 -173.48352 6.01815 2.24176 -173.60184 607.77897
6385.0000 -179.49117 -173.54120 5.94997 2.28340 -172.88115 636.86379
6390.0000 -179.27290 -173.86157 5.41133 2.21086 -174.13673 598.17302
6395.0000 -179.53147 -174.18166 5.34981 2.22077 -173.96521 590.53602
6400.0000 -179.92726 -173.78047 6.14680 2.23314 -173.75099 598.99279
6405.0000 -179.24411 -173.66660 5.57751 2.25503 -173.37221 625.80285
6410.0000 -179.49531 -173.71925 5.77606 2.23071 -173.79303 576.27135
6415.0000 -179.27959 -174.74432 4.53527 2.19445 -174.42066 566.80162
6420.0000 -178.91325 -173.07690 5.83635 2.24603 -173.52792 600.26395
6425.0000 -178.82513 -173.06755 5.75758 2.28947 -172.77610 628.68693
6430.0000 -178.89295 -173.86425 5.02870 2.28661 -172.82568 627.37327
6435.0000 -179.00498 -173.39017 5.61481 2.25184 -173.42735 619.13102
6440.0000 -178.51899 -173.45794 5.06106 2.24044 -173.62478 614.41224
6445.0000 -179.80403 -174.36307 5.44096 2.23273 -173.75824 613.02827
6450.0000 -178.64771 -173.17374 5.47396 2.20114 -174.30491 583.13315
6455.0000 -179.25312 -173.64559 5.60754 2.28512 -172.85146 642.73503
6460.0000 -179.84303 -174.34612 5.49691 2.24325 -173.57605 611.63321
6465.0000 -179.22313 -173.27742 5.94571 2.23201 -173.77053 590.81205
6470.0000 -179.12060 -173.72847 5.39213 2.26828 -173.14289 604.80917
6475.0000 -179.00185 -172.34885 6.65300 2.29683 -172.64872 637.03065
6480.0000 -178.29117 -172.76943 5.52174 2.30270 -172.54714 649.24750
6485.0000 -179.03397 -172.81333 6.22064 2.30110 -172.57481 638.52165
6490.0000 -178.50699 -172.71272 5.79428 2.29223 -172.72831 648.41258
6495.0000 -178.69788 -173.68195 5.01593 2.27848 -172.96641 617.25552
6500.0000 -179.72561 -174.86363 4.86198 2.20740 -174.19646 539.82345
FREEZING PROCESS: loop number 27 T-loop= 578.00000000000000
main_MD> interactions number 27 at Temperature= 578.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.65730 3.32996 1.94290
force_rgl> df(natom) 4.67860 3.16725 -1.48330
6505.0000 -179.85429 -175.29601 4.55828 2.16840 -174.87143 519.94305
6510.0000 -179.25397 -174.59669 4.65728 2.16092 -175.00100 532.60072
6515.0000 -180.21741 -174.17286 6.04455 2.19302 -174.44544 563.60454
6520.0000 -179.24284 -173.94227 5.30057 2.20422 -174.25164 576.43374
6525.0000 -179.62552 -174.37596 5.24956 2.21698 -174.03066 599.96154
6530.0000 -179.31650 -173.74532 5.57118 2.19335 -174.43962 596.51291
6535.0000 -179.87058 -174.65418 5.21640 2.22913 -173.82053 594.23585
6540.0000 -179.93084 -174.28495 5.64590 2.20609 -174.21919 605.99845
6545.0000 -179.97078 -174.72000 5.25078 2.15313 -175.13577 570.48193
6550.0000 -180.01848 -174.97646 5.04202 2.18693 -174.55085 568.20078
6555.0000 -180.53153 -175.82518 4.70635 2.14745 -175.23412 554.57557
6560.0000 -179.92270 -174.70001 5.22268 2.15920 -175.03074 559.96639
6565.0000 -179.91111 -174.96315 4.94796 2.13991 -175.36463 559.06477
6570.0000 -180.59427 -175.63614 4.95813 2.13800 -175.39765 551.20985
6575.0000 -180.08241 -174.24251 5.83990 2.16383 -174.95063 552.75306
6580.0000 -180.40331 -175.39481 5.00850 2.15123 -175.16869 551.30947
6585.0000 -181.45029 -176.68717 4.76312 2.12530 -175.61750 540.73052
6590.0000 -180.68559 -175.86596 4.81963 2.08754 -176.27087 509.58749
6595.0000 -180.50183 -175.36305 5.13879 2.11470 -175.80098 514.95700
6600.0000 -180.67027 -176.09989 4.57038 2.14093 -175.34695 552.84016
6605.0000 -180.80329 -176.31994 4.48335 2.07283 -176.52557 514.30563
6610.0000 -181.69327 -177.03127 4.66200 2.08857 -176.25310 539.76803
6615.0000 -181.27919 -177.05816 4.22102 2.05990 -176.74933 511.71889
6620.0000 -180.41364 -175.43853 4.97511 2.07024 -176.57033 513.49236
6625.0000 -181.47674 -176.68291 4.79383 2.12442 -175.63275 569.88086
6630.0000 -179.09430 -174.53575 4.55855 2.13947 -175.37220 571.17789
6635.0000 -181.03067 -174.97322 6.05745 2.15496 -175.10407 574.11768
6640.0000 -180.30428 -175.21338 5.09090 2.18841 -174.52525 628.87734
6645.0000 -181.46893 -176.62689 4.84204 2.12063 -175.69827 546.96537
6650.0000 -180.70692 -175.72626 4.98066 2.09725 -176.10293 541.83476
6655.0000 -180.15633 -174.60116 5.55516 2.15696 -175.06946 559.61251
6660.0000 -179.98858 -174.04783 5.94075 2.20271 -174.27765 592.63838
6665.0000 -180.19032 -175.86514 4.32518 2.18356 -174.60913 588.52806
6670.0000 -180.38723 -175.64121 4.74602 2.11414 -175.81067 528.57042
6675.0000 -180.06529 -174.52076 5.54452 2.14039 -175.35626 527.18357
6680.0000 -179.67559 -173.70655 5.96904 2.18320 -174.61535 565.53344
6685.0000 -179.18722 -173.50491 5.68231 2.24236 -173.59144 609.52479
6690.0000 -178.83113 -173.39522 5.43591 2.25543 -173.36522 618.27674
6695.0000 -178.86022 -173.94550 4.91472 2.24477 -173.54980 589.01378
6700.0000 -180.24642 -175.16825 5.07817 2.20606 -174.21972 575.77712
6705.0000 -180.44044 -175.10363 5.33680 2.14383 -175.29671 530.50029
6710.0000 -180.04213 -173.39695 6.64517 2.19584 -174.39669 570.54553
6715.0000 -177.45272 -171.79159 5.66113 2.29568 -172.66869 633.15984
6720.0000 -178.12808 -172.51223 5.61586 2.35256 -171.68422 666.54772
6725.0000 -178.40794 -173.12471 5.28323 2.31292 -172.37024 646.55753
6730.0000 -178.59074 -173.71934 4.87139 2.26615 -173.17968 621.94747
6735.0000 -178.21305 -171.94317 6.26988 2.26660 -173.17194 613.76025
6740.0000 -178.27121 -172.93143 5.33978 2.28142 -172.91549 627.54461
6745.0000 -179.32558 -173.98602 5.33956 2.27294 -173.06215 666.80495
6750.0000 -180.16713 -174.77551 5.39162 2.21056 -174.14192 616.11500
FREEZING PROCESS: loop number 28 T-loop= 553.00000000000000
main_MD> interactions number 28 at Temperature= 553.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.14182 -2.50006 0.79354
force_rgl> df(natom) -1.06325 -0.72654 0.09896
6755.0000 -179.85753 -175.08757 4.76997 2.12779 -175.57437 564.59615
6760.0000 -181.13319 -175.40054 5.73265 2.14894 -175.20830 584.90815
6765.0000 -181.42030 -176.83027 4.59003 2.09395 -176.16009 527.17433
6770.0000 -180.74878 -175.82787 4.92091 2.05829 -176.77722 506.90793
6775.0000 -180.63058 -174.70363 5.92694 2.12668 -175.59356 533.61786
6780.0000 -181.33148 -175.65110 5.68038 2.14768 -175.23019 560.91807
6785.0000 -180.24871 -175.04112 5.20760 2.19391 -174.43006 605.27581
6790.0000 -180.42633 -174.89102 5.53531 2.18077 -174.65741 584.91561
6795.0000 -180.41451 -175.68311 4.73140 2.13791 -175.39921 555.93003
6800.0000 -180.50781 -175.52432 4.98349 2.14842 -175.21725 572.48125
6805.0000 -180.12624 -174.56410 5.56214 2.15936 -175.02793 555.57126
6810.0000 -179.90208 -174.96598 4.93610 2.16796 -174.87908 568.97139
6815.0000 -179.59071 -174.51023 5.08049 2.16897 -174.86158 551.76945
6820.0000 -180.60869 -174.95570 5.65299 2.15465 -175.10946 540.51362
6825.0000 -180.24052 -174.54204 5.69848 2.16799 -174.87855 554.86649
6830.0000 -180.83474 -175.35261 5.48212 2.16171 -174.98730 550.93323
6835.0000 -180.85354 -175.90824 4.94531 2.11577 -175.78232 544.78956
6840.0000 -179.85815 -175.06104 4.79711 2.14421 -175.29016 560.84609
6845.0000 -180.81983 -175.22305 5.59678 2.11656 -175.76878 530.86293
6850.0000 -179.68172 -174.30695 5.37476 2.15989 -175.01885 560.71783
6855.0000 -179.62078 -174.83816 4.78262 2.18628 -174.56207 557.70185
6860.0000 -179.68468 -174.45528 5.22940 2.19305 -174.44483 583.60850
6865.0000 -181.65583 -176.26407 5.39176 2.14347 -175.30299 563.75490
6870.0000 -179.99057 -174.35992 5.63066 2.11869 -175.73180 540.56173
6875.0000 -180.36178 -175.59264 4.76914 2.15020 -175.18656 580.01725
6880.0000 -180.70002 -175.80556 4.89447 2.08197 -176.36734 531.11189
6885.0000 -182.04531 -176.83247 5.21284 2.05464 -176.84043 522.16020
6890.0000 -180.64356 -175.20930 5.43426 2.10456 -175.97636 550.31964
6895.0000 -180.77947 -175.16968 5.60979 2.18011 -174.66880 573.18597
6900.0000 -180.34730 -175.60960 4.73770 2.14125 -175.34143 545.25471
6905.0000 -180.82014 -174.94749 5.87265 2.13645 -175.42452 535.76824
6910.0000 -178.53520 -174.09216 4.44305 2.20136 -174.30101 578.96336
6915.0000 -179.50928 -174.90772 4.60156 2.20049 -174.31612 557.51438
6920.0000 -180.34617 -174.77099 5.57518 2.18325 -174.61443 551.83573
6925.0000 -180.46989 -176.18446 4.28543 2.10227 -176.01607 504.29746
6930.0000 -182.12937 -177.12144 5.00793 2.08039 -176.39467 512.74844
6935.0000 -181.17735 -176.40087 4.77648 2.09857 -176.07998 528.59752
6940.0000 -181.38803 -176.39981 4.98822 2.08751 -176.27152 515.20779
6945.0000 -180.82858 -177.46059 3.36799 2.02845 -177.29368 478.25873
6950.0000 -180.86964 -176.56112 4.30852 2.04206 -177.05816 491.35211
6955.0000 -180.20177 -175.30513 4.89664 2.11810 -175.74206 539.54832
6960.0000 -180.24467 -175.13334 5.11133 2.14965 -175.19597 583.96968
6965.0000 -181.04954 -176.49225 4.55729 2.11817 -175.74078 553.70784
6970.0000 -179.97626 -175.24308 4.73318 2.13444 -175.45924 555.03920
6975.0000 -180.64697 -175.96261 4.68436 2.14595 -175.26005 550.65626
6980.0000 -180.10688 -175.41265 4.69422 2.12858 -175.56063 531.78541
6985.0000 -180.54647 -175.06507 5.48140 2.16277 -174.96890 552.98298
6990.0000 -180.75572 -175.83609 4.91963 2.15274 -175.14253 531.87530
6995.0000 -182.03032 -177.06527 4.96505 2.08941 -176.23859 510.06231
7000.0000 -181.21988 -176.01564 5.20424 2.07409 -176.50372 513.63622
FREEZING PROCESS: loop number 29 T-loop= 528.00000000000000
main_MD> interactions number 29 at Temperature= 528.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.81313 -0.29538 -0.95098
force_rgl> df(natom) -1.68855 -0.94715 -2.25036
7005.0000 -181.48350 -176.70099 4.78250 2.09700 -176.10725 536.38355
7010.0000 -180.74126 -175.62921 5.11205 2.07989 -176.40343 520.30708
7015.0000 -180.81166 -175.80596 5.00569 2.10268 -176.00898 552.30946
7020.0000 -179.45637 -174.35573 5.10063 2.17979 -174.67442 579.17936
7025.0000 -180.59659 -175.88930 4.70729 2.13463 -175.45595 542.80742
7030.0000 -180.38679 -175.94631 4.44048 2.11933 -175.72081 522.14516
7035.0000 -179.74151 -175.30816 4.43335 2.15115 -175.17013 540.64782
7040.0000 -181.78941 -176.82478 4.96463 2.09292 -176.17778 491.44062
7045.0000 -181.60055 -176.11494 5.48561 2.05490 -176.83583 494.43864
7050.0000 -181.06101 -176.76471 4.29630 2.11471 -175.80071 563.31458
7055.0000 -182.12716 -177.53618 4.59098 2.04278 -177.04559 504.60711
7060.0000 -181.54397 -176.45867 5.08531 2.02608 -177.33461 488.58038
7065.0000 -181.55801 -175.77997 5.77804 2.08837 -176.25667 542.00769
7070.0000 -180.42690 -175.64408 4.78282 2.16116 -174.99687 561.51487
7075.0000 -179.44819 -174.59991 4.84827 2.15508 -175.10200 553.84473
7080.0000 -180.29838 -175.81733 4.48105 2.13966 -175.36890 548.03375
7085.0000 -180.81254 -175.64589 5.16664 2.12683 -175.59104 540.25550
7090.0000 -180.02222 -174.60329 5.41893 2.16568 -174.91857 556.80396
7095.0000 -180.64646 -175.75282 4.89364 2.10471 -175.97378 527.68749
7100.0000 -181.25053 -175.66364 5.58690 2.11249 -175.83923 515.07365
7105.0000 -180.79429 -175.90038 4.89391 2.13993 -175.36430 531.18493
7110.0000 -180.22112 -175.95377 4.26736 2.07704 -176.45264 495.73224
7115.0000 -181.25929 -176.09962 5.15967 2.14444 -175.28617 538.72572
7120.0000 -180.80309 -176.48476 4.31833 2.09064 -176.21724 503.45493
7125.0000 -181.15502 -176.40902 4.74600 2.11415 -175.81035 516.60113
7130.0000 -181.41015 -176.82199 4.58815 2.08742 -176.27306 513.68260
7135.0000 -181.34548 -176.23998 5.10550 2.05600 -176.81681 513.29645
7140.0000 -181.60006 -176.37589 5.22417 2.09283 -176.17947 537.42947
7145.0000 -181.51082 -177.16723 4.34359 2.07058 -176.56452 524.92283
7150.0000 -181.10079 -176.26624 4.83455 2.08320 -176.34608 519.02183
7155.0000 -181.56404 -175.92277 5.64127 2.10551 -175.95995 525.05678
7160.0000 -180.59180 -175.50457 5.08723 2.10416 -175.98331 541.20421
7165.0000 -181.11074 -176.29247 4.81827 2.09716 -176.10443 535.70877
7170.0000 -180.24704 -175.35450 4.89254 2.11969 -175.71453 529.28180
7175.0000 -180.54661 -175.79015 4.75645 2.12948 -175.54515 530.16783
7180.0000 -180.39560 -175.31020 5.08540 2.13926 -175.37580 547.37775
7185.0000 -180.30447 -174.92706 5.37741 2.14912 -175.20518 555.16019
7190.0000 -180.39715 -175.74711 4.65003 2.14958 -175.19720 536.81942
7195.0000 -180.94564 -176.16624 4.77940 2.12038 -175.70255 513.35059
7200.0000 -180.53506 -174.76148 5.77357 2.14795 -175.22538 516.11965
7205.0000 -179.94513 -175.04424 4.90088 2.19409 -174.42685 569.12870
7210.0000 -180.95162 -175.40118 5.55044 2.14675 -175.24621 531.43511
7215.0000 -180.62719 -174.96600 5.66119 2.16267 -174.97076 533.92251
7220.0000 -180.69482 -175.02249 5.67233 2.13831 -175.39225 566.23808
7225.0000 -181.63406 -175.56870 6.06536 2.14530 -175.27131 570.51485
7230.0000 -181.43669 -176.40636 5.03033 2.10470 -175.97404 571.93219
7235.0000 -182.17417 -177.27819 4.89598 2.06394 -176.67932 566.30471
7240.0000 -182.78225 -177.70656 5.07570 2.02577 -177.34001 543.56437
7245.0000 -183.03704 -178.33383 4.70321 1.98498 -178.04600 515.49798
7250.0000 -181.71702 -177.47076 4.24626 2.01467 -177.53219 541.61068
FREEZING PROCESS: loop number 30 T-loop= 503.00000000000000
main_MD> interactions number 30 at Temperature= 503.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.05688 3.17944 -1.49946
force_rgl> df(natom) -1.89730 -1.27937 2.64244
7255.0000 -182.65818 -178.45389 4.20429 1.99065 -177.94783 524.43196
7260.0000 -182.66616 -178.16622 4.49994 1.97172 -178.27540 503.06032
7265.0000 -183.89686 -178.56874 5.32812 1.95418 -178.57900 495.07028
7270.0000 -182.61277 -177.55038 5.06239 1.98392 -178.06438 504.98559
7275.0000 -183.28269 -178.68391 4.59878 1.97108 -178.28648 512.09242
7280.0000 -182.81394 -178.07767 4.73626 1.95412 -178.58000 495.52429
7285.0000 -183.75083 -178.99135 4.75949 1.95767 -178.51864 500.26208
7290.0000 -183.54611 -179.50237 4.04374 1.92769 -179.03745 478.52175
7295.0000 -182.80083 -178.43259 4.36825 1.95339 -178.59261 483.10718
7300.0000 -182.58756 -177.87794 4.70962 1.97217 -178.26759 506.81622
7305.0000 -183.03043 -177.85140 5.17903 2.02407 -177.36939 539.02787
7310.0000 -183.39001 -178.20207 5.18794 1.99388 -177.89188 521.35180
7315.0000 -181.73136 -176.51840 5.21296 2.02215 -177.40270 537.69616
7320.0000 -182.15357 -178.13037 4.02320 2.01179 -177.58191 535.63779
7325.0000 -182.79975 -178.26620 4.53355 1.96760 -178.34677 498.07167
7330.0000 -183.12331 -177.50515 5.61816 1.97132 -178.28243 507.40405
7335.0000 -182.69755 -177.21235 5.48520 1.99936 -177.79701 534.27267
7340.0000 -183.98988 -179.09293 4.89695 1.97497 -178.21915 518.91789
7345.0000 -182.57858 -178.18500 4.39358 1.94804 -178.68524 484.55615
7350.0000 -182.29120 -177.58300 4.70820 1.98719 -178.00768 523.09339
7355.0000 -183.11147 -178.93812 4.17335 1.95831 -178.50749 486.85302
7360.0000 -182.97346 -178.63121 4.34225 1.98077 -178.11887 512.81758
7365.0000 -183.56202 -178.31395 5.24808 1.98399 -178.06313 515.95304
7370.0000 -182.85381 -177.80244 5.05137 1.98154 -178.10545 500.84794
7375.0000 -181.82559 -176.96385 4.86174 2.00475 -177.70389 515.36931
7380.0000 -183.06157 -179.04509 4.01647 1.96642 -178.36723 497.60102
7385.0000 -183.25925 -178.63288 4.62636 1.93127 -178.97547 480.98258
7390.0000 -183.50346 -179.02238 4.48108 1.93165 -178.96888 476.56027
7395.0000 -182.28430 -178.39043 3.89387 1.95744 -178.52257 496.40647
7400.0000 -183.04763 -178.50364 4.54400 1.95597 -178.54810 498.95264
7405.0000 -183.45472 -178.85218 4.60254 1.96350 -178.41776 489.74825
7410.0000 -182.96138 -179.09448 3.86689 1.91632 -179.23419 455.52445
7415.0000 -183.20098 -178.59235 4.60863 1.93263 -178.95200 470.22877
7420.0000 -182.92154 -178.04885 4.87269 1.95827 -178.50821 499.08085
7425.0000 -181.58984 -177.02044 4.56941 1.98971 -177.96406 521.21760
7430.0000 -181.71574 -176.94277 4.77297 2.03951 -177.10215 553.90140
7435.0000 -182.61271 -176.94069 5.67202 2.04532 -177.00158 543.07100
7440.0000 -183.56308 -178.54650 5.01658 1.98982 -177.96226 514.81839
7445.0000 -183.29982 -179.79110 3.50872 1.92754 -179.04012 466.15576
7450.0000 -182.44001 -177.82718 4.61283 1.96711 -178.35516 500.87199
7455.0000 -183.77692 -179.58151 4.19541 1.93494 -178.91197 477.39846
7460.0000 -183.65925 -178.96034 4.69891 1.91701 -179.22235 463.12432
7465.0000 -182.42894 -177.28618 5.14276 1.93420 -178.92479 479.28919
7470.0000 -183.43438 -177.85975 5.57463 1.99814 -177.81828 529.04169
7475.0000 -183.12998 -178.23016 4.89982 2.00288 -177.73616 529.49818
7480.0000 -183.18489 -178.85046 4.33443 1.96076 -178.46519 501.48078
7485.0000 -183.45714 -178.32406 5.13308 1.95820 -178.50942 502.10301
7490.0000 -183.20591 -177.89097 5.31493 1.99768 -177.82617 528.76173
7495.0000 -182.87383 -178.37922 4.49462 1.96919 -178.31932 491.30276
7500.0000 -182.76842 -177.77420 4.99421 1.98492 -178.04706 511.43698
FREEZING PROCESS: loop number 31 T-loop= 478.00000000000000
main_MD> interactions number 31 at Temperature= 478.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.65710 -2.84292 0.81467
force_rgl> df(natom) -0.20407 2.79026 0.03730
7505.0000 -183.25107 -178.86994 4.38113 1.99761 -177.82742 524.55031
7510.0000 -183.19055 -178.29459 4.89596 1.95910 -178.49384 497.94584
7515.0000 -183.30329 -178.41975 4.88354 1.99073 -177.94638 522.73170
7520.0000 -182.62304 -177.87507 4.74798 1.98466 -178.05153 508.59427
7525.0000 -183.54115 -179.94657 3.59458 1.95791 -178.51438 493.58391
7530.0000 -183.41088 -179.53190 3.87898 1.89985 -179.51923 459.08909
7535.0000 -183.56995 -178.79969 4.77026 1.92146 -179.14531 469.27288
7540.0000 -183.33903 -178.73466 4.60437 1.94669 -178.70858 491.60387
7545.0000 -183.97195 -179.25967 4.71227 1.93905 -178.84088 483.50234
7550.0000 -183.50229 -178.78841 4.71387 1.92390 -179.10309 471.83977
7555.0000 -184.35190 -180.17401 4.17790 1.89309 -179.63637 445.98761
7560.0000 -182.95030 -179.16960 3.78069 1.88313 -179.80863 438.57572
7565.0000 -183.87747 -178.94048 4.93699 1.94957 -178.65885 490.57928
7570.0000 -183.74904 -179.11162 4.63741 1.92846 -179.02421 470.50597
7575.0000 -183.92213 -179.07770 4.84443 1.91647 -179.23165 466.75523
7580.0000 -182.45029 -178.67176 3.77853 1.94482 -178.74093 486.30876
7585.0000 -182.84712 -178.93657 3.91055 1.94789 -178.68794 492.65966
7590.0000 -183.73454 -178.68986 5.04468 1.96824 -178.33568 499.43070
7595.0000 -183.09098 -178.80754 4.28344 1.95798 -178.51320 501.14518
7600.0000 -182.62077 -177.80828 4.81249 1.92880 -179.01825 473.03305
7605.0000 -182.77092 -178.12768 4.64324 1.97897 -178.15006 506.80124
7610.0000 -183.33814 -179.47060 3.86754 1.94270 -178.77778 465.21956
7615.0000 -183.59455 -179.14926 4.44528 1.90344 -179.45723 448.31210
7620.0000 -183.70519 -178.95016 4.75503 1.89523 -179.59931 449.83447
7625.0000 -183.78287 -179.65501 4.12787 1.90735 -179.38952 456.16145
7630.0000 -183.02484 -177.98494 5.03990 1.94494 -178.73896 486.22322
7635.0000 -183.77829 -179.25136 4.52694 1.94371 -178.76026 482.49724
7640.0000 -183.55753 -180.04058 3.51695 1.89312 -179.63576 446.99340
7645.0000 -183.89925 -179.85754 4.04171 1.88287 -179.81309 433.80154
7650.0000 -183.83460 -179.44013 4.39447 1.89570 -179.59106 443.28540
7655.0000 -182.82064 -178.20560 4.61503 1.93251 -178.95410 474.58220
7660.0000 -183.03030 -178.12871 4.90159 1.97242 -178.26330 506.60526
7665.0000 -183.20200 -178.96317 4.23883 1.92835 -179.02600 468.85523
7670.0000 -182.81997 -178.51036 4.30961 1.94217 -178.78696 480.64173
7675.0000 -182.80680 -177.94697 4.85983 1.98934 -177.97043 521.17273
7680.0000 -183.32254 -178.98559 4.33695 1.95575 -178.55190 499.20689
7685.0000 -183.43965 -178.35147 5.08819 1.95379 -178.58584 499.88279
7690.0000 -183.19032 -178.90207 4.28826 1.95287 -178.60169 495.63740
7695.0000 -182.28326 -177.73120 4.55206 1.95510 -178.56302 481.48518
7700.0000 -182.79764 -178.40359 4.39406 2.00913 -177.62796 529.27574
7705.0000 -183.45402 -179.29280 4.16122 1.88226 -179.82368 428.90875
7710.0000 -182.81123 -178.32736 4.48387 1.92879 -179.01848 470.37370
7715.0000 -183.51661 -179.20310 4.31351 1.96595 -178.37531 499.58117
7720.0000 -182.71291 -179.08659 3.62632 1.91543 -179.24971 460.91419
7725.0000 -182.79835 -177.90906 4.88929 1.95446 -178.57412 477.77931
7730.0000 -182.44984 -178.10732 4.34253 1.98389 -178.06488 505.22714
7735.0000 -183.02743 -178.05972 4.96771 1.98564 -178.03448 513.71745
7740.0000 -183.45454 -179.23453 4.22001 1.94632 -178.71499 480.81371
7745.0000 -183.07948 -178.67226 4.40722 1.92653 -179.05753 472.19806
7750.0000 -183.18397 -179.48566 3.69832 1.93027 -178.99280 469.68462
FREEZING PROCESS: loop number 32 T-loop= 453.00000000000000
main_MD> interactions number 32 at Temperature= 453.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.61324 -1.02940 -0.13682
force_rgl> df(natom) -1.04421 -2.48192 2.65427
7755.0000 -183.27438 -179.69331 3.58107 1.91922 -179.18415 465.20974
7760.0000 -183.84695 -179.72359 4.12336 1.88948 -179.69874 438.97517
7765.0000 -183.53553 -179.76082 3.77471 1.88612 -179.75696 435.87430
7770.0000 -184.11244 -179.59892 4.51352 1.88506 -179.77522 435.13972
7775.0000 -183.26483 -179.18612 4.07871 1.91129 -179.32124 459.84609
7780.0000 -183.03837 -179.30106 3.73731 1.91802 -179.20482 465.01448
7785.0000 -183.84401 -179.94079 3.90322 1.89315 -179.63522 442.79035
7790.0000 -183.67196 -179.45412 4.21783 1.89906 -179.53304 442.70092
7795.0000 -183.84221 -180.36096 3.48125 1.86697 -180.08841 415.93601
7800.0000 -183.43970 -178.99567 4.44403 1.87732 -179.90922 421.29221
7805.0000 -183.59851 -179.48081 4.11771 1.92522 -179.08026 453.88152
7810.0000 -183.75294 -178.84288 4.91006 1.90007 -179.51544 441.11800
7815.0000 -183.55963 -179.90594 3.65368 1.90375 -179.45184 451.65855
7820.0000 -183.28935 -178.86537 4.42398 1.89764 -179.55757 444.83483
7825.0000 -184.07495 -179.95848 4.11647 1.90646 -179.40496 448.35036
7830.0000 -183.51209 -178.94408 4.56801 1.90453 -179.43825 447.87594
7835.0000 -183.88338 -179.14014 4.74324 1.90325 -179.46044 456.12339
7840.0000 -183.36386 -179.38648 3.97738 1.89195 -179.65600 441.99692
7845.0000 -183.23561 -179.25975 3.97587 1.90603 -179.41243 451.16526
7850.0000 -183.98773 -179.43737 4.55036 1.89807 -179.55014 440.61001
7855.0000 -183.94318 -180.33143 3.61175 1.87597 -179.93255 426.99675
7860.0000 -183.83061 -179.78581 4.04480 1.86026 -180.20458 413.72439
7865.0000 -183.11171 -178.65939 4.45232 1.90842 -179.37104 455.33680
7870.0000 -183.30437 -179.00470 4.29967 1.94749 -178.69480 482.43722
7875.0000 -182.51363 -177.77390 4.73973 1.97127 -178.28319 502.35781
7880.0000 -183.09163 -178.93526 4.15637 1.95890 -178.49730 493.53093
7885.0000 -183.27738 -179.05836 4.21902 1.94011 -178.82245 475.91969
7890.0000 -183.58510 -179.52059 4.06451 1.91828 -179.20035 460.65285
7895.0000 -183.20500 -178.57269 4.63231 1.94001 -178.82426 470.69478
7900.0000 -183.41994 -179.29538 4.12456 1.93639 -178.88683 470.92992
7905.0000 -182.95111 -179.12295 3.82816 1.91025 -179.33937 457.90576
7910.0000 -183.53179 -179.53703 3.99476 1.91160 -179.31592 456.27832
7915.0000 -183.81759 -179.40543 4.41216 1.92183 -179.13882 473.47691
7920.0000 -183.86241 -179.61253 4.24987 1.90463 -179.43651 446.75736
7925.0000 -183.44192 -179.44198 3.99994 1.90001 -179.51660 451.64679
7930.0000 -184.07014 -180.02370 4.04644 1.90321 -179.46121 448.82032
7935.0000 -183.90372 -179.31691 4.58680 1.91585 -179.24236 457.40994
7940.0000 -184.12045 -180.07328 4.04717 1.89195 -179.65598 439.67343
7945.0000 -183.64387 -179.47486 4.16901 1.88242 -179.82104 418.50589
7950.0000 -183.79868 -179.13477 4.66391 1.90361 -179.45431 448.12260
7955.0000 -184.22303 -180.02351 4.19952 1.87382 -179.96988 425.28341
7960.0000 -184.14781 -180.07001 4.07781 1.88207 -179.82700 430.31020
7965.0000 -183.50177 -179.08655 4.41522 1.89885 -179.53663 446.69418
7970.0000 -183.42925 -179.02145 4.40780 1.90380 -179.45092 447.55402
7975.0000 -183.25533 -179.10606 4.14927 1.93116 -178.97751 471.92730
7980.0000 -183.91813 -179.45758 4.46055 1.89998 -179.51700 444.91232
7985.0000 -183.93043 -180.44856 3.48187 1.87999 -179.86294 430.65752
7990.0000 -183.55366 -180.13454 3.41912 1.87730 -179.90957 433.94662
7995.0000 -183.18357 -178.74745 4.43613 1.91605 -179.23898 461.16668
8000.0000 -183.66538 -179.42505 4.24033 1.92803 -179.03156 465.22015
FREEZING PROCESS: loop number 33 T-loop= 428.00000000000000
main_MD> interactions number 33 at Temperature= 428.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.18923 -2.25487 0.66138
force_rgl> df(natom) 0.98331 0.09335 -0.54151
8005.0000 -183.76974 -179.20000 4.56974 1.91522 -179.25329 456.35182
8010.0000 -183.92576 -180.35010 3.57566 1.87492 -179.95075 428.42998
8015.0000 -184.05802 -179.12775 4.93027 1.89319 -179.63450 442.16996
8020.0000 -183.96681 -179.75418 4.21264 1.94012 -178.82227 482.57772
8025.0000 -184.29721 -179.63289 4.66432 1.88602 -179.75863 433.95412
8030.0000 -184.06834 -179.64962 4.41872 1.89441 -179.61354 443.52519
8035.0000 -184.52096 -180.80417 3.71679 1.89855 -179.54188 448.50047
8040.0000 -183.99209 -179.79844 4.19365 1.84122 -180.53398 400.45364
8045.0000 -184.59043 -180.30817 4.28226 1.84885 -180.40189 400.62826
8050.0000 -183.68520 -179.51260 4.17260 1.87626 -179.92761 427.76092
8055.0000 -183.23041 -178.81283 4.41758 1.93434 -178.92245 474.41530
8060.0000 -183.33679 -179.71356 3.62323 1.92826 -179.02767 463.48237
8065.0000 -184.31320 -180.83325 3.47995 1.85742 -180.25359 409.41832
8070.0000 -184.14568 -180.50056 3.64512 1.82147 -180.87575 378.04501
8075.0000 -183.90791 -180.00384 3.90407 1.85308 -180.32878 401.16132
8080.0000 -183.66840 -179.50586 4.16253 1.89845 -179.54346 442.49490
8085.0000 -183.71226 -179.15402 4.55824 1.90740 -179.38868 449.47629
8090.0000 -183.93871 -179.23170 4.70702 1.91194 -179.31008 459.87608
8095.0000 -183.86687 -179.84957 4.01730 1.88790 -179.72612 437.67100
8100.0000 -184.31321 -180.39120 3.92202 1.87659 -179.92179 426.28059
8105.0000 -184.06912 -180.42254 3.64658 1.84694 -180.43505 402.93697
8110.0000 -183.56579 -180.29538 3.27041 1.83285 -180.67892 388.87499
8115.0000 -183.79482 -180.18242 3.61240 1.85934 -180.22046 413.81631
8120.0000 -184.26959 -179.87691 4.39268 1.86165 -180.18040 414.72249
8125.0000 -182.99915 -178.68190 4.31725 1.90415 -179.44491 449.98712
8130.0000 -183.42708 -179.55580 3.87127 1.93332 -178.94007 470.93096
8135.0000 -183.47049 -179.82274 3.64775 1.86860 -180.06010 414.14775
8140.0000 -184.34807 -180.03130 4.31677 1.84899 -180.39961 404.66225
8145.0000 -184.41656 -180.36503 4.05153 1.86455 -180.13028 419.74849
8150.0000 -183.84253 -180.27341 3.56912 1.85108 -180.36330 408.76809
8155.0000 -183.71410 -179.41258 4.30153 1.88724 -179.73756 441.35706
8160.0000 -184.03137 -179.96831 4.06307 1.87287 -179.98633 423.86285
8165.0000 -184.11271 -179.93574 4.17697 1.88263 -179.81741 432.31857
8170.0000 -184.51911 -180.58101 3.93809 1.85319 -180.32684 406.65415
8175.0000 -183.28407 -179.73615 3.54792 1.85465 -180.30151 405.36626
8180.0000 -183.81846 -179.20531 4.61315 1.91224 -179.30493 453.02326
8185.0000 -184.17685 -180.23148 3.94538 1.87399 -179.96693 423.26578
8190.0000 -183.58821 -179.38175 4.20646 1.87052 -180.02700 418.93451
8195.0000 -183.90798 -179.57529 4.33269 1.88819 -179.72102 436.73631
8200.0000 -184.65491 -181.24606 3.40885 1.85618 -180.27514 410.75755
8205.0000 -184.68830 -181.24294 3.44535 1.79302 -181.36816 353.00250
8210.0000 -184.41891 -179.99666 4.42225 1.85615 -180.27558 414.11707
8215.0000 -183.29630 -179.55133 3.74497 1.87306 -179.98294 422.30777
8220.0000 -183.36965 -179.76014 3.60950 1.90760 -179.38513 450.51738
8225.0000 -183.76297 -180.05065 3.71232 1.87059 -180.02568 421.05794
8230.0000 -183.96711 -180.36090 3.60621 1.85803 -180.24315 408.43427
8235.0000 -183.75802 -179.69432 4.06370 1.88426 -179.78910 431.30234
8240.0000 -183.46884 -179.53195 3.93689 1.86721 -180.08421 424.38935
8245.0000 -184.17542 -180.29282 3.88260 1.87195 -180.00220 426.68191
8250.0000 -184.24985 -179.95367 4.29618 1.89321 -179.63417 443.25062
FREEZING PROCESS: loop number 34 T-loop= 403.00000000000000
main_MD> interactions number 34 at Temperature= 403.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.39754 -1.59608 -0.70724
force_rgl> df(natom) -0.32497 0.55511 -1.98619
8255.0000 -184.54085 -180.53267 4.00818 1.87219 -179.99804 423.41215
8260.0000 -184.35610 -180.22224 4.13386 1.84785 -180.41930 402.18955
8265.0000 -184.21089 -180.48351 3.72738 1.89058 -179.67973 443.31860
8270.0000 -184.21516 -180.89906 3.31610 1.84242 -180.51328 396.28325
8275.0000 -183.90095 -180.06341 3.83754 1.85316 -180.32733 404.28602
8280.0000 -184.21940 -180.42106 3.79834 1.86888 -180.05531 423.38265
8285.0000 -183.28314 -179.17380 4.10934 1.86708 -180.08638 423.49288
8290.0000 -183.73948 -179.32397 4.41551 1.89619 -179.58265 442.24848
8295.0000 -183.91473 -180.07116 3.84357 1.88698 -179.74200 436.37671
8300.0000 -184.50280 -180.57031 3.93250 1.85645 -180.27038 409.03126
8305.0000 -184.14693 -180.09389 4.05304 1.85714 -180.25841 407.66426
8310.0000 -184.57641 -181.29484 3.28156 1.84586 -180.45370 399.18876
8315.0000 -184.83762 -181.32368 3.51394 1.81385 -181.00776 372.74867
8320.0000 -184.44565 -180.61038 3.83527 1.81363 -181.01158 374.78079
8325.0000 -184.55927 -181.52570 3.03358 1.81156 -181.04730 370.34127
8330.0000 -184.04796 -180.04482 4.00315 1.83099 -180.71108 389.56994
8335.0000 -183.98514 -179.88540 4.09974 1.86318 -180.15393 416.04294
8340.0000 -184.28058 -180.18630 4.09428 1.87035 -180.02978 423.09379
8345.0000 -184.38678 -179.98224 4.40454 1.88349 -179.80242 434.69957
8350.0000 -184.65832 -180.62123 4.03709 1.84646 -180.44338 404.72129
8355.0000 -184.56387 -181.13454 3.42933 1.81877 -180.92264 382.10628
8360.0000 -184.33279 -180.70177 3.63102 1.81557 -180.97796 377.94387
8365.0000 -184.00190 -180.51909 3.48282 1.83621 -180.62075 391.03722
8370.0000 -183.76816 -179.88309 3.88507 1.83529 -180.63657 394.30209
8375.0000 -184.65434 -180.76687 3.88747 1.84886 -180.40174 399.36062
8380.0000 -183.84823 -179.88668 3.96156 1.85417 -180.30992 408.13043
8385.0000 -184.43522 -180.92409 3.51112 1.83809 -180.58816 394.23365
8390.0000 -184.17565 -179.99274 4.18291 1.86762 -180.07719 417.28810
8395.0000 -183.63375 -179.79112 3.84263 1.87856 -179.88779 424.38424
8400.0000 -184.10302 -179.78157 4.32146 1.87420 -179.96318 424.43338
8405.0000 -184.03362 -179.32848 4.70514 1.89781 -179.55458 441.65550
8410.0000 -184.25506 -180.18536 4.06970 1.88982 -179.69290 434.53863
8415.0000 -184.07848 -180.62909 3.44938 1.85519 -180.29224 408.95072
8420.0000 -184.57502 -180.37342 4.20161 1.87352 -179.97499 425.73254
8425.0000 -184.39990 -180.92561 3.47429 1.85730 -180.25567 410.27985
8430.0000 -184.20136 -180.85334 3.34801 1.82119 -180.88069 380.10959
8435.0000 -184.56834 -180.91916 3.64918 1.80725 -181.12196 368.61082
8440.0000 -184.22535 -180.71405 3.51129 1.84948 -180.39108 405.79560
8445.0000 -183.81300 -179.86550 3.94750 1.84817 -180.41369 402.50440
8450.0000 -183.33934 -179.47136 3.86798 1.88519 -179.77309 429.80351
8455.0000 -184.23431 -180.26933 3.96499 1.90217 -179.47907 451.22195
8460.0000 -184.55632 -180.59172 3.96460 1.86217 -180.17139 414.87610
8465.0000 -184.19150 -180.14163 4.04987 1.87056 -180.02625 421.01881
8470.0000 -183.80855 -179.77793 4.03062 1.88346 -179.80296 430.85126
8475.0000 -184.35651 -180.88380 3.47270 1.85745 -180.25311 409.29600
8480.0000 -184.15662 -181.00370 3.15292 1.82119 -180.88073 378.53067
8485.0000 -183.91332 -180.49567 3.41765 1.81210 -181.03802 372.23082
8490.0000 -184.09962 -180.44478 3.65484 1.84702 -180.43364 399.63824
8495.0000 -184.21760 -180.66331 3.55430 1.85496 -180.29626 408.89527
8500.0000 -183.48914 -179.82792 3.66122 1.88197 -179.82880 427.26899
FREEZING PROCESS: loop number 35 T-loop= 378.00000000000000
main_MD> interactions number 35 at Temperature= 378.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.78066 -3.24735 -0.38019
force_rgl> df(natom) 1.90659 -2.82686 2.21855
8505.0000 -184.23715 -180.98879 3.24836 1.86001 -180.20884 416.75104
8510.0000 -184.19246 -180.95786 3.23460 1.81214 -181.03725 371.84853
8515.0000 -184.12002 -180.28184 3.83819 1.82461 -180.82152 381.10349
8520.0000 -184.91016 -180.92300 3.98716 1.82748 -180.77183 383.13821
8525.0000 -184.92221 -180.87329 4.04892 1.79954 -181.25538 366.70024
8530.0000 -184.43037 -181.03123 3.39914 1.84015 -180.55252 400.47533
8535.0000 -184.41114 -180.66043 3.75071 1.81860 -180.92547 380.84032
8540.0000 -183.96845 -180.23636 3.73209 1.83518 -180.63863 390.92724
8545.0000 -184.61345 -180.34428 4.26918 1.85250 -180.33871 404.03211
8550.0000 -183.45930 -180.25815 3.20115 1.83597 -180.62482 396.20219
8555.0000 -184.21854 -180.99453 3.22401 1.84099 -180.53802 392.72363
8560.0000 -184.09391 -180.14307 3.95084 1.82574 -180.80186 383.13385
8565.0000 -184.59802 -181.18080 3.41722 1.83986 -180.55750 399.12097
8570.0000 -184.13876 -180.85802 3.28074 1.82533 -180.80906 382.92040
8575.0000 -184.48717 -180.64591 3.84126 1.81895 -180.91948 383.46725
8580.0000 -184.71435 -181.11171 3.60264 1.82450 -180.82347 383.16398
8585.0000 -184.33031 -181.15587 3.17444 1.79299 -181.36875 360.48912
8590.0000 -184.21050 -180.30091 3.90959 1.83149 -180.70239 388.41545
8595.0000 -184.47964 -180.68190 3.79775 1.86431 -180.13443 415.45451
8600.0000 -184.91337 -181.58502 3.32835 1.81775 -180.94014 380.93583
8605.0000 -184.83015 -181.21360 3.61656 1.79221 -181.38221 356.79930
8610.0000 -184.46400 -181.39239 3.07161 1.78956 -181.42813 356.27344
8615.0000 -184.55438 -181.11549 3.43889 1.80012 -181.24528 360.97320
8620.0000 -185.00440 -181.80662 3.19778 1.79514 -181.33147 357.65196
8625.0000 -185.09347 -181.56283 3.53065 1.80402 -181.17788 367.65575
8630.0000 -183.93599 -180.80231 3.13368 1.81455 -180.99567 372.46731
8635.0000 -184.86173 -181.27753 3.58420 1.82663 -180.78652 383.52333
8640.0000 -185.16666 -181.69309 3.47356 1.78049 -181.58512 344.25854
8645.0000 -184.41982 -181.18019 3.23964 1.80305 -181.19463 366.63703
8650.0000 -184.66998 -180.74987 3.92011 1.82059 -180.89112 383.45064
8655.0000 -184.90272 -181.09924 3.80348 1.80187 -181.21503 366.65482
8660.0000 -184.21551 -180.84941 3.36611 1.82934 -180.73957 392.34937
8665.0000 -183.93839 -180.64216 3.29623 1.81228 -181.03487 372.54771
8670.0000 -184.23754 -181.49596 2.74158 1.81213 -181.03752 371.42371
8675.0000 -185.02154 -181.44271 3.57883 1.78707 -181.47127 354.61943
8680.0000 -185.01972 -181.76848 3.25124 1.77361 -181.70406 337.93178
8685.0000 -184.55210 -180.41352 4.13858 1.80365 -181.18423 364.00088
8690.0000 -184.59246 -180.78606 3.80640 1.85637 -180.27173 411.43380
8695.0000 -184.57026 -181.41982 3.15044 1.80430 -181.17299 366.84625
8700.0000 -184.71308 -181.30426 3.40882 1.81421 -181.00152 376.47634
8705.0000 -184.84075 -181.07647 3.76428 1.81145 -181.04921 372.05644
8710.0000 -184.91378 -181.08679 3.82699 1.81439 -180.99830 372.85442
8715.0000 -185.16993 -181.48852 3.68140 1.79797 -181.28259 360.65720
8720.0000 -184.41111 -180.67827 3.73284 1.80255 -181.20335 365.33343
8725.0000 -184.84166 -181.68775 3.15391 1.80527 -181.15621 369.55665
8730.0000 -184.16201 -181.21430 2.94771 1.78612 -181.48762 347.98099
8735.0000 -184.76050 -180.96435 3.79615 1.79394 -181.35233 358.15901
8740.0000 -184.90431 -181.56926 3.33505 1.82339 -180.84267 380.37579
8745.0000 -184.56060 -180.92594 3.63466 1.81061 -181.06385 370.75197
8750.0000 -184.59697 -181.33146 3.26551 1.80724 -181.12211 367.23297
FREEZING PROCESS: loop number 36 T-loop= 353.00000000000000
main_MD> interactions number 36 at Temperature= 353.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.41165 1.03566 -0.64849
force_rgl> df(natom) -2.13159 0.49291 1.65737
8755.0000 -184.77273 -181.60524 3.16749 1.78306 -181.54059 349.48159
8760.0000 -184.67532 -181.15073 3.52459 1.79130 -181.39793 350.62972
8765.0000 -184.40227 -181.14170 3.26057 1.78876 -181.44194 349.95425
8770.0000 -184.26394 -181.55733 2.70661 1.78480 -181.51041 347.83157
8775.0000 -184.01950 -180.80906 3.21044 1.80458 -181.16812 364.76657
8780.0000 -184.81472 -180.64192 4.17280 1.82688 -180.78220 385.77063
8785.0000 -183.56953 -179.87483 3.69469 1.87305 -179.98316 428.50882
8790.0000 -184.67454 -180.93394 3.74060 1.83362 -180.66562 393.62558
8795.0000 -184.77351 -181.11802 3.65548 1.79783 -181.28490 360.74614
8800.0000 -184.05854 -180.75022 3.30832 1.83170 -180.69885 385.42026
8805.0000 -184.83905 -182.10063 2.73842 1.80610 -181.14179 364.73868
8810.0000 -184.98508 -182.18611 2.79898 1.74980 -182.11620 320.98682
8815.0000 -185.15436 -182.36598 2.78838 1.73455 -182.38016 306.47285
8820.0000 -185.04925 -182.30953 2.73972 1.73702 -182.33744 307.02976
8825.0000 -184.75219 -181.14263 3.60956 1.77519 -181.67686 339.48659
8830.0000 -183.88493 -180.52570 3.35923 1.80406 -181.17721 362.93609
8835.0000 -184.89539 -181.41420 3.48119 1.80974 -181.07875 366.03319
8840.0000 -185.44598 -182.35641 3.08957 1.76400 -181.87041 331.59356
8845.0000 -185.00986 -182.01905 2.99080 1.74987 -182.11494 319.61850
8850.0000 -184.55790 -181.43709 3.12080 1.76405 -181.86956 331.54552
8855.0000 -184.60293 -181.30184 3.30108 1.80827 -181.10428 368.66749
8860.0000 -184.62452 -181.15406 3.47046 1.80485 -181.16350 368.32003
8865.0000 -185.41420 -182.45213 2.96207 1.75832 -181.96884 326.99054
8870.0000 -184.89694 -181.87261 3.02433 1.74467 -182.20504 314.16543
8875.0000 -184.94173 -181.60865 3.33308 1.76935 -181.77791 335.19019
8880.0000 -184.83894 -181.99477 2.84417 1.76793 -181.80240 333.18860
8885.0000 -185.09226 -181.53871 3.55355 1.77231 -181.72669 338.13157
8890.0000 -184.42528 -181.21520 3.21007 1.78948 -181.42946 356.08029
8895.0000 -185.23467 -182.07823 3.15644 1.76458 -181.86039 331.81389
8900.0000 -184.67274 -182.01145 2.66129 1.75570 -182.01417 322.96994
8905.0000 -184.33468 -181.40711 2.92758 1.77003 -181.76602 336.30051
8910.0000 -184.68810 -181.63493 3.05316 1.79529 -181.32888 358.33381
8915.0000 -185.26242 -182.38584 2.87658 1.75179 -182.08186 321.57669
8920.0000 -185.49962 -182.20015 3.29947 1.73442 -182.38244 305.31931
8925.0000 -184.69394 -181.39427 3.29966 1.78027 -181.58893 346.88230
8930.0000 -185.10083 -181.98943 3.11139 1.78682 -181.47548 349.73784
8935.0000 -184.72313 -181.81691 2.90622 1.76681 -181.82182 333.11348
8940.0000 -185.26206 -182.56432 2.69774 1.74435 -182.21060 312.11023
8945.0000 -184.95988 -181.29842 3.66146 1.76904 -181.78323 339.22327
8950.0000 -184.28851 -180.99582 3.29269 1.80524 -181.15676 366.62900
8955.0000 -184.85512 -181.63072 3.22440 1.79386 -181.35367 358.12651
8960.0000 -184.83215 -181.92717 2.90498 1.77933 -181.60515 348.02991
8965.0000 -185.07160 -181.88925 3.18235 1.76801 -181.80109 331.97594
8970.0000 -184.04924 -180.39972 3.64952 1.81885 -180.92110 376.79460
8975.0000 -184.58345 -180.83776 3.74569 1.83448 -180.65068 391.71170
8980.0000 -184.76757 -181.12692 3.64066 1.83661 -180.61388 392.50836
8985.0000 -184.57392 -181.69720 2.87672 1.79845 -181.27429 359.51168
8990.0000 -184.83881 -181.80482 3.03398 1.76939 -181.77714 336.69207
8995.0000 -185.16828 -181.92136 3.24692 1.75486 -182.02864 322.96361
9000.0000 -184.49719 -181.39112 3.10607 1.77962 -181.60010 345.18880
FREEZING PROCESS: loop number 37 T-loop= 328.00000000000000
main_MD> interactions number 37 at Temperature= 328.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.13523 1.43585 0.43697
force_rgl> df(natom) 3.15731 0.59488 -1.56221
9005.0000 -185.28922 -181.77898 3.51024 1.79870 -181.26999 360.03449
9010.0000 -185.58943 -182.11280 3.47663 1.73404 -182.38899 308.35559
9015.0000 -184.98375 -181.89586 3.08790 1.74571 -182.18698 316.77415
9020.0000 -185.27530 -182.32462 2.95068 1.73765 -182.32658 308.10839
9025.0000 -184.97896 -181.79171 3.18724 1.75891 -181.95849 327.07280
9030.0000 -185.45038 -181.80463 3.64575 1.75680 -181.99509 324.77117
9035.0000 -184.60473 -181.94771 2.65702 1.77526 -181.67552 339.17445
9040.0000 -184.71120 -181.15788 3.55332 1.78047 -181.58540 345.01231
9045.0000 -184.77152 -181.22476 3.54676 1.78128 -181.57145 344.68518
9050.0000 -184.78944 -181.77813 3.01131 1.77568 -181.66830 340.91014
9055.0000 -185.22349 -182.30211 2.92138 1.74386 -182.21895 311.84089
9060.0000 -185.26684 -182.56736 2.69948 1.74062 -182.27503 312.71551
9065.0000 -185.40621 -182.64510 2.76111 1.71961 -182.63871 289.11156
9070.0000 -184.94881 -181.78747 3.16134 1.75291 -182.06242 322.14630
9075.0000 -184.40506 -181.44872 2.95634 1.77569 -181.66817 341.51912
9080.0000 -185.59098 -182.38097 3.21001 1.76618 -181.83269 332.32972
9085.0000 -184.80242 -181.92396 2.87846 1.75809 -181.97269 325.36563
9090.0000 -184.73543 -181.44130 3.29413 1.77412 -181.69534 340.53653
9095.0000 -184.34794 -181.52062 2.82731 1.76097 -181.92283 329.93318
9100.0000 -185.24175 -182.05845 3.18331 1.75549 -182.01775 322.16341
9105.0000 -184.55863 -181.50719 3.05144 1.76370 -181.87572 330.02310
9110.0000 -185.01490 -181.86329 3.15161 1.77877 -181.61480 345.49580
9115.0000 -184.76689 -181.51320 3.25369 1.77710 -181.64373 343.35457
9120.0000 -184.29201 -181.09612 3.19589 1.79986 -181.24985 361.03237
9125.0000 -184.79964 -181.30287 3.49677 1.78346 -181.53374 340.67613
9130.0000 -185.01801 -181.95138 3.06663 1.75593 -182.01013 326.87443
9135.0000 -185.13558 -182.38596 2.74962 1.73990 -182.28762 311.02183
9140.0000 -185.26292 -182.58079 2.68213 1.74033 -182.28016 310.95082
9145.0000 -185.60143 -182.83896 2.76247 1.71681 -182.68720 290.73939
9150.0000 -185.09736 -182.33903 2.75832 1.71595 -182.70208 291.71130
9155.0000 -184.48937 -181.92642 2.56296 1.77379 -181.70111 339.15909
9160.0000 -184.44345 -181.05392 3.38953 1.79092 -181.40463 355.34719
9165.0000 -184.69877 -181.77877 2.92000 1.77099 -181.74955 338.35209
9170.0000 -185.02536 -182.18501 2.84035 1.74765 -182.15345 317.77803
9175.0000 -185.09730 -182.18235 2.91495 1.74822 -182.14355 319.56266
9180.0000 -185.02334 -182.28927 2.73407 1.74304 -182.23323 316.01028
9185.0000 -185.32755 -182.54515 2.78239 1.72884 -182.47894 301.02369
9190.0000 -184.90310 -182.36296 2.54014 1.74635 -182.17588 315.41188
9195.0000 -185.53607 -182.32124 3.21483 1.74078 -182.27227 315.94474
9200.0000 -185.46370 -182.23125 3.23245 1.75701 -181.99148 324.48408
9205.0000 -185.55393 -182.93893 2.61500 1.74688 -182.16673 315.29016
9210.0000 -185.22533 -182.57016 2.65518 1.71686 -182.68631 289.69108
9215.0000 -184.64650 -181.91663 2.72987 1.73411 -182.38777 304.14849
9220.0000 -185.01974 -182.14997 2.86977 1.75939 -181.95027 329.36327
9225.0000 -185.12461 -182.12382 3.00079 1.74536 -182.19301 316.12307
9230.0000 -185.20193 -182.63173 2.57020 1.73020 -182.45551 299.85393
9235.0000 -184.96169 -182.50827 2.45343 1.72956 -182.46649 301.85079
9240.0000 -185.38920 -182.55724 2.83196 1.72917 -182.47326 298.57426
9245.0000 -184.84566 -181.36414 3.48152 1.76167 -181.91083 327.36682
9250.0000 -184.72474 -181.92896 2.79578 1.77933 -181.60517 343.86028
FREEZING PROCESS: loop number 38 T-loop= 303.00000000000000
main_MD> interactions number 38 at Temperature= 303.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.42863 0.04040 2.54856
force_rgl> df(natom) 1.45378 -0.06061 -0.81594
9255.0000 -185.01126 -182.33381 2.67745 1.73343 -182.39958 304.23427
9260.0000 -184.93898 -182.08206 2.85693 1.73909 -182.30165 309.55340
9265.0000 -184.82202 -181.45797 3.36405 1.78271 -181.54659 348.67051
9270.0000 -185.12051 -182.42399 2.69652 1.75719 -181.98827 327.31758
9275.0000 -185.83684 -182.92031 2.91653 1.72778 -182.49733 299.80800
9280.0000 -185.59689 -183.21404 2.38285 1.69559 -183.05448 271.36256
9285.0000 -185.55860 -182.66044 2.89816 1.69609 -183.04576 272.87340
9290.0000 -185.45168 -182.53055 2.92114 1.72973 -182.46364 301.99503
9295.0000 -185.47460 -182.65489 2.81971 1.70409 -182.90740 278.58440
9300.0000 -185.42096 -182.70755 2.71341 1.72281 -182.58334 295.20756
9305.0000 -185.04525 -182.02602 3.01923 1.73067 -182.44724 299.47976
9310.0000 -185.20774 -182.50270 2.70504 1.73878 -182.30696 310.13168
9315.0000 -185.41446 -182.17786 3.23660 1.74210 -182.24943 311.96347
9320.0000 -185.24196 -182.52339 2.71857 1.73114 -182.43913 303.91466
9325.0000 -185.50270 -182.85865 2.64405 1.71914 -182.64677 294.67572
9330.0000 -185.47143 -182.16070 3.31073 1.71734 -182.67792 291.60628
9335.0000 -185.62699 -182.73915 2.88784 1.72743 -182.50332 301.62600
9340.0000 -185.52778 -182.58479 2.94299 1.71888 -182.65134 291.44448
9345.0000 -185.71584 -182.81582 2.90003 1.72767 -182.49926 300.45766
9350.0000 -185.86423 -183.28892 2.57532 1.70668 -182.86244 280.92052
9355.0000 -185.56581 -183.14580 2.42001 1.70681 -182.86022 280.49901
9360.0000 -185.77877 -182.92089 2.85788 1.70106 -182.95971 276.19190
9365.0000 -185.61290 -183.22221 2.39069 1.69834 -183.00677 272.92265
9370.0000 -185.20877 -182.62447 2.58430 1.69547 -183.05647 270.77491
9375.0000 -184.93497 -182.25423 2.68073 1.72512 -182.54344 297.71181
9380.0000 -185.46681 -182.67177 2.79504 1.73339 -182.40023 303.97517
9385.0000 -184.72497 -182.09743 2.62753 1.72643 -182.52062 299.30384
9390.0000 -185.07466 -182.09222 2.98244 1.75017 -182.10981 318.23950
9395.0000 -185.12572 -182.04115 3.08458 1.76522 -181.84940 331.08310
9400.0000 -185.22276 -182.59518 2.62757 1.73763 -182.32688 307.22935
9405.0000 -184.99837 -182.39733 2.60105 1.73502 -182.37204 305.79717
9410.0000 -185.43927 -182.57376 2.86551 1.74973 -182.11739 320.86158
9415.0000 -185.48754 -182.85832 2.62922 1.71549 -182.71005 289.64660
9420.0000 -185.33410 -182.29125 3.04285 1.71955 -182.63978 291.35760
9425.0000 -184.80369 -181.96647 2.83722 1.74499 -182.19941 316.57017
9430.0000 -185.13676 -181.93812 3.19864 1.73234 -182.41836 303.37581
9435.0000 -185.54043 -182.73124 2.80918 1.72318 -182.57702 296.59588
9440.0000 -185.02301 -182.29870 2.72432 1.73735 -182.33167 310.35886
9445.0000 -185.30709 -182.21950 3.08759 1.74186 -182.25363 314.01799
9450.0000 -185.64199 -182.80292 2.83907 1.71716 -182.68106 291.48686
9455.0000 -185.28444 -182.31760 2.96684 1.73590 -182.35685 308.23284
9460.0000 -185.94752 -183.04709 2.90043 1.71907 -182.64801 291.63128
9465.0000 -185.01236 -182.18308 2.82928 1.73353 -182.39788 303.51165
9470.0000 -185.23053 -182.43755 2.79298 1.74124 -182.26437 310.06896
9475.0000 -185.49851 -182.67057 2.82794 1.72264 -182.58623 295.41094
9480.0000 -185.80517 -182.83395 2.97122 1.70981 -182.80829 284.68954
9485.0000 -184.80614 -181.88329 2.92285 1.74096 -182.26924 311.61673
9490.0000 -185.42453 -182.80033 2.62420 1.73028 -182.45410 299.78979
9495.0000 -185.34603 -182.34552 3.00050 1.71543 -182.71104 290.04859
9500.0000 -185.55995 -182.25055 3.30940 1.71745 -182.67615 294.92134
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 13 [min], 57.8340087 [s].
main_MD> Deallocating global variables
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