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nanoparticlesims/growth_Melting_Silver_ICO_3269/freezeSims/run_31/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_31.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 = 31 ntipo2 = 0
read_input> Finish reading input
main_MD> Allocating global variables
main_MD> Number of outputs that will be created: 1550
main_MD> Size of nv and nvoiz: 31 3100
main_MD> Size of nv and nvoiz: 31 3100
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 = 31
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> -6.0590320555278028E-002 -3.5199944568482980E-002 8.1746636576367201E-002 initial drift of cluster / NP1 for coalescence
init> 0.28433047221157481 0.34739576719630089 0.25572087572783297 scaling for velocity /for coalescence NP1
init.f90 > facguy = 3.5234690818193113E-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) -8.72209 -2.56657 3.37200
force_rgl> df(natom) -4.61576 -3.34722 1.56572
preparo> THERMALIZATION PROCESS AT 1076.1325050771875
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -64.144426416151731 6.5337776167275186 -70.678204032879250 6.0690083163401508E-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 31
FREEZING PROCESS: loop number 1 T-loop= 1052.0000000000000
main_MD> interactions number 1 at Temperature= 1052.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 5.25462 2.52601 0.13765
force_rgl> df(natom) -2.43217 -1.66843 -3.41277
5.0000 -69.72509 -64.32747 5.39762 2.73411 -64.46910 1241.60482
10.0000 -68.87519 -64.66136 4.21383 2.75038 -64.30854 1276.19768
15.0000 -71.43802 -66.76551 4.67251 2.61954 -65.59963 1092.48622
20.0000 -71.20677 -66.51163 4.69514 2.54933 -66.29255 1019.64453
25.0000 -71.57045 -68.37578 3.19468 2.41786 -67.58988 957.06147
30.0000 -71.44248 -66.74711 4.69537 2.40780 -67.68914 966.86617
35.0000 -69.57988 -65.01079 4.56910 2.57509 -66.03834 1169.95205
40.0000 -71.03400 -67.61292 3.42107 2.50937 -66.68684 1134.33387
45.0000 -70.16576 -66.67390 3.49186 2.46081 -67.16603 979.79799
50.0000 -70.90768 -66.26869 4.63899 2.54093 -66.37536 1066.07352
55.0000 -72.57247 -67.02500 5.54747 2.48568 -66.92068 1006.10390
60.0000 -70.04214 -66.09134 3.95080 2.56810 -66.10733 1113.75520
65.0000 -70.10518 -66.13031 3.97487 2.54979 -66.28798 1097.03879
70.0000 -69.04681 -63.45468 5.59213 2.72798 -64.52950 1285.18216
75.0000 -69.61665 -64.82450 4.79215 2.71664 -64.64147 1294.32702
80.0000 -70.92866 -66.51436 4.41430 2.54943 -66.29154 1085.74331
85.0000 -69.78401 -65.06513 4.71888 2.58050 -65.98490 1158.49843
90.0000 -69.95477 -64.31501 5.63976 2.73339 -64.47619 1232.94826
95.0000 -68.59683 -64.35776 4.23907 2.78059 -64.01033 1300.42038
100.0000 -68.86124 -65.49217 3.36907 2.65356 -65.26393 1147.75276
105.0000 -71.50615 -67.51589 3.99026 2.56905 -66.09793 1052.24255
110.0000 -71.16649 -67.00999 4.15651 2.43567 -67.41411 1031.60862
115.0000 -71.21374 -67.65509 3.55866 2.43155 -67.45479 974.06282
120.0000 -72.80048 -67.42726 5.37322 2.41243 -67.64348 1000.51007
125.0000 -70.56516 -66.08624 4.47892 2.46079 -67.16625 1035.18928
130.0000 -70.94552 -66.10081 4.84471 2.48565 -66.92092 1028.21671
135.0000 -70.66661 -66.93274 3.73387 2.54080 -66.37672 1084.07657
140.0000 -71.17017 -65.83674 5.33344 2.50104 -66.76906 1067.51194
145.0000 -72.31479 -68.29455 4.02024 2.45214 -67.25163 1066.15429
150.0000 -71.49142 -67.60025 3.89117 2.32776 -68.47904 928.89359
155.0000 -69.93705 -65.50963 4.42742 2.50983 -66.68235 1029.29790
160.0000 -70.86239 -66.17367 4.68872 2.55338 -66.25257 1081.83986
165.0000 -71.65446 -67.42599 4.22847 2.46023 -67.17173 1038.24749
170.0000 -71.03261 -65.45148 5.58113 2.52268 -66.55550 1069.41477
175.0000 -70.75917 -67.40101 3.35816 2.55702 -66.21666 1131.79946
180.0000 -70.62359 -67.34014 3.28344 2.50436 -66.73626 1042.05491
185.0000 -70.58846 -66.51470 4.07376 2.49611 -66.81770 1054.65876
190.0000 -70.17519 -66.68394 3.49125 2.50412 -66.73871 1041.13250
195.0000 -71.49820 -67.63324 3.86496 2.47874 -66.98915 1018.76551
200.0000 -71.35154 -68.52572 2.82582 2.40517 -67.71509 927.43626
205.0000 -70.48125 -66.88801 3.59324 2.41886 -67.58003 967.67413
210.0000 -70.43915 -66.21983 4.21933 2.54747 -66.31089 1077.32840
215.0000 -70.05323 -66.40117 3.65206 2.58963 -65.89481 1098.00779
220.0000 -69.68468 -64.85057 4.83411 2.63424 -65.45458 1163.18901
225.0000 -70.48042 -66.23411 4.24631 2.65569 -65.24292 1197.09598
230.0000 -69.85518 -66.38488 3.47030 2.50810 -66.69944 1084.47916
235.0000 -72.13353 -67.38204 4.75149 2.48077 -66.96908 1015.87060
240.0000 -72.48902 -68.65556 3.83346 2.39159 -67.84913 1005.92916
245.0000 -71.35420 -67.65237 3.70183 2.41015 -67.66599 1009.52906
250.0000 -70.85077 -66.64215 4.20862 2.43271 -67.44332 978.43020
FREEZING PROCESS: loop number 2 T-loop= 1027.0000000000000
main_MD> interactions number 2 at Temperature= 1027.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.11876 -3.56435 0.19270
force_rgl> df(natom) -0.04997 -2.41609 -1.03708
255.0000 -69.32528 -65.85865 3.46663 2.58685 -65.92221 1151.00540
260.0000 -71.86720 -67.72566 4.14153 2.51201 -66.66082 1049.37848
265.0000 -71.45174 -68.21455 3.23719 2.31422 -68.61264 850.64074
270.0000 -71.68763 -67.73581 3.95181 2.41320 -67.63591 964.33674
275.0000 -71.56121 -67.64754 3.91368 2.42155 -67.55352 965.71896
280.0000 -71.39545 -67.99458 3.40087 2.37525 -68.01040 904.50902
285.0000 -71.82226 -67.11262 4.70964 2.42393 -67.53004 971.03381
290.0000 -71.10300 -67.09787 4.00513 2.45667 -67.20690 994.93914
295.0000 -72.47167 -68.88093 3.59074 2.39257 -67.83948 882.76446
300.0000 -72.27151 -68.40306 3.86844 2.36395 -68.12194 900.95721
305.0000 -71.66182 -67.66129 4.00053 2.44108 -67.36079 973.81273
310.0000 -72.03348 -68.17784 3.85565 2.42240 -67.54507 941.89931
315.0000 -71.32469 -66.84261 4.48208 2.38022 -67.96137 947.42521
320.0000 -70.40462 -66.21564 4.18898 2.55505 -66.23611 1131.18980
325.0000 -71.17241 -66.59874 4.57366 2.55744 -66.21253 1094.72731
330.0000 -70.79615 -66.89143 3.90471 2.51997 -66.58227 1085.28314
335.0000 -71.24614 -68.07507 3.17106 2.46011 -67.17292 980.19346
340.0000 -72.49979 -69.42801 3.07178 2.33756 -68.38228 908.29965
345.0000 -71.56667 -67.69851 3.86816 2.34040 -68.35431 911.78447
350.0000 -70.84423 -66.29325 4.55097 2.52668 -66.51601 1040.71413
355.0000 -70.08714 -66.82026 3.26688 2.53536 -66.43035 1024.92205
360.0000 -70.81955 -66.38355 4.43600 2.49029 -66.87513 1082.88041
365.0000 -70.99074 -66.58808 4.40266 2.53099 -66.47348 1154.10058
370.0000 -70.59762 -65.76022 4.83739 2.53153 -66.46818 1144.14239
375.0000 -70.22630 -65.80203 4.42428 2.56777 -66.11059 1084.16489
380.0000 -70.62424 -67.21062 3.41362 2.48524 -66.92502 1007.24971
385.0000 -72.10229 -67.85863 4.24365 2.43230 -67.44737 960.85942
390.0000 -70.94278 -66.23382 4.70896 2.40419 -67.72475 960.69893
395.0000 -71.55960 -66.88041 4.67920 2.59817 -65.81055 1152.72670
400.0000 -70.13667 -64.74533 5.39135 2.64005 -65.39730 1198.03063
405.0000 -69.75872 -66.20599 3.55273 2.71441 -64.66346 1284.01611
410.0000 -70.96064 -66.46356 4.49708 2.53616 -66.42249 1001.81744
415.0000 -71.50693 -67.35545 4.15148 2.47203 -67.05536 1014.32077
420.0000 -70.18105 -66.54820 3.63285 2.44296 -67.34225 985.58087
425.0000 -71.33894 -66.76575 4.57319 2.52158 -66.56638 1085.38681
430.0000 -69.19380 -64.90087 4.29293 2.64729 -65.32584 1116.92820
435.0000 -71.45246 -66.86499 4.58747 2.54773 -66.30831 1094.67681
440.0000 -71.00749 -67.51225 3.49524 2.43064 -67.46378 1010.49522
445.0000 -71.64299 -67.97939 3.66361 2.36751 -68.08675 995.92907
450.0000 -71.22887 -66.92992 4.29894 2.47532 -67.02282 997.83438
455.0000 -71.56626 -66.71623 4.85003 2.52541 -66.52861 1068.80696
460.0000 -70.71734 -66.11180 4.60554 2.48977 -66.88023 1017.83258
465.0000 -71.13259 -67.18199 3.95060 2.46809 -67.09418 1002.49848
470.0000 -72.37843 -68.45260 3.92583 2.41777 -67.59081 976.05002
475.0000 -71.15048 -67.05577 4.09472 2.41658 -67.60249 953.19446
480.0000 -71.44997 -66.74987 4.70010 2.48421 -66.93516 1018.19991
485.0000 -71.14434 -66.59128 4.55306 2.49961 -66.78314 1056.00187
490.0000 -70.31650 -66.88710 3.42939 2.52314 -66.55095 1080.69535
495.0000 -72.43382 -69.42208 3.01174 2.35626 -68.19776 922.34340
500.0000 -72.83490 -68.95522 3.87968 2.26176 -69.13036 840.07296
FREEZING PROCESS: loop number 3 T-loop= 1002.0000000000000
main_MD> interactions number 3 at Temperature= 1002.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.61911 0.66983 -0.26137
force_rgl> df(natom) 0.59337 -0.65789 1.97906
505.0000 -71.41598 -66.85964 4.55634 2.38355 -67.92843 955.40795
510.0000 -71.05510 -66.45985 4.59525 2.50039 -66.77549 1057.98872
515.0000 -70.42138 -66.26158 4.15980 2.49549 -66.82387 1065.73373
520.0000 -70.85860 -67.27898 3.57962 2.52391 -66.54338 1088.52800
525.0000 -71.15381 -66.66458 4.48923 2.50015 -66.77785 1042.86016
530.0000 -72.37789 -67.98288 4.39501 2.45759 -67.19787 1022.18692
535.0000 -72.81667 -68.26968 4.54698 2.38016 -67.96193 970.39556
540.0000 -71.60522 -67.21705 4.38817 2.44709 -67.30141 968.31516
545.0000 -70.74398 -66.73631 4.00767 2.43273 -67.44318 970.87454
550.0000 -70.63534 -66.78655 3.84879 2.54316 -66.35345 1103.76794
555.0000 -70.28352 -66.50660 3.77692 2.53687 -66.41544 1044.15498
560.0000 -71.35204 -65.50492 5.84712 2.55369 -66.24949 1040.66963
565.0000 -70.65487 -66.76701 3.88786 2.58721 -65.91873 1169.35516
570.0000 -71.14985 -66.13689 5.01296 2.50697 -66.71051 1105.57562
575.0000 -70.65830 -67.36397 3.29434 2.49794 -66.79961 1029.71646
580.0000 -71.82185 -66.99238 4.82947 2.47956 -66.98106 1010.66012
585.0000 -72.06539 -67.68036 4.38503 2.43307 -67.43981 1004.26171
590.0000 -72.56831 -68.86423 3.70408 2.33546 -68.40302 870.07676
595.0000 -72.17427 -67.74404 4.43024 2.32418 -68.51432 886.50022
600.0000 -72.31078 -68.21901 4.09177 2.32699 -68.48659 894.17199
605.0000 -72.76865 -69.41630 3.35235 2.32830 -68.47369 900.01825
610.0000 -72.26664 -68.44797 3.81867 2.26738 -69.07488 878.80082
615.0000 -72.02947 -67.51803 4.51143 2.33976 -68.36057 905.93045
620.0000 -70.64277 -66.46795 4.17481 2.50376 -66.74223 1045.57949
625.0000 -70.01045 -65.74656 4.26388 2.59896 -65.80277 1099.44492
630.0000 -69.20496 -65.91350 3.29146 2.62498 -65.54594 1111.19803
635.0000 -70.97752 -66.94847 4.02905 2.52522 -66.53047 1067.66271
640.0000 -71.10378 -67.73265 3.37113 2.44177 -67.35396 984.31733
645.0000 -70.45167 -66.96533 3.48634 2.43153 -67.45502 992.60904
650.0000 -71.32454 -66.37869 4.94584 2.48458 -66.93146 1032.75349
655.0000 -71.05628 -66.09869 4.95759 2.54575 -66.32786 1096.69729
660.0000 -71.13617 -66.66397 4.47220 2.50796 -66.70075 1039.59820
665.0000 -72.52674 -68.41616 4.11058 2.39584 -67.80720 935.44772
670.0000 -71.66923 -67.32022 4.34902 2.44210 -67.35073 972.85871
675.0000 -70.95992 -66.33155 4.62837 2.42934 -67.47656 1001.47436
680.0000 -70.77677 -66.38948 4.38730 2.52808 -66.50217 1037.87986
685.0000 -70.87395 -66.44843 4.42553 2.66208 -65.17986 1160.10502
690.0000 -71.16692 -67.25044 3.91648 2.47083 -67.06721 1014.28993
695.0000 -70.97183 -67.07755 3.89428 2.45010 -67.27178 1035.30900
700.0000 -70.72251 -65.88650 4.83601 2.52008 -66.58119 1061.71737
705.0000 -71.73947 -68.02661 3.71286 2.43917 -67.37965 1001.68065
710.0000 -70.69683 -66.95331 3.74351 2.44330 -67.33880 990.85956
715.0000 -70.62280 -66.90497 3.71782 2.50838 -66.69659 1087.77028
720.0000 -70.17663 -66.84503 3.33160 2.44732 -67.29915 992.02802
725.0000 -71.67506 -67.00615 4.66891 2.44955 -67.27719 1008.25519
730.0000 -71.95879 -67.93180 4.02699 2.46548 -67.11996 1021.21333
735.0000 -72.19117 -68.27789 3.91328 2.43541 -67.41674 1010.20453
740.0000 -70.46859 -67.92236 2.54623 2.33004 -68.45654 905.39152
745.0000 -70.55247 -66.12546 4.42700 2.42289 -67.54025 957.26317
750.0000 -72.00969 -66.81872 5.19097 2.51947 -66.58717 1079.24100
FREEZING PROCESS: loop number 4 T-loop= 977.00000000000000
main_MD> interactions number 4 at Temperature= 977.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.18704 -1.67122 0.37173
force_rgl> df(natom) -3.78808 -4.55780 3.79722
755.0000 -70.81490 -67.10594 3.70896 2.43078 -67.46243 1004.50728
760.0000 -71.19341 -66.85858 4.33484 2.48422 -66.93501 1046.96746
765.0000 -72.03023 -67.25038 4.77986 2.47501 -67.02593 1012.36205
770.0000 -71.43866 -67.16851 4.27015 2.41545 -67.61368 970.72206
775.0000 -71.16633 -66.19198 4.97435 2.45012 -67.27153 1020.65030
780.0000 -70.47184 -66.14987 4.32198 2.54962 -66.28969 1094.44007
785.0000 -73.18802 -69.41055 3.77746 2.38612 -67.90312 967.66662
790.0000 -71.99412 -68.30532 3.68880 2.26307 -69.11736 869.99906
795.0000 -72.23297 -67.32586 4.90711 2.42788 -67.49100 1003.57692
800.0000 -71.07176 -66.62858 4.44319 2.47875 -66.98901 1081.39615
805.0000 -69.67252 -65.43663 4.23589 2.57770 -66.01251 1114.92705
810.0000 -71.07638 -66.87343 4.20295 2.55696 -66.21722 1192.95167
815.0000 -71.57125 -67.87622 3.69503 2.39118 -67.85322 974.87256
820.0000 -71.58132 -68.68377 2.89755 2.36581 -68.10353 926.67888
825.0000 -72.06003 -68.62436 3.43567 2.33712 -68.38665 878.99384
830.0000 -71.94016 -68.58526 3.35491 2.32610 -68.49540 911.86482
835.0000 -72.32926 -68.43994 3.88932 2.27825 -68.96762 846.14972
840.0000 -72.88224 -69.68084 3.20140 2.28899 -68.86163 917.06708
845.0000 -72.44966 -68.12541 4.32425 2.39515 -67.81400 922.07108
850.0000 -72.31862 -69.02445 3.29417 2.35321 -68.22785 951.12671
855.0000 -72.64819 -68.88784 3.76035 2.21464 -69.59530 812.16680
860.0000 -71.51004 -67.55274 3.95730 2.29229 -68.82905 830.21732
865.0000 -71.17072 -67.90222 3.26850 2.38986 -67.86619 993.72014
870.0000 -71.94272 -68.38213 3.56059 2.32376 -68.51849 882.11493
875.0000 -70.61867 -67.07627 3.54240 2.34368 -68.32198 892.05181
880.0000 -70.48882 -66.01029 4.47853 2.45582 -67.21529 991.53837
885.0000 -71.20098 -67.89398 3.30700 2.44556 -67.31651 997.96060
890.0000 -72.08153 -67.93546 4.14607 2.38366 -67.92743 953.91532
895.0000 -70.57865 -67.03990 3.53875 2.37364 -68.02627 964.14012
900.0000 -71.21430 -66.93503 4.27926 2.46032 -67.17091 1032.68902
905.0000 -72.51676 -68.65174 3.86502 2.38989 -67.86594 974.47790
910.0000 -71.66615 -68.37234 3.29381 2.33568 -68.40085 852.15873
915.0000 -71.87502 -67.73852 4.13650 2.41129 -67.65475 946.28529
920.0000 -71.44132 -67.29756 4.14376 2.43662 -67.40476 968.99648
925.0000 -71.76455 -67.72391 4.04064 2.43523 -67.41853 967.64819
930.0000 -71.87091 -67.54852 4.32239 2.34203 -68.33820 890.27759
935.0000 -70.97229 -67.17134 3.80095 2.43715 -67.39952 972.92159
940.0000 -72.36348 -68.12891 4.23458 2.39621 -67.80350 916.31224
945.0000 -71.36768 -67.53300 3.83469 2.35509 -68.20938 917.53440
950.0000 -71.84042 -68.66566 3.17476 2.34613 -68.29772 906.65970
955.0000 -71.70352 -68.60578 3.09774 2.30523 -68.70137 840.34841
960.0000 -71.79020 -68.44932 3.34088 2.42132 -67.55574 1006.14335
965.0000 -72.33010 -68.80228 3.52782 2.27895 -68.96071 874.43067
970.0000 -72.52974 -68.21295 4.31679 2.34284 -68.33019 889.84454
975.0000 -71.12583 -67.07349 4.05234 2.37831 -67.98018 941.47838
980.0000 -71.74698 -67.10851 4.63847 2.50200 -66.75956 1072.75667
985.0000 -71.28969 -67.39338 3.89631 2.42066 -67.56229 1000.71391
990.0000 -72.01649 -67.21238 4.80411 2.47411 -67.03484 1031.77965
995.0000 -72.27501 -68.14291 4.13211 2.43711 -67.39990 949.07279
1000.0000 -71.78187 -68.26085 3.52102 2.37868 -67.97656 937.52901
FREEZING PROCESS: loop number 5 T-loop= 952.00000000000000
main_MD> interactions number 5 at Temperature= 952.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.72771 0.20279 0.76083
force_rgl> df(natom) -0.71038 3.99497 -0.22855
1005.0000 -70.60397 -66.34615 4.25782 2.43414 -67.42922 953.29631
1010.0000 -72.20885 -67.66855 4.54029 2.50061 -66.77326 1054.49690
1015.0000 -71.29689 -67.61377 3.68312 2.33063 -68.45069 917.44123
1020.0000 -71.81318 -67.18700 4.62618 2.41647 -67.60362 982.55269
1025.0000 -72.08752 -68.37297 3.71454 2.33852 -68.37287 878.23040
1030.0000 -72.21069 -68.48910 3.72158 2.33352 -68.42222 874.92412
1035.0000 -72.38690 -68.31135 4.07555 2.28528 -68.89819 873.34861
1040.0000 -71.81094 -67.90582 3.90512 2.33398 -68.41765 898.38941
1045.0000 -69.84153 -66.21936 3.62218 2.54135 -66.37124 1089.59154
1050.0000 -71.27794 -67.02476 4.25317 2.47076 -67.06785 1024.40370
1055.0000 -71.14232 -66.65514 4.48717 2.50946 -66.68592 1027.30191
1060.0000 -72.57028 -68.53794 4.03233 2.42422 -67.52714 932.01209
1065.0000 -71.82401 -67.79616 4.02785 2.40966 -67.67077 983.11312
1070.0000 -72.10615 -68.88748 3.21868 2.33880 -68.37009 911.73160
1075.0000 -72.17559 -68.26339 3.91221 2.32112 -68.54457 886.66447
1080.0000 -71.90522 -68.35388 3.55134 2.34350 -68.32371 919.56758
1085.0000 -71.37044 -67.67728 3.69316 2.41545 -67.61365 1010.25388
1090.0000 -70.93839 -67.13710 3.80129 2.43301 -67.44043 1026.15937
1095.0000 -71.73106 -68.35258 3.37848 2.34768 -68.28242 924.04492
1100.0000 -72.10981 -68.29616 3.81366 2.35029 -68.25669 962.52605
1105.0000 -70.79452 -67.17655 3.61797 2.41101 -67.65750 979.48065
1110.0000 -72.87238 -68.90465 3.96773 2.33777 -68.38025 915.42302
1115.0000 -71.65321 -68.14710 3.50611 2.30405 -68.71299 848.05946
1120.0000 -70.15815 -66.43760 3.72055 2.44691 -67.30321 964.87375
1125.0000 -70.43309 -65.36271 5.07038 2.57132 -66.07553 1094.86190
1130.0000 -70.04901 -66.50218 3.54682 2.55501 -66.23649 1103.22224
1135.0000 -70.80206 -66.56606 4.23600 2.57125 -66.07621 1142.93920
1140.0000 -71.55415 -67.87662 3.67753 2.51212 -66.65976 1041.53621
1145.0000 -72.02580 -68.51720 3.50860 2.31725 -68.58273 911.11148
1150.0000 -72.81038 -67.18957 5.62081 2.35239 -68.23593 935.95507
1155.0000 -72.91729 -69.45916 3.45813 2.33630 -68.39476 900.40896
1160.0000 -72.06781 -68.75547 3.31234 2.35522 -68.20809 893.95399
1165.0000 -71.14806 -67.06036 4.08770 2.35091 -68.25054 865.31172
1170.0000 -70.88034 -67.63022 3.25011 2.44426 -67.32942 989.54915
1175.0000 -72.18500 -67.94450 4.24049 2.48303 -66.94680 1058.23163
1180.0000 -72.70377 -69.56864 3.13514 2.30936 -68.66065 895.77705
1185.0000 -72.36288 -68.03707 4.32581 2.34867 -68.27267 938.14506
1190.0000 -72.00348 -68.08968 3.91380 2.33208 -68.43644 943.34508
1195.0000 -72.85261 -68.36478 4.48783 2.33066 -68.45042 940.44261
1200.0000 -71.25563 -68.39493 2.86071 2.30066 -68.74644 906.00045
1205.0000 -71.22037 -67.25263 3.96774 2.38403 -67.92375 937.39171
1210.0000 -70.55713 -66.91958 3.63756 2.46449 -67.12972 1011.45442
1215.0000 -69.65526 -65.32907 4.32618 2.55151 -66.27098 1034.09297
1220.0000 -71.90133 -66.61567 5.28566 2.55283 -66.25802 1098.83702
1225.0000 -71.28645 -66.29375 4.99270 2.48755 -66.90214 993.56980
1230.0000 -69.98718 -66.15108 3.83609 2.49087 -66.86944 967.57332
1235.0000 -70.99574 -66.44589 4.54985 2.51357 -66.64540 1026.70457
1240.0000 -71.70091 -67.84779 3.85312 2.35752 -68.18537 912.89555
1245.0000 -71.71989 -68.41460 3.30528 2.34347 -68.32399 880.32622
1250.0000 -73.28472 -69.38328 3.90145 2.28082 -68.94230 818.81627
FREEZING PROCESS: loop number 6 T-loop= 927.00000000000000
main_MD> interactions number 6 at Temperature= 927.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.12583 -2.21046 -0.19078
force_rgl> df(natom) -3.66113 -0.84115 1.26852
1255.0000 -71.35672 -68.33235 3.02436 2.32372 -68.51894 897.13041
1260.0000 -71.69932 -67.46447 4.23485 2.31715 -68.58376 838.09676
1265.0000 -71.27378 -67.87115 3.40264 2.41916 -67.57707 994.69982
1270.0000 -71.71144 -67.19780 4.51364 2.43163 -67.45405 954.38724
1275.0000 -72.36024 -69.28498 3.07526 2.35353 -68.22471 927.38936
1280.0000 -70.95807 -67.02101 3.93706 2.34311 -68.32753 871.04524
1285.0000 -71.54033 -67.26737 4.27296 2.45414 -67.23191 1042.15876
1290.0000 -72.17947 -67.86602 4.31345 2.38524 -67.91180 947.35887
1295.0000 -70.87163 -66.57875 4.29288 2.41206 -67.64717 971.33871
1300.0000 -72.10942 -68.86228 3.24714 2.44562 -67.31593 1043.60322
1305.0000 -72.32415 -68.60026 3.72389 2.36756 -68.08625 927.49037
1310.0000 -71.36461 -67.45477 3.90984 2.38263 -67.93756 953.15870
1315.0000 -70.17704 -66.96359 3.21344 2.41544 -67.61376 971.70792
1320.0000 -70.66692 -67.31675 3.35017 2.49321 -66.84633 1053.50085
1325.0000 -71.43877 -66.32704 5.11173 2.48853 -66.89252 1040.70887
1330.0000 -71.93207 -68.71571 3.21635 2.40774 -67.68980 991.10577
1335.0000 -71.87876 -68.11073 3.76802 2.28645 -68.88671 823.52918
1340.0000 -72.70210 -68.98353 3.71857 2.33374 -68.41999 917.47543
1345.0000 -72.90202 -68.76309 4.13893 2.32104 -68.54531 935.56990
1350.0000 -73.35424 -69.69387 3.66037 2.20074 -69.73249 812.25661
1355.0000 -72.12310 -68.34882 3.77428 2.24746 -69.27145 868.84744
1360.0000 -72.41773 -68.25863 4.15909 2.41607 -67.60756 963.51984
1365.0000 -72.05125 -69.09352 2.95772 2.39819 -67.78399 965.82158
1370.0000 -71.37149 -67.45011 3.92138 2.32756 -68.48101 818.41889
1375.0000 -72.03834 -69.12763 2.91071 2.31450 -68.60986 890.42692
1380.0000 -72.57758 -69.08724 3.49035 2.25422 -69.20470 838.51070
1385.0000 -72.18256 -69.42818 2.75438 2.28246 -68.92611 925.77392
1390.0000 -72.29968 -68.81919 3.48048 2.26837 -69.06511 823.25332
1395.0000 -71.76408 -68.40997 3.35411 2.27048 -69.04428 872.56263
1400.0000 -72.02162 -67.71747 4.30415 2.38071 -67.95654 959.31397
1405.0000 -72.13045 -68.65012 3.48033 2.36182 -68.14289 926.18488
1410.0000 -71.58656 -67.84640 3.74016 2.36187 -68.14243 953.08860
1415.0000 -70.89134 -66.46428 4.42706 2.49939 -66.78529 1035.95671
1420.0000 -70.58540 -67.19849 3.38691 2.48163 -66.96059 1012.49528
1425.0000 -71.95351 -67.98304 3.97046 2.42739 -67.49586 941.80047
1430.0000 -70.98973 -67.24865 3.74108 2.42247 -67.54436 929.81400
1435.0000 -72.49481 -67.43199 5.06282 2.40688 -67.69825 995.44916
1440.0000 -71.01358 -66.62934 4.38424 2.47653 -67.01095 1063.13310
1445.0000 -71.83215 -68.17693 3.65522 2.39815 -67.78436 920.19770
1450.0000 -71.36947 -68.00687 3.36260 2.40174 -67.74902 952.15874
1455.0000 -72.79682 -69.28627 3.51054 2.32099 -68.54585 866.65206
1460.0000 -72.77319 -68.75746 4.01573 2.23225 -69.42153 799.91701
1465.0000 -71.30099 -67.61506 3.68592 2.40333 -67.73330 999.17266
1470.0000 -72.00847 -67.09969 4.90877 2.50914 -66.68915 1077.14268
1475.0000 -72.94455 -69.51024 3.43432 2.35293 -68.23064 930.29928
1480.0000 -70.84166 -66.98063 3.86103 2.37093 -68.05297 911.66518
1485.0000 -71.48099 -67.56332 3.91767 2.40025 -67.76371 949.73351
1490.0000 -71.25761 -67.01199 4.24562 2.49750 -66.80398 1071.08336
1495.0000 -72.27426 -68.70833 3.56594 2.41869 -67.58174 957.79868
1500.0000 -71.55151 -66.58140 4.97011 2.46756 -67.09949 1013.14291
FREEZING PROCESS: loop number 7 T-loop= 902.00000000000000
main_MD> interactions number 7 at Temperature= 902.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.19884 1.76772 -4.53049
force_rgl> df(natom) 2.27027 -5.08245 3.21707
1505.0000 -71.68580 -68.06327 3.62253 2.45345 -67.23864 996.48466
1510.0000 -71.19375 -68.26611 2.92764 2.38025 -67.96104 931.13970
1515.0000 -72.42286 -68.63979 3.78307 2.35404 -68.21974 856.33782
1520.0000 -72.67600 -68.79176 3.88423 2.30876 -68.66649 833.16080
1525.0000 -71.99626 -68.43491 3.56135 2.33178 -68.43932 843.95961
1530.0000 -72.07790 -68.17199 3.90592 2.32088 -68.54693 850.22246
1535.0000 -72.14484 -67.87915 4.26569 2.37494 -68.01343 963.48017
1540.0000 -72.75490 -68.61005 4.14486 2.32248 -68.53118 851.15498
1545.0000 -72.55949 -69.42303 3.13645 2.27578 -68.99193 859.54349
1550.0000 -71.74577 -68.00130 3.74446 2.24665 -69.27940 854.14416
1555.0000 -72.34808 -68.77852 3.56956 2.31338 -68.62096 933.23743
1560.0000 -71.63234 -67.60849 4.02385 2.41443 -67.62372 972.42510
1565.0000 -71.57730 -67.91599 3.66132 2.39188 -67.84626 911.15070
1570.0000 -72.72900 -69.19719 3.53181 2.33339 -68.42348 864.82259
1575.0000 -72.72819 -69.03754 3.69065 2.22653 -69.47800 773.61809
1580.0000 -72.44824 -67.99527 4.45297 2.28059 -68.94455 908.25046
1585.0000 -72.06810 -67.27316 4.79494 2.40787 -67.68849 972.33820
1590.0000 -71.23966 -68.03492 3.20474 2.44912 -67.28141 1025.85489
1595.0000 -72.47989 -68.65728 3.82261 2.34227 -68.33589 942.64572
1600.0000 -71.65207 -67.48813 4.16394 2.30956 -68.65860 928.65828
1605.0000 -71.89810 -67.54525 4.35284 2.42153 -67.55367 964.43855
1610.0000 -71.47532 -67.86860 3.60672 2.40696 -67.69746 938.20764
1615.0000 -71.68776 -67.96621 3.72155 2.38804 -67.88417 971.39274
1620.0000 -71.53904 -68.24830 3.29074 2.37944 -67.96907 920.68553
1625.0000 -71.64128 -68.07157 3.56971 2.33802 -68.37776 861.00887
1630.0000 -71.60081 -67.58237 4.01844 2.36359 -68.12542 889.58062
1635.0000 -71.69048 -68.20950 3.48098 2.38451 -67.91900 948.11286
1640.0000 -72.19878 -68.35493 3.84386 2.31406 -68.61419 875.57471
1645.0000 -71.71884 -67.95577 3.76307 2.35692 -68.19128 893.70012
1650.0000 -72.15639 -68.98413 3.17226 2.31135 -68.64097 852.17072
1655.0000 -72.38001 -68.84845 3.53156 2.28429 -68.90797 849.68006
1660.0000 -71.81545 -69.03440 2.78105 2.35555 -68.20483 911.97306
1665.0000 -71.66119 -68.54493 3.11626 2.28100 -68.94046 795.14278
1670.0000 -72.69643 -69.26737 3.42905 2.31728 -68.58241 892.00796
1675.0000 -72.80529 -69.49976 3.30553 2.30162 -68.73695 879.72909
1680.0000 -72.13603 -68.07475 4.06128 2.32860 -68.47076 869.69029
1685.0000 -72.78111 -69.48977 3.29135 2.27668 -68.98309 856.18103
1690.0000 -72.09339 -68.76502 3.32837 2.24690 -69.27703 829.44993
1695.0000 -72.22122 -69.06707 3.15415 2.26856 -69.06324 855.74434
1700.0000 -72.29368 -69.31390 2.97978 2.28157 -68.93480 873.40150
1705.0000 -71.24585 -68.07869 3.16716 2.33577 -68.40000 901.68518
1710.0000 -71.29473 -67.54405 3.75068 2.35239 -68.23597 926.06140
1715.0000 -71.35609 -67.65465 3.70144 2.44230 -67.34873 961.38856
1720.0000 -71.37639 -67.71701 3.65938 2.45628 -67.21071 1020.64116
1725.0000 -71.05394 -67.46701 3.58693 2.41470 -67.62104 941.16562
1730.0000 -72.36331 -67.99435 4.36896 2.40238 -67.74265 967.84018
1735.0000 -71.72758 -68.14931 3.57828 2.37927 -67.97071 1004.03329
1740.0000 -72.87914 -69.05688 3.82226 2.29319 -68.82016 851.85979
1745.0000 -72.22041 -69.42478 2.79563 2.28292 -68.92148 864.43282
1750.0000 -72.36930 -67.68844 4.68086 2.32412 -68.51498 903.12339
FREEZING PROCESS: loop number 8 T-loop= 877.00000000000000
main_MD> interactions number 8 at Temperature= 877.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.66079 -2.67462 -2.33725
force_rgl> df(natom) -0.50285 4.30695 -2.41297
1755.0000 -71.49254 -67.84988 3.64265 2.43015 -67.46864 950.96197
1760.0000 -73.27416 -68.27753 4.99663 2.37176 -68.04481 946.23037
1765.0000 -72.59934 -69.05626 3.54307 2.29810 -68.77170 883.38474
1770.0000 -71.73345 -68.67910 3.05435 2.33911 -68.36704 856.11219
1775.0000 -71.91465 -68.47762 3.43703 2.36147 -68.14634 953.55308
1780.0000 -71.81096 -67.89397 3.91699 2.32646 -68.49189 927.85044
1785.0000 -71.96160 -68.63884 3.32276 2.29737 -68.77891 914.77067
1790.0000 -73.59919 -70.23733 3.36187 2.24052 -69.33996 793.28744
1795.0000 -72.86336 -68.90078 3.96258 2.22920 -69.45164 809.95718
1800.0000 -71.59221 -67.64718 3.94503 2.34231 -68.33545 895.96044
1805.0000 -71.22955 -67.43056 3.79899 2.35438 -68.21630 920.07883
1810.0000 -72.01462 -68.30994 3.70468 2.34324 -68.32623 958.54160
1815.0000 -71.89044 -69.05982 2.83062 2.30717 -68.68225 833.43371
1820.0000 -71.82404 -67.40293 4.42110 2.36809 -68.08101 931.69099
1825.0000 -72.04713 -68.50543 3.54170 2.37429 -68.01985 937.43019
1830.0000 -71.88650 -67.98767 3.89883 2.32290 -68.52697 897.56832
1835.0000 -73.55068 -69.76938 3.78130 2.32541 -68.50225 923.91028
1840.0000 -72.74568 -69.50578 3.23991 2.21055 -69.63571 776.22527
1845.0000 -72.04113 -68.59636 3.44477 2.21295 -69.61201 796.43902
1850.0000 -72.69676 -68.96657 3.73019 2.25792 -69.16828 803.25085
1855.0000 -72.55269 -68.81644 3.73625 2.26740 -69.07473 854.92722
1860.0000 -72.87177 -69.61700 3.25477 2.23625 -69.38212 868.09610
1865.0000 -73.33342 -69.83391 3.49951 2.22086 -69.53392 781.25513
1870.0000 -72.84400 -68.83874 4.00525 2.28031 -68.94724 890.43879
1875.0000 -72.77336 -69.69223 3.08113 2.27622 -68.98767 861.92224
1880.0000 -72.31017 -68.83374 3.47642 2.27428 -69.00677 832.39982
1885.0000 -72.35025 -68.20910 4.14115 2.25951 -69.15256 903.79006
1890.0000 -72.44610 -69.05893 3.38717 2.28544 -68.89663 835.32752
1895.0000 -73.44988 -69.02179 4.42809 2.27160 -69.03320 857.18675
1900.0000 -72.47779 -69.08962 3.38816 2.22147 -69.52793 814.85340
1905.0000 -71.99915 -68.82027 3.17888 2.27445 -69.00511 864.50879
1910.0000 -72.73323 -69.65704 3.07619 2.22894 -69.45419 821.20438
1915.0000 -71.87649 -68.78370 3.09279 2.20575 -69.68304 778.15008
1920.0000 -71.14346 -67.12526 4.01820 2.37143 -68.04812 893.97114
1925.0000 -72.31033 -67.71620 4.59413 2.41133 -67.65429 1017.55247
1930.0000 -72.69523 -68.72463 3.97060 2.43176 -67.45273 985.85625
1935.0000 -73.47161 -70.78760 2.68401 2.23210 -69.42306 835.34932
1940.0000 -71.99257 -68.57615 3.41642 2.15198 -70.21370 738.91284
1945.0000 -71.67980 -67.84967 3.83013 2.40919 -67.67549 959.32551
1950.0000 -70.59366 -67.40750 3.18615 2.42775 -67.49226 940.91766
1955.0000 -71.98928 -68.54973 3.43955 2.35207 -68.23915 915.03042
1960.0000 -72.56348 -69.61845 2.94502 2.24181 -69.32725 799.71029
1965.0000 -71.77300 -68.09757 3.67544 2.29081 -68.84365 859.21101
1970.0000 -71.69525 -66.81093 4.88432 2.37771 -67.98615 892.93402
1975.0000 -71.70216 -67.74304 3.95912 2.41070 -67.66058 926.80275
1980.0000 -71.94964 -67.34300 4.60664 2.44759 -67.29656 1036.65617
1985.0000 -72.04224 -68.50256 3.53969 2.43147 -67.45555 961.10363
1990.0000 -72.60629 -69.70036 2.90593 2.22400 -69.50295 799.94491
1995.0000 -73.13565 -69.48587 3.64978 2.18176 -69.91982 761.11663
2000.0000 -72.43557 -69.19087 3.24470 2.28336 -68.91719 883.28820
FREEZING PROCESS: loop number 9 T-loop= 852.00000000000000
main_MD> interactions number 9 at Temperature= 852.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.37537 4.71134 -0.13248
force_rgl> df(natom) 1.60981 2.59984 -0.32617
2005.0000 -72.43883 -69.55863 2.88020 2.24599 -69.28593 811.09586
2010.0000 -72.39055 -68.92062 3.46993 2.22287 -69.51414 770.15031
2015.0000 -72.09208 -69.26793 2.82415 2.28355 -68.91527 867.19259
2020.0000 -73.29055 -69.94833 3.34222 2.16497 -70.08548 725.72125
2025.0000 -72.40958 -69.33301 3.07657 2.19106 -69.82806 782.25595
2030.0000 -73.76669 -70.37284 3.39385 2.20378 -69.70251 821.61147
2035.0000 -72.80427 -69.26494 3.53934 2.21910 -69.55135 815.31179
2040.0000 -72.89869 -70.63131 2.26739 2.22015 -69.54092 791.36293
2045.0000 -72.79374 -69.23837 3.55537 2.21049 -69.63628 809.66046
2050.0000 -71.59046 -68.65840 2.93206 2.22793 -69.46417 802.17734
2055.0000 -72.76926 -69.25119 3.51806 2.29218 -68.83017 889.72516
2060.0000 -72.88554 -69.22099 3.66455 2.22189 -69.52382 807.15495
2065.0000 -73.04174 -69.19065 3.85109 2.27446 -69.00504 869.59736
2070.0000 -72.07467 -68.96745 3.10722 2.25093 -69.23717 819.00852
2075.0000 -72.20138 -68.99197 3.20941 2.29088 -68.84301 858.14842
2080.0000 -72.09262 -69.19815 2.89447 2.29360 -68.81616 907.98170
2085.0000 -72.80615 -69.97859 2.82756 2.18474 -69.89039 781.36176
2090.0000 -72.55515 -68.52944 4.02571 2.27075 -69.04159 840.89843
2095.0000 -72.62069 -69.08660 3.53409 2.29936 -68.75928 867.34163
2100.0000 -72.39950 -69.49650 2.90301 2.18432 -69.89452 766.90341
2105.0000 -72.50751 -68.98596 3.52154 2.22997 -69.44401 859.87260
2110.0000 -72.47769 -69.14829 3.32941 2.22017 -69.54074 801.31699
2115.0000 -73.62834 -70.30114 3.32721 2.23957 -69.34932 829.43223
2120.0000 -72.99944 -69.57475 3.42468 2.21094 -69.63181 773.63102
2125.0000 -73.16763 -69.95448 3.21315 2.20379 -69.70242 759.16694
2130.0000 -71.40222 -67.99782 3.40440 2.28826 -68.86885 844.47660
2135.0000 -72.18227 -67.86460 4.31768 2.35414 -68.21867 919.88408
2140.0000 -72.72098 -68.83589 3.88509 2.38882 -67.87647 969.16947
2145.0000 -72.78033 -69.09877 3.68157 2.30504 -68.70322 867.71645
2150.0000 -71.69448 -68.01343 3.68105 2.31966 -68.55901 882.57167
2155.0000 -71.59818 -66.85807 4.74010 2.43515 -67.41923 960.17579
2160.0000 -70.91936 -66.32178 4.59758 2.51374 -66.64372 1045.92429
2165.0000 -70.84431 -66.83579 4.00852 2.53803 -66.40399 1041.42530
2170.0000 -72.60640 -68.63737 3.96903 2.35715 -68.18897 938.61761
2175.0000 -72.14715 -68.50329 3.64386 2.31944 -68.56117 909.57751
2180.0000 -72.51655 -68.83713 3.67943 2.41172 -67.65047 990.78238
2185.0000 -72.41305 -69.38634 3.02671 2.28892 -68.86227 865.84933
2190.0000 -71.85402 -68.25108 3.60294 2.26020 -69.14577 863.66277
2195.0000 -72.43927 -68.75938 3.67989 2.33253 -68.43195 887.09530
2200.0000 -71.37497 -67.62338 3.75159 2.38670 -67.89739 941.04839
2205.0000 -71.72798 -67.51061 4.21737 2.43396 -67.43099 973.93620
2210.0000 -72.29320 -68.32739 3.96580 2.40120 -67.75427 954.17791
2215.0000 -72.63615 -69.60212 3.03403 2.32421 -68.51407 883.58513
2220.0000 -73.09044 -70.35554 2.73490 2.20343 -69.70593 815.70939
2225.0000 -72.88245 -69.76685 3.11560 2.13557 -70.37560 719.82001
2230.0000 -71.46129 -68.46330 2.99798 2.29346 -68.81747 906.66484
2235.0000 -71.95430 -68.61294 3.34136 2.29636 -68.78887 852.26860
2240.0000 -71.97813 -67.92840 4.04973 2.35244 -68.23553 917.24118
2245.0000 -71.81868 -68.04551 3.77317 2.38383 -67.92567 946.57028
2250.0000 -72.22647 -68.54091 3.68556 2.32472 -68.50900 922.00754
FREEZING PROCESS: loop number 10 T-loop= 827.00000000000000
main_MD> interactions number 10 at Temperature= 827.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.48317 0.75241 -9.52147
force_rgl> df(natom) 2.04089 -0.85980 -7.27446
2255.0000 -72.10953 -69.64019 2.46934 2.27043 -69.04476 832.48823
2260.0000 -72.91253 -69.79972 3.11281 2.26178 -69.13019 852.47655
2265.0000 -72.98214 -69.94290 3.03924 2.12794 -70.45094 719.64247
2270.0000 -72.11286 -68.93974 3.17312 2.19987 -69.74106 807.99431
2275.0000 -71.36148 -68.10741 3.25407 2.28376 -68.91321 877.46245
2280.0000 -72.02580 -68.54296 3.48284 2.40931 -67.67429 937.88907
2285.0000 -72.35351 -68.66484 3.68867 2.30412 -68.71227 901.12068
2290.0000 -71.46373 -68.23315 3.23058 2.34005 -68.35779 894.91504
2295.0000 -71.86706 -68.17329 3.69377 2.38045 -67.95909 925.40664
2300.0000 -72.72940 -69.01592 3.71349 2.27004 -69.04867 862.03348
2305.0000 -73.58917 -69.60461 3.98456 2.24946 -69.25167 791.43449
2310.0000 -73.12953 -70.10837 3.02116 2.19643 -69.77502 739.19797
2315.0000 -72.89484 -69.69514 3.19970 2.19119 -69.82676 783.60373
2320.0000 -73.45164 -70.30998 3.14165 2.19038 -69.83475 785.07778
2325.0000 -73.24864 -69.60340 3.64524 2.16908 -70.04488 764.44108
2330.0000 -72.46804 -69.39011 3.07793 2.21805 -69.56169 766.35438
2335.0000 -72.50107 -69.38237 3.11870 2.26177 -69.13021 834.84374
2340.0000 -73.43570 -70.21314 3.22256 2.16576 -70.07769 726.60269
2345.0000 -72.54728 -69.92547 2.62181 2.21184 -69.62297 794.16333
2350.0000 -72.33620 -68.99474 3.34146 2.21263 -69.61520 809.82904
2355.0000 -71.33887 -68.34907 2.98980 2.32384 -68.51773 898.17672
2360.0000 -72.82142 -69.48982 3.33161 2.28258 -68.92484 832.49629
2365.0000 -72.12507 -68.80677 3.31830 2.28074 -68.94304 788.62123
2370.0000 -72.92299 -69.64561 3.27738 2.27629 -68.98700 854.48483
2375.0000 -72.22140 -69.28020 2.94119 2.20628 -69.67784 778.30605
2380.0000 -70.90265 -67.53497 3.36768 2.33762 -68.38177 923.17317
2385.0000 -72.60123 -68.57976 4.02146 2.39578 -67.80776 917.54293
2390.0000 -72.74390 -69.32134 3.42256 2.26841 -69.06468 842.32490
2395.0000 -72.54469 -69.13657 3.40813 2.24126 -69.33260 769.75556
2400.0000 -72.54058 -68.52730 4.01328 2.27689 -68.98104 873.67224
2405.0000 -71.99470 -69.01710 2.97759 2.31426 -68.61221 939.53948
2410.0000 -72.39171 -68.59417 3.79754 2.27887 -68.96153 913.26396
2415.0000 -71.51338 -67.56687 3.94651 2.34765 -68.28270 893.17832
2420.0000 -71.51908 -68.27098 3.24810 2.36441 -68.11737 963.32042
2425.0000 -72.54641 -68.87929 3.66712 2.33112 -68.44584 828.06235
2430.0000 -72.42933 -69.14691 3.28241 2.27098 -69.03932 882.18789
2435.0000 -71.81860 -68.42409 3.39451 2.32553 -68.50106 873.99766
2440.0000 -72.47686 -68.79616 3.68070 2.30593 -68.69449 893.15721
2445.0000 -72.88695 -69.21759 3.66936 2.22192 -69.52350 791.74048
2450.0000 -72.95803 -70.37974 2.57829 2.28232 -68.92740 840.86112
2455.0000 -72.72517 -69.54437 3.18080 2.19558 -69.78343 772.86167
2460.0000 -73.30168 -70.53858 2.76310 2.12122 -70.51726 742.07848
2465.0000 -72.91187 -70.25032 2.66155 2.14098 -70.32225 728.23827
2470.0000 -73.69372 -69.77010 3.92362 2.16474 -70.08776 746.78701
2475.0000 -72.78936 -69.39010 3.39926 2.18818 -69.85649 809.79580
2480.0000 -72.19562 -69.96225 2.23337 2.21989 -69.54350 758.52224
2485.0000 -72.90809 -69.53832 3.36977 2.26722 -69.07647 841.66837
2490.0000 -71.94299 -69.41100 2.53199 2.22962 -69.44753 787.95737
2495.0000 -72.55647 -68.91071 3.64576 2.28591 -68.89197 838.76670
2500.0000 -72.72109 -69.10190 3.61919 2.23421 -69.40223 820.91862
FREEZING PROCESS: loop number 11 T-loop= 802.00000000000000
main_MD> interactions number 11 at Temperature= 802.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.55084 0.00038 -0.67282
force_rgl> df(natom) 3.02206 -1.89502 -5.20804
2505.0000 -72.44877 -68.25260 4.19616 2.29126 -68.83923 901.58431
2510.0000 -72.99096 -69.71342 3.27754 2.29773 -68.77537 881.32588
2515.0000 -72.36038 -68.93519 3.42519 2.28231 -68.92757 822.48415
2520.0000 -72.07968 -68.78647 3.29321 2.26620 -69.08656 853.85052
2525.0000 -72.72080 -69.02336 3.69744 2.30097 -68.74336 866.06084
2530.0000 -72.97396 -69.60698 3.36697 2.27211 -69.02822 853.04509
2535.0000 -73.10223 -69.76944 3.33279 2.23827 -69.36214 834.91479
2540.0000 -73.21931 -70.37625 2.84306 2.19298 -69.80909 792.23856
2545.0000 -73.15519 -69.48707 3.66813 2.18465 -69.89124 807.24094
2550.0000 -72.27159 -69.01663 3.25495 2.22128 -69.52983 852.40666
2555.0000 -72.12548 -68.28241 3.84306 2.31436 -68.61122 874.59061
2560.0000 -73.31845 -69.66369 3.65476 2.23875 -69.35745 823.52796
2565.0000 -73.48028 -70.16417 3.31611 2.19819 -69.75761 786.54070
2570.0000 -72.39221 -69.79324 2.59898 2.11376 -70.59084 717.86338
2575.0000 -72.84150 -70.38396 2.45753 2.11822 -70.54688 687.33776
2580.0000 -72.99953 -69.90945 3.09008 2.23091 -69.43475 808.71132
2585.0000 -72.13884 -69.37630 2.76254 2.21756 -69.56651 768.13823
2590.0000 -72.66299 -69.49623 3.16676 2.22168 -69.52581 756.73115
2595.0000 -72.69440 -68.45739 4.23701 2.32841 -68.47265 876.20132
2600.0000 -72.82206 -69.64912 3.17294 2.35874 -68.17336 882.17244
2605.0000 -71.94780 -69.50012 2.44768 2.23867 -69.35823 824.04265
2610.0000 -72.63844 -70.13931 2.49913 2.16325 -70.10241 762.23926
2615.0000 -73.55065 -70.37740 3.17325 2.10679 -70.65963 716.73062
2620.0000 -73.84811 -71.32993 2.51817 2.08331 -70.89132 687.23350
2625.0000 -73.64889 -71.19840 2.45049 2.07640 -70.95951 687.66272
2630.0000 -73.59987 -70.92417 2.67570 2.03761 -71.34228 612.06813
2635.0000 -73.42827 -70.72965 2.69862 2.07511 -70.97227 684.79413
2640.0000 -72.89287 -69.53359 3.35927 2.14651 -70.26764 706.38048
2645.0000 -72.50005 -69.30297 3.19708 2.21388 -69.60281 797.22379
2650.0000 -72.66158 -69.60998 3.05159 2.24655 -69.28041 834.68533
2655.0000 -72.48030 -68.80065 3.67965 2.23296 -69.41459 818.84489
2660.0000 -73.38415 -69.79407 3.59008 2.25912 -69.15642 833.33574
2665.0000 -73.50215 -70.37935 3.12280 2.25359 -69.21093 842.03189
2670.0000 -72.20455 -68.24020 3.96435 2.25130 -69.23355 830.18904
2675.0000 -72.15200 -69.25263 2.89937 2.34787 -68.28059 891.55961
2680.0000 -72.47671 -68.99761 3.47910 2.19835 -69.75609 781.09986
2685.0000 -71.58424 -67.92107 3.66316 2.35222 -68.23762 911.62443
2690.0000 -72.73778 -69.11223 3.62555 2.33368 -68.42061 936.88608
2695.0000 -71.97146 -69.15653 2.81493 2.31411 -68.61374 877.97963
2700.0000 -72.13897 -68.15967 3.97930 2.31606 -68.59447 857.52808
2705.0000 -73.30826 -69.48836 3.81991 2.29162 -68.83570 884.67233
2710.0000 -72.98634 -70.13125 2.85509 2.23949 -69.35007 830.97445
2715.0000 -73.00014 -70.36875 2.63138 2.20421 -69.69830 773.76824
2720.0000 -72.89421 -70.03608 2.85814 2.11615 -70.56728 686.97477
2725.0000 -72.89673 -69.56575 3.33098 2.15768 -70.15738 732.00360
2730.0000 -73.16860 -69.98196 3.18664 2.22605 -69.48277 773.77520
2735.0000 -73.00840 -70.00581 3.00259 2.16512 -70.08404 696.72620
2740.0000 -72.40833 -69.33988 3.06846 2.20350 -69.70530 786.61371
2745.0000 -73.54753 -70.30964 3.23789 2.19852 -69.75440 774.59490
2750.0000 -72.75610 -69.71447 3.04164 2.19980 -69.74175 781.75917
FREEZING PROCESS: loop number 12 T-loop= 777.00000000000000
main_MD> interactions number 12 at Temperature= 777.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.84527 -1.98475 -0.38115
force_rgl> df(natom) 0.63907 0.43724 0.66540
2755.0000 -73.33597 -69.97668 3.35929 2.15888 -70.14562 753.78769
2760.0000 -73.73457 -71.24951 2.48506 2.11819 -70.54714 709.01430
2765.0000 -73.36316 -70.17776 3.18540 2.13302 -70.40077 694.46172
2770.0000 -73.73696 -71.24551 2.49145 2.10908 -70.63699 692.81963
2775.0000 -74.09064 -70.72244 3.36820 2.06831 -71.03936 694.74725
2780.0000 -73.50183 -70.57799 2.92384 2.09982 -70.72845 718.99963
2785.0000 -73.10246 -70.39850 2.70396 2.09380 -70.78782 705.47243
2790.0000 -74.27261 -71.22840 3.04421 2.13760 -70.35554 761.04664
2795.0000 -72.84812 -69.64964 3.19848 2.17533 -69.98321 774.73000
2800.0000 -72.50155 -68.95736 3.54420 2.18283 -69.90923 795.56492
2805.0000 -72.33541 -68.93305 3.40236 2.27664 -68.98349 848.99945
2810.0000 -73.03985 -70.63794 2.40191 2.24509 -69.29486 793.64420
2815.0000 -72.55045 -70.04974 2.50071 2.13146 -70.41621 682.55547
2820.0000 -73.24709 -70.72183 2.52527 2.17108 -70.02519 741.91300
2825.0000 -73.55664 -70.45587 3.10076 2.11776 -70.55140 719.91789
2830.0000 -73.64749 -69.90330 3.74418 2.13109 -70.41980 706.57242
2835.0000 -72.30121 -69.17373 3.12748 2.19212 -69.81753 750.13706
2840.0000 -71.70896 -68.42605 3.28291 2.27934 -68.95681 809.28384
2845.0000 -73.02243 -70.45210 2.57032 2.18829 -69.85537 795.42559
2850.0000 -73.12124 -69.72160 3.39964 2.15110 -70.22240 732.79918
2855.0000 -72.83230 -69.67087 3.16143 2.27973 -68.95304 844.51489
2860.0000 -71.45711 -68.41501 3.04211 2.32817 -68.47500 921.15904
2865.0000 -72.79354 -69.13718 3.65636 2.29245 -68.82744 817.07733
2870.0000 -72.35393 -68.52821 3.82572 2.26644 -69.08413 837.40517
2875.0000 -72.71514 -69.47771 3.23743 2.28522 -68.89884 849.52998
2880.0000 -72.60169 -69.21126 3.39043 2.22601 -69.48314 851.96314
2885.0000 -73.25721 -70.20168 3.05553 2.19393 -69.79970 779.79932
2890.0000 -71.84640 -68.53435 3.31204 2.24594 -69.28641 830.98016
2895.0000 -71.37534 -67.53576 3.83958 2.33816 -68.37642 928.64012
2900.0000 -72.28845 -68.62938 3.65907 2.31925 -68.56300 901.66930
2905.0000 -73.04118 -69.52404 3.51714 2.29013 -68.85034 892.40555
2910.0000 -73.02743 -70.30998 2.71745 2.19262 -69.81261 795.52299
2915.0000 -73.11098 -70.04489 3.06609 2.20185 -69.72155 822.91765
2920.0000 -72.62908 -69.81436 2.81472 2.19236 -69.81515 784.28686
2925.0000 -74.15872 -70.40417 3.75456 2.19745 -69.76501 786.29451
2930.0000 -73.12699 -69.74836 3.37863 2.13427 -70.38847 724.71601
2935.0000 -72.58610 -70.13137 2.45473 2.21422 -69.59944 790.13407
2940.0000 -71.79651 -68.82710 2.96940 2.18233 -69.91415 714.10802
2945.0000 -71.76336 -67.89161 3.87175 2.33247 -68.43258 872.09556
2950.0000 -71.96138 -69.16644 2.79494 2.30142 -68.73897 817.70233
2955.0000 -73.10981 -69.48396 3.62585 2.25025 -69.24389 807.13447
2960.0000 -73.63309 -69.62814 4.00496 2.20569 -69.68363 784.23086
2965.0000 -72.50931 -69.17715 3.33216 2.23696 -69.37502 829.61038
2970.0000 -72.75676 -69.26675 3.49001 2.28382 -68.91265 887.76003
2975.0000 -72.90669 -70.16842 2.73828 2.24778 -69.26830 767.22185
2980.0000 -72.71207 -69.57456 3.13751 2.17164 -70.01968 761.46104
2985.0000 -71.76307 -68.98496 2.77811 2.22950 -69.44871 788.37872
2990.0000 -73.47990 -70.51719 2.96271 2.17779 -69.95899 768.37298
2995.0000 -73.55606 -70.45546 3.10061 2.13814 -70.35027 744.70434
3000.0000 -72.86618 -69.74852 3.11766 2.18926 -69.84581 795.81823
FREEZING PROCESS: loop number 13 T-loop= 752.00000000000000
main_MD> interactions number 13 at Temperature= 752.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 4.40723 3.06286 -3.19449
force_rgl> df(natom) 2.38118 1.64206 -0.07613
3005.0000 -74.16291 -71.27411 2.88880 2.11872 -70.54191 739.92012
3010.0000 -73.25027 -70.97820 2.27208 2.06224 -71.09926 672.35660
3015.0000 -73.58074 -71.18101 2.39973 2.06824 -71.04001 665.68829
3020.0000 -73.90743 -70.36250 3.54493 2.13234 -70.40748 745.86421
3025.0000 -72.83174 -69.22951 3.60222 2.21387 -69.60293 826.87434
3030.0000 -72.38507 -69.17655 3.20853 2.21399 -69.60175 807.57185
3035.0000 -72.67610 -69.84671 2.82939 2.25828 -69.16467 834.45095
3040.0000 -72.98698 -69.35792 3.62906 2.20343 -69.70598 802.85775
3045.0000 -72.58165 -69.20251 3.37914 2.26491 -69.09928 850.68425
3050.0000 -73.39062 -71.00716 2.38346 2.17156 -70.02047 738.04852
3055.0000 -73.07786 -70.17686 2.90100 2.18250 -69.91247 757.82923
3060.0000 -72.71364 -70.11643 2.59721 2.16268 -70.10811 703.31962
3065.0000 -73.21257 -70.81657 2.39601 2.13276 -70.40332 729.40196
3070.0000 -73.62731 -71.38560 2.24172 2.08723 -70.85266 654.63888
3075.0000 -73.30318 -70.56685 2.73633 2.15264 -70.20716 728.43068
3080.0000 -72.79775 -70.11847 2.67929 2.13684 -70.36305 708.65803
3085.0000 -73.52240 -70.33847 3.18392 2.15114 -70.22200 753.49040
3090.0000 -72.77726 -70.31636 2.46090 2.15973 -70.13724 735.24105
3095.0000 -73.44343 -70.72903 2.71440 2.10518 -70.67553 652.73129
3100.0000 -73.48344 -70.99772 2.48572 2.08164 -70.90785 657.49117
3105.0000 -72.24195 -69.52449 2.71746 2.13245 -70.40643 706.24147
3110.0000 -72.83920 -69.43502 3.40419 2.19259 -69.81290 788.25057
3115.0000 -73.06548 -69.58812 3.47736 2.21174 -69.62394 774.23308
3120.0000 -73.52475 -70.46550 3.05924 2.19621 -69.77720 792.16354
3125.0000 -73.03790 -70.23838 2.79952 2.14753 -70.25761 732.93672
3130.0000 -73.29983 -70.62111 2.67871 2.16753 -70.06023 746.70230
3135.0000 -73.27457 -69.96902 3.30555 2.14263 -70.30594 751.27182
3140.0000 -72.62799 -70.36482 2.26317 2.13958 -70.33609 740.31404
3145.0000 -72.90411 -70.31053 2.59358 2.11890 -70.54014 729.64314
3150.0000 -73.07142 -70.03069 3.04073 2.17213 -70.01482 724.54189
3155.0000 -72.39052 -69.23241 3.15811 2.23534 -69.39104 829.32163
3160.0000 -73.60540 -70.64305 2.96235 2.23819 -69.36295 831.88343
3165.0000 -73.30387 -70.49533 2.80854 2.15912 -70.14326 772.88791
3170.0000 -73.81736 -70.51227 3.30509 2.11526 -70.57603 765.20327
3175.0000 -73.52169 -70.69196 2.82972 2.12000 -70.52925 773.63044
3180.0000 -73.43338 -70.16747 3.26591 2.12346 -70.49513 707.19271
3185.0000 -72.73360 -69.57873 3.15487 2.19474 -69.79175 770.51702
3190.0000 -72.92002 -70.35468 2.56534 2.18943 -69.84409 728.81878
3195.0000 -72.66473 -69.81786 2.84687 2.10689 -70.65868 684.61780
3200.0000 -73.76499 -70.64593 3.11906 2.15158 -70.21764 729.56675
3205.0000 -72.53049 -69.78699 2.74350 2.13432 -70.38794 714.32053
3210.0000 -73.21789 -70.59856 2.61933 2.18157 -69.92167 757.21931
3215.0000 -72.99565 -70.15573 2.83992 2.11891 -70.54005 710.18725
3220.0000 -74.17644 -71.78307 2.39337 2.10789 -70.64877 702.35845
3225.0000 -73.50788 -71.16261 2.34527 2.04989 -71.22116 641.36022
3230.0000 -73.49737 -70.78081 2.71656 2.14206 -70.31156 721.20600
3235.0000 -73.77215 -70.86850 2.90365 2.05798 -71.14129 638.07819
3240.0000 -73.07032 -70.40146 2.66886 2.10544 -70.67294 707.48905
3245.0000 -73.97443 -71.16124 2.81319 2.10375 -70.68963 697.03312
3250.0000 -73.18269 -69.76961 3.41308 2.14304 -70.30190 700.39129
FREEZING PROCESS: loop number 14 T-loop= 727.00000000000000
main_MD> interactions number 14 at Temperature= 727.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.41498 -1.17610 1.27198
force_rgl> df(natom) -2.75279 -1.37561 -1.28845
3255.0000 -74.18900 -71.34958 2.83942 2.11497 -70.57887 705.86017
3260.0000 -73.47647 -71.14067 2.33580 2.01843 -71.53157 613.07353
3265.0000 -74.31498 -71.37702 2.93795 2.03656 -71.35271 640.66093
3270.0000 -73.77079 -70.92382 2.84698 2.04648 -71.25479 608.05347
3275.0000 -73.24125 -70.10592 3.13533 2.15518 -70.18207 708.41903
3280.0000 -73.25757 -70.47351 2.78405 2.13973 -70.33454 731.50063
3285.0000 -72.62678 -69.59320 3.03358 2.12328 -70.49692 720.15539
3290.0000 -72.20231 -69.63095 2.57136 2.24496 -69.29613 829.56305
3295.0000 -73.64915 -70.32618 3.32297 2.19347 -69.80426 739.05397
3300.0000 -73.94257 -71.18154 2.76103 2.05307 -71.18972 643.76046
3305.0000 -73.27617 -70.24199 3.03418 2.09655 -70.76068 714.15504
3310.0000 -72.84437 -70.34830 2.49607 2.15371 -70.19659 701.95237
3315.0000 -74.15638 -71.49223 2.66415 2.03991 -71.31964 635.26565
3320.0000 -73.30793 -70.52376 2.78417 2.06522 -71.06988 690.23980
3325.0000 -72.86919 -70.31575 2.55344 2.12086 -70.52073 706.83045
3330.0000 -73.18544 -70.58818 2.59726 2.14803 -70.25269 749.51719
3335.0000 -74.27748 -71.67768 2.59980 2.07902 -70.93370 682.13614
3340.0000 -75.05320 -72.54023 2.51297 2.00046 -71.70892 621.84912
3345.0000 -74.64562 -72.15584 2.48978 1.93232 -72.38137 559.28489
3350.0000 -74.24402 -71.83762 2.40640 1.98107 -71.90026 579.00550
3355.0000 -73.69470 -70.42064 3.27405 2.05668 -71.15409 663.57578
3360.0000 -74.06061 -70.79212 3.26848 2.12705 -70.45969 712.95998
3365.0000 -73.40919 -70.39879 3.01040 2.12162 -70.51330 717.72846
3370.0000 -72.79801 -70.57979 2.21822 2.07543 -70.96907 674.06322
3375.0000 -74.03307 -71.06461 2.96846 2.10149 -70.71192 698.32767
3380.0000 -73.41958 -71.19671 2.22287 2.07760 -70.94765 649.15117
3385.0000 -73.90649 -71.62629 2.28021 2.05945 -71.12682 656.04493
3390.0000 -73.09158 -70.90232 2.18926 2.08082 -70.91594 658.68852
3395.0000 -72.86400 -69.70421 3.15979 2.14611 -70.27160 718.96570
3400.0000 -72.82644 -69.46147 3.36497 2.19160 -69.82273 784.09183
3405.0000 -73.81586 -70.69416 3.12169 2.17617 -69.97496 768.46655
3410.0000 -74.20324 -71.16309 3.04014 2.07856 -70.93823 692.41767
3415.0000 -73.93190 -71.02785 2.90406 2.02758 -71.44132 655.65141
3420.0000 -74.03934 -71.01939 3.01995 2.08101 -70.91398 718.03928
3425.0000 -72.75121 -69.94928 2.80193 2.12406 -70.48917 707.26055
3430.0000 -73.89427 -71.57541 2.31887 2.13943 -70.33755 758.75300
3435.0000 -73.58378 -71.10345 2.48033 2.00059 -71.70759 624.34651
3440.0000 -74.12715 -70.73634 3.39081 2.08706 -70.85429 693.55014
3445.0000 -72.37598 -69.88313 2.49285 2.12884 -70.44199 688.73792
3450.0000 -73.19110 -71.01665 2.17445 2.09100 -70.81540 676.84843
3455.0000 -73.42914 -70.64952 2.77962 2.08548 -70.86990 675.83989
3460.0000 -73.88683 -71.19079 2.69604 2.04325 -71.28663 667.03565
3465.0000 -73.87595 -70.52953 3.34642 2.07657 -70.95785 644.95889
3470.0000 -73.49073 -71.09407 2.39666 2.06201 -71.10151 679.42705
3475.0000 -73.80936 -71.55771 2.25165 2.07501 -70.97327 660.86637
3480.0000 -73.38293 -70.80761 2.57532 2.07779 -70.94576 642.03626
3485.0000 -73.50822 -70.72914 2.77907 2.11428 -70.58571 725.89595
3490.0000 -73.18818 -70.65379 2.53438 2.12681 -70.46201 749.47581
3495.0000 -73.09748 -69.98355 3.11393 2.15467 -70.18716 797.04971
3500.0000 -72.75126 -69.43160 3.31966 2.20007 -69.73915 787.42482
FREEZING PROCESS: loop number 15 T-loop= 702.00000000000000
main_MD> interactions number 15 at Temperature= 702.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.34890 0.27069 0.42844
force_rgl> df(natom) 0.45304 -5.89848 4.45151
3505.0000 -73.23552 -71.50410 1.73141 2.11386 -70.58986 726.94900
3510.0000 -73.19990 -70.50669 2.69322 2.05109 -71.20929 630.32039
3515.0000 -74.06240 -70.71596 3.34644 2.11538 -70.57481 703.83788
3520.0000 -73.62414 -70.90495 2.71919 2.09713 -70.75498 730.39282
3525.0000 -74.03121 -71.59635 2.43486 2.01625 -71.55310 652.87795
3530.0000 -74.76567 -72.76813 1.99755 1.92834 -72.42058 562.43387
3535.0000 -74.47058 -71.66840 2.80218 1.93639 -72.34120 556.34717
3540.0000 -74.22907 -71.80229 2.42678 2.06914 -71.03118 703.35355
3545.0000 -73.42144 -70.75797 2.66347 2.06264 -71.09533 664.07179
3550.0000 -73.02177 -70.32766 2.69411 2.12595 -70.47058 704.32735
3555.0000 -73.52502 -70.48875 3.03627 2.12224 -70.50717 723.12371
3560.0000 -74.14825 -70.89466 3.25359 2.05336 -71.18684 626.39000
3565.0000 -73.86317 -70.72400 3.13917 2.06562 -71.06593 706.66122
3570.0000 -74.44192 -71.70502 2.73690 2.04622 -71.25734 652.59094
3575.0000 -73.25911 -70.70949 2.54962 2.05424 -71.17824 669.32664
3580.0000 -73.24962 -70.58212 2.66750 2.15248 -70.20874 689.64719
3585.0000 -73.71722 -70.91529 2.80193 2.15763 -70.15792 745.99564
3590.0000 -73.58761 -71.18845 2.39916 2.11275 -70.60081 708.30220
3595.0000 -74.38500 -71.76194 2.62306 2.00117 -71.70186 596.56037
3600.0000 -73.96669 -70.91484 3.05185 2.02024 -71.51369 639.79532
3605.0000 -73.83604 -70.60149 3.23455 2.08602 -70.86461 694.09436
3610.0000 -73.89046 -70.78443 3.10603 2.10882 -70.63963 721.97280
3615.0000 -73.32578 -70.43512 2.89067 2.09835 -70.74289 690.18022
3620.0000 -73.41372 -70.22689 3.18683 2.12925 -70.43801 693.79916
3625.0000 -73.54385 -71.10032 2.44353 2.11923 -70.53689 729.76356
3630.0000 -73.69334 -70.54679 3.14655 2.09888 -70.73765 738.05560
3635.0000 -73.66492 -70.73990 2.92502 2.13291 -70.40184 754.24918
3640.0000 -73.58054 -70.90602 2.67452 2.05359 -71.18464 679.99692
3645.0000 -74.45917 -71.98195 2.47722 2.02512 -71.46561 664.34400
3650.0000 -73.29675 -70.60681 2.68994 1.98578 -71.85378 586.96021
3655.0000 -73.25264 -70.71716 2.53548 2.09742 -70.75207 706.48556
3660.0000 -73.01223 -70.01656 2.99566 2.17037 -70.03218 744.70329
3665.0000 -74.06159 -70.62211 3.43948 2.11260 -70.60230 691.00117
3670.0000 -74.13504 -70.88152 3.25352 2.12781 -70.45222 719.64729
3675.0000 -73.18605 -69.80294 3.38311 2.10044 -70.72226 691.15967
3680.0000 -72.90094 -69.97864 2.92230 2.18264 -69.91115 761.13560
3685.0000 -73.67050 -70.89853 2.77198 2.11330 -70.59542 700.02131
3690.0000 -73.32145 -69.83624 3.48520 2.18708 -69.86728 734.60029
3695.0000 -73.65734 -70.58105 3.07629 2.13554 -70.37595 765.62960
3700.0000 -73.73036 -71.25101 2.47935 2.05776 -71.14347 673.96192
3705.0000 -74.04450 -70.99941 3.04508 2.08942 -70.83101 742.40968
3710.0000 -73.78349 -70.70928 3.07421 2.16020 -70.13260 794.45160
3715.0000 -72.87836 -70.40153 2.47682 2.11764 -70.55251 726.08865
3720.0000 -73.96160 -71.25083 2.71076 2.09278 -70.79787 682.31928
3725.0000 -73.94221 -70.81777 3.12444 2.09763 -70.75000 667.37382
3730.0000 -73.97486 -71.10392 2.87095 2.07475 -70.97583 678.63412
3735.0000 -73.46925 -70.65338 2.81587 2.09634 -70.76277 704.52489
3740.0000 -73.20691 -70.38857 2.81834 2.12344 -70.49533 713.53169
3745.0000 -72.98186 -70.30473 2.67713 2.18963 -69.84211 760.78457
3750.0000 -73.02607 -70.06888 2.95719 2.19185 -69.82023 772.05578
FREEZING PROCESS: loop number 16 T-loop= 677.00000000000000
main_MD> interactions number 16 at Temperature= 677.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.01608 -1.13522 -1.61249
force_rgl> df(natom) -5.20574 -0.08582 -5.95120
3755.0000 -73.30040 -69.98595 3.31445 2.20074 -69.73248 805.27145
3760.0000 -73.54884 -70.18754 3.36130 2.19304 -69.80848 766.72346
3765.0000 -73.59657 -71.43814 2.15843 2.05270 -71.19344 661.25500
3770.0000 -74.20943 -71.70687 2.50256 2.00470 -71.66711 610.16697
3775.0000 -74.21439 -71.76673 2.44766 1.99477 -71.76502 584.83902
3780.0000 -72.40779 -69.81976 2.58804 2.08453 -70.87933 674.16036
3785.0000 -73.14828 -70.13750 3.01078 2.21412 -69.60051 755.17266
3790.0000 -73.07546 -70.41555 2.65991 2.14864 -70.24661 735.03095
3795.0000 -73.09409 -69.80835 3.28574 2.16111 -70.12357 736.26278
3800.0000 -74.15711 -71.83111 2.32600 2.05050 -71.21510 635.46090
3805.0000 -74.02151 -71.54551 2.47600 2.02305 -71.48604 635.40177
3810.0000 -73.51413 -70.81243 2.70170 2.06623 -71.05991 693.75184
3815.0000 -73.16065 -69.96625 3.19440 2.10472 -70.68000 733.81426
3820.0000 -73.75354 -70.22864 3.52490 2.18349 -69.90272 774.10317
3825.0000 -73.45021 -70.82917 2.62105 2.11649 -70.56385 755.51301
3830.0000 -74.12232 -71.37189 2.75043 2.04931 -71.22690 694.75961
3835.0000 -73.60320 -71.40516 2.19804 2.10817 -70.64602 728.70423
3840.0000 -74.26418 -71.63823 2.62594 2.06440 -71.07797 703.19132
3845.0000 -73.56033 -70.81159 2.74874 2.08849 -70.84024 700.24150
3850.0000 -74.65167 -72.20060 2.45107 2.00689 -71.64545 609.30989
3855.0000 -74.06141 -71.95036 2.11105 1.96802 -72.02907 591.39088
3860.0000 -74.38586 -71.41390 2.97196 1.98131 -71.89787 597.82826
3865.0000 -73.75889 -70.83763 2.92126 2.04845 -71.23530 674.55590
3870.0000 -73.40304 -71.27516 2.12788 2.05898 -71.13142 621.57832
3875.0000 -73.17231 -70.33268 2.83963 2.11177 -70.61049 710.27200
3880.0000 -73.67976 -71.24938 2.43038 2.06420 -71.07995 651.28840
3885.0000 -73.89490 -70.68992 3.20498 2.03808 -71.33767 636.96379
3890.0000 -73.53226 -71.27691 2.25535 2.08234 -70.90087 687.64661
3895.0000 -73.16150 -70.49178 2.66971 2.08088 -70.91535 698.66101
3900.0000 -72.76096 -70.19458 2.56639 2.15051 -70.22819 748.13299
3905.0000 -73.03829 -70.04673 2.99156 2.14552 -70.27742 735.14454
3910.0000 -72.94982 -69.93326 3.01656 2.18137 -69.92362 760.33508
3915.0000 -73.94115 -70.71621 3.22494 2.15534 -70.18057 723.68012
3920.0000 -73.20680 -70.82322 2.38358 2.11674 -70.56147 695.94675
3925.0000 -73.10303 -69.80351 3.29952 2.11937 -70.53543 674.47116
3930.0000 -72.91506 -70.24847 2.66659 2.18484 -69.88938 747.35657
3935.0000 -73.72816 -71.12748 2.60068 2.09351 -70.79070 677.54556
3940.0000 -73.58583 -70.64468 2.94115 2.05620 -71.15890 674.95800
3945.0000 -74.08098 -71.28078 2.80020 2.08071 -70.91696 692.29696
3950.0000 -73.72326 -70.99785 2.72541 2.07429 -70.98033 676.68687
3955.0000 -73.94464 -71.21537 2.72927 2.04378 -71.28138 670.18317
3960.0000 -73.16109 -70.13235 3.02874 2.09742 -70.75213 732.54748
3965.0000 -74.29693 -71.56854 2.72839 2.05391 -71.18150 658.78118
3970.0000 -74.69687 -72.15221 2.54466 2.00930 -71.62167 635.12473
3975.0000 -73.72375 -70.64704 3.07670 2.00403 -71.67365 621.62691
3980.0000 -73.35407 -70.54376 2.81031 2.07714 -70.95223 728.50080
3985.0000 -73.63225 -70.85999 2.77226 2.11215 -70.60677 725.87313
3990.0000 -73.78436 -71.32371 2.46065 2.07333 -70.98981 666.01892
3995.0000 -73.56790 -70.84621 2.72169 2.01674 -71.54828 640.71414
4000.0000 -73.63408 -71.07115 2.56294 2.12910 -70.43947 728.10462
FREEZING PROCESS: loop number 17 T-loop= 652.00000000000000
main_MD> interactions number 17 at Temperature= 652.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 6.64587 -1.15929 -1.42725
force_rgl> df(natom) 1.41124 -0.12394 -1.17488
4005.0000 -72.94754 -70.31399 2.63355 2.07942 -70.92973 665.90255
4010.0000 -73.39970 -70.43263 2.96707 2.07899 -70.93399 669.64484
4015.0000 -73.84611 -71.17234 2.67377 2.09935 -70.73307 685.37023
4020.0000 -74.26262 -71.13369 3.12894 2.04665 -71.25307 689.50118
4025.0000 -74.44173 -71.90077 2.54096 2.09088 -70.81663 715.05099
4030.0000 -74.72218 -72.30780 2.41439 1.94432 -72.26291 586.59036
4035.0000 -74.07691 -71.81841 2.25850 1.96326 -72.07603 582.84239
4040.0000 -73.78663 -71.00563 2.78100 2.01676 -71.54810 646.37943
4045.0000 -73.38903 -71.21625 2.17278 2.03341 -71.38376 685.77781
4050.0000 -74.26640 -72.33019 1.93622 1.99163 -71.79604 599.62634
4055.0000 -74.62351 -72.82218 1.80132 1.90363 -72.66449 517.10204
4060.0000 -73.82260 -71.47854 2.34406 1.93172 -72.38725 577.35652
4065.0000 -74.28854 -72.02339 2.26515 2.01840 -71.53187 651.04047
4070.0000 -74.16598 -72.38536 1.78062 1.95404 -72.16700 579.81617
4075.0000 -73.95667 -71.80287 2.15380 1.94611 -72.24522 544.48321
4080.0000 -74.62195 -71.88385 2.73809 1.96881 -72.02121 585.42120
4085.0000 -73.80593 -70.85786 2.94808 2.03255 -71.39221 641.18315
4090.0000 -74.14970 -71.71333 2.43637 2.02269 -71.48957 636.10402
4095.0000 -73.70129 -70.99265 2.70863 2.06188 -71.10278 705.66697
4100.0000 -73.85017 -71.03277 2.81739 2.07019 -71.02075 658.65214
4105.0000 -73.54308 -70.83938 2.70370 2.09761 -70.75019 721.15531
4110.0000 -73.95329 -71.81563 2.13766 2.06515 -71.07053 697.02483
4115.0000 -74.49551 -71.47727 3.01824 1.99394 -71.77329 591.30009
4120.0000 -74.07099 -71.76155 2.30944 1.98145 -71.89651 629.85509
4125.0000 -73.21093 -70.69094 2.51999 2.04003 -71.31838 664.01516
4130.0000 -73.82573 -71.93396 1.89177 2.02757 -71.44142 633.95947
4135.0000 -74.27055 -71.87716 2.39339 2.03377 -71.38022 628.12187
4140.0000 -73.73375 -70.38188 3.35187 2.11802 -70.54876 732.72373
4145.0000 -73.11887 -70.80269 2.31618 2.08975 -70.82778 721.83145
4150.0000 -73.08258 -70.77655 2.30603 2.09209 -70.80468 713.67617
4155.0000 -73.92730 -71.13155 2.79575 2.12431 -70.48673 711.47679
4160.0000 -74.04925 -71.47300 2.57625 2.04463 -71.27299 668.07413
4165.0000 -74.36411 -71.62728 2.73684 1.99349 -71.77770 619.51406
4170.0000 -74.25027 -71.46727 2.78300 2.02771 -71.43999 619.13320
4175.0000 -73.43168 -70.74031 2.69136 2.04805 -71.23927 627.88707
4180.0000 -73.17988 -70.36172 2.81816 2.10368 -70.69036 686.73072
4185.0000 -73.54005 -70.65390 2.88616 2.12848 -70.44554 719.47882
4190.0000 -73.39566 -69.72006 3.67559 2.13148 -70.41598 753.82295
4195.0000 -73.14455 -70.09809 3.04646 2.17241 -70.01210 727.87811
4200.0000 -73.76517 -71.14876 2.61642 2.07312 -70.99193 696.31302
4205.0000 -74.32455 -71.94766 2.37689 2.04975 -71.22255 639.53642
4210.0000 -74.56984 -71.64448 2.92536 1.97117 -71.99795 590.46987
4215.0000 -74.54129 -71.45321 3.08809 1.97813 -71.92930 577.75776
4220.0000 -73.80462 -71.41428 2.39034 2.01436 -71.57178 607.48650
4225.0000 -73.52190 -70.64833 2.87357 2.07238 -70.99921 697.18376
4230.0000 -73.57672 -71.11777 2.45895 2.13004 -70.43015 711.17801
4235.0000 -74.15984 -71.59114 2.56871 2.02973 -71.42007 636.28547
4240.0000 -73.91045 -71.22369 2.68677 1.97273 -71.98258 579.77233
4245.0000 -74.42170 -72.14466 2.27704 2.04786 -71.24118 652.65763
4250.0000 -74.70087 -71.64485 3.05602 1.98330 -71.87821 596.26686
FREEZING PROCESS: loop number 18 T-loop= 627.00000000000000
main_MD> interactions number 18 at Temperature= 627.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.56479 1.51177 -1.12839
force_rgl> df(natom) -2.88053 0.95793 1.59070
4255.0000 -74.09252 -71.53520 2.55732 2.03325 -71.38532 647.79451
4260.0000 -74.64291 -72.45725 2.18566 1.97041 -72.00551 560.73149
4265.0000 -74.32802 -71.66742 2.66060 1.92670 -72.43676 537.25416
4270.0000 -73.52590 -71.32431 2.20159 2.02159 -71.50037 641.07578
4275.0000 -74.59438 -71.96999 2.62439 1.98377 -71.87362 618.33193
4280.0000 -74.49550 -72.33465 2.16085 1.98181 -71.89291 625.19483
4285.0000 -74.59279 -72.42377 2.16901 1.95550 -72.15260 578.36819
4290.0000 -74.06403 -71.77828 2.28576 1.97871 -71.92351 583.45398
4295.0000 -74.64785 -72.25352 2.39433 1.94216 -72.28423 579.31330
4300.0000 -74.60468 -71.66342 2.94126 2.01448 -71.57055 655.41654
4305.0000 -73.83862 -71.44074 2.39787 2.01150 -71.60000 637.12785
4310.0000 -74.22111 -71.71449 2.50662 2.02160 -71.50027 613.34341
4315.0000 -74.26094 -71.70149 2.55945 2.02962 -71.42111 634.27602
4320.0000 -73.84042 -71.28173 2.55868 1.99550 -71.75787 583.65715
4325.0000 -73.09547 -71.36233 1.73314 2.04521 -71.26731 658.11455
4330.0000 -74.45260 -71.57131 2.88128 2.00578 -71.65646 624.48769
4335.0000 -73.74570 -71.38106 2.36463 2.00693 -71.64503 605.94306
4340.0000 -73.76167 -70.67720 3.08447 2.04417 -71.27762 629.41635
4345.0000 -74.24028 -72.02061 2.21967 2.00200 -71.69373 597.87973
4350.0000 -74.08415 -72.04464 2.03951 1.97971 -71.91367 575.87307
4355.0000 -73.96236 -70.71405 3.24831 2.01562 -71.55932 623.47924
4360.0000 -74.08141 -70.61544 3.46597 2.10321 -70.69492 699.03635
4365.0000 -73.23004 -70.84480 2.38524 2.08748 -70.85022 678.24005
4370.0000 -74.03014 -70.31881 3.71134 2.10064 -70.72030 728.71390
4375.0000 -74.02010 -71.76024 2.25986 2.09203 -70.80526 682.61337
4380.0000 -73.56778 -71.08119 2.48659 2.05197 -71.20065 647.79305
4385.0000 -72.77979 -70.20345 2.57634 2.15132 -70.22015 743.74053
4390.0000 -73.73587 -71.56928 2.16659 2.09375 -70.78827 688.23452
4395.0000 -74.40678 -72.38241 2.02437 1.98102 -71.90071 573.22742
4400.0000 -73.11339 -70.88606 2.22733 2.01042 -71.61059 641.37337
4405.0000 -73.75647 -71.18303 2.57344 2.06187 -71.10290 672.73512
4410.0000 -74.18336 -71.49236 2.69100 2.03461 -71.37195 667.26484
4415.0000 -73.96826 -72.00957 1.95869 1.99026 -71.80954 614.43383
4420.0000 -74.84507 -72.59350 2.25156 1.97489 -71.96123 566.92057
4425.0000 -74.28784 -71.91179 2.37606 1.90821 -72.61922 530.25279
4430.0000 -73.13605 -70.20997 2.92607 2.04924 -71.22755 661.55943
4435.0000 -73.96370 -71.27329 2.69041 2.09819 -70.74452 712.51074
4440.0000 -73.26007 -70.01682 3.24326 2.07754 -70.94830 718.72532
4445.0000 -73.25851 -70.91463 2.34388 2.13482 -70.38303 757.24207
4450.0000 -74.05210 -71.72167 2.33043 2.01830 -71.53288 602.37027
4455.0000 -74.17120 -71.85763 2.31357 1.97173 -71.99240 568.85485
4460.0000 -73.73624 -70.58983 3.14642 2.10916 -70.63620 733.27346
4465.0000 -73.56764 -70.89718 2.67045 2.07028 -71.01991 667.57210
4470.0000 -74.26364 -70.88187 3.38177 2.05586 -71.16224 684.36249
4475.0000 -73.39780 -71.18886 2.20894 2.06364 -71.08546 652.50371
4480.0000 -73.35750 -70.99644 2.36106 2.05906 -71.13061 651.77075
4485.0000 -74.00227 -70.95246 3.04981 2.06863 -71.03617 688.18315
4490.0000 -73.80721 -70.83871 2.96850 2.07392 -70.98396 671.16872
4495.0000 -73.40047 -69.90300 3.49747 2.12952 -70.43531 710.28596
4500.0000 -74.02216 -70.81448 3.20768 2.12010 -70.52831 693.13353
FREEZING PROCESS: loop number 19 T-loop= 602.00000000000000
main_MD> interactions number 19 at Temperature= 602.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -4.10991 0.59434 -0.80199
force_rgl> df(natom) -0.25856 -0.44616 -1.85164
4505.0000 -73.73296 -70.57534 3.15763 2.09189 -70.80664 632.66818
4510.0000 -73.40810 -70.87953 2.52856 2.09280 -70.79767 625.74075
4515.0000 -73.49957 -70.71873 2.78084 2.10053 -70.72136 684.88416
4520.0000 -73.48786 -70.70850 2.77936 2.09175 -70.80802 673.43974
4525.0000 -73.89556 -71.89384 2.00173 2.04211 -71.29790 643.96717
4530.0000 -74.76494 -72.37652 2.38842 1.96998 -72.00967 582.89969
4535.0000 -74.47140 -72.16910 2.30230 1.96408 -72.06792 585.27255
4540.0000 -74.55630 -71.95093 2.60537 1.97209 -71.98887 575.02670
4545.0000 -74.42272 -72.29471 2.12801 1.97888 -71.92187 590.86615
4550.0000 -74.58284 -72.47348 2.10936 1.98336 -71.87764 604.14842
4555.0000 -74.27463 -72.26970 2.00493 1.95188 -72.18831 567.19984
4560.0000 -74.74801 -72.87919 1.86882 1.92117 -72.49133 546.15872
4565.0000 -74.11684 -72.04562 2.07122 1.91414 -72.56076 522.92126
4570.0000 -73.89301 -72.18476 1.70825 1.96170 -72.09139 575.84673
4575.0000 -74.68828 -72.53614 2.15214 1.93080 -72.39638 555.48824
4580.0000 -74.23949 -72.25905 1.98044 1.90424 -72.65840 523.25234
4585.0000 -74.86844 -72.72379 2.14464 1.90925 -72.60896 533.33419
4590.0000 -74.19797 -71.95455 2.24342 1.93116 -72.39278 554.30361
4595.0000 -74.16194 -71.60348 2.55846 2.02056 -71.51059 615.42749
4600.0000 -74.93736 -72.54112 2.39624 1.99539 -71.75898 602.17363
4605.0000 -74.34308 -72.05554 2.28753 1.95705 -72.13726 560.41181
4610.0000 -74.60108 -71.64188 2.95920 1.98969 -71.81516 608.87557
4615.0000 -74.38249 -72.19410 2.18839 1.96191 -72.08930 612.22972
4620.0000 -74.30263 -72.28491 2.01772 1.92773 -72.42665 563.92212
4625.0000 -74.13868 -71.69940 2.43928 1.96130 -72.09531 563.88081
4630.0000 -74.22992 -72.29614 1.93378 1.99787 -71.73446 605.23660
4635.0000 -74.42369 -71.99659 2.42709 1.97661 -71.94423 575.18336
4640.0000 -73.92610 -71.61837 2.30773 1.97485 -71.96160 607.97515
4645.0000 -74.01496 -71.65436 2.36059 2.02628 -71.45413 628.78379
4650.0000 -73.82801 -71.33377 2.49424 1.98728 -71.83901 593.76941
4655.0000 -73.10077 -71.19416 1.90662 2.00675 -71.64682 597.99674
4660.0000 -74.16638 -71.49350 2.67288 2.01636 -71.55201 608.73793
4665.0000 -74.56615 -71.87632 2.68983 2.01095 -71.60544 615.62694
4670.0000 -74.70006 -72.49572 2.20433 1.94803 -72.22636 560.64424
4675.0000 -74.13942 -71.67781 2.46162 1.96831 -72.02622 566.18245
4680.0000 -74.68605 -72.23461 2.45144 1.97863 -71.92433 610.31650
4685.0000 -74.19131 -71.46895 2.72236 1.96292 -72.07936 579.72905
4690.0000 -73.48507 -71.22055 2.26452 1.98388 -71.87257 548.49632
4695.0000 -73.85151 -71.51082 2.34068 2.03940 -71.32468 635.88014
4700.0000 -73.23548 -70.99150 2.24398 2.03506 -71.36744 628.00556
4705.0000 -73.46667 -70.99965 2.46702 2.07999 -70.92409 656.35756
4710.0000 -74.49830 -71.83131 2.66699 2.02114 -71.50488 641.85804
4715.0000 -74.56008 -72.01005 2.55003 1.96980 -72.01151 594.35738
4720.0000 -73.68436 -71.07419 2.61017 2.00215 -71.69226 634.59466
4725.0000 -74.01680 -71.89125 2.12555 2.01268 -71.58830 641.28609
4730.0000 -74.97365 -72.17701 2.79663 1.98012 -71.90963 594.38076
4735.0000 -73.57789 -71.35030 2.22759 2.01909 -71.52505 664.37105
4740.0000 -73.26749 -70.79494 2.47255 2.03970 -71.32167 659.14047
4745.0000 -73.44981 -70.87145 2.57836 2.08075 -70.91660 655.69963
4750.0000 -73.80100 -71.78485 2.01614 2.03507 -71.36739 607.25087
FREEZING PROCESS: loop number 20 T-loop= 577.00000000000000
main_MD> interactions number 20 at Temperature= 577.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.05838 4.66189 2.04264
force_rgl> df(natom) 3.54380 -1.01224 -1.93333
4755.0000 -74.12305 -71.89258 2.23047 1.99537 -71.75919 574.16640
4760.0000 -74.38269 -71.46430 2.91838 2.01741 -71.54169 594.50521
4765.0000 -74.86463 -72.08005 2.78458 1.98752 -71.83656 599.52957
4770.0000 -74.52586 -72.47426 2.05161 1.93347 -72.36995 569.93779
4775.0000 -74.81249 -72.33767 2.47482 1.90868 -72.61461 512.57250
4780.0000 -74.46807 -71.76768 2.70039 2.01306 -71.58458 630.67846
4785.0000 -74.56526 -72.10325 2.46201 1.97230 -71.98683 615.22760
4790.0000 -73.84708 -71.47016 2.37692 1.99872 -71.72605 610.41629
4795.0000 -73.79314 -71.49765 2.29549 2.00569 -71.65731 584.25922
4800.0000 -73.15428 -70.97536 2.17891 2.04893 -71.23059 647.28832
4805.0000 -74.15841 -71.19180 2.96661 2.06363 -71.08558 628.13782
4810.0000 -73.30005 -71.40979 1.89026 2.04223 -71.29671 633.43978
4815.0000 -73.61297 -71.67199 1.94098 2.03094 -71.40813 669.49287
4820.0000 -74.02253 -71.12044 2.90209 2.01357 -71.57959 633.11446
4825.0000 -73.46740 -70.92133 2.54606 2.07938 -70.93009 683.33024
4830.0000 -73.54323 -71.37282 2.17040 2.01820 -71.53381 638.22351
4835.0000 -74.43594 -71.70271 2.73322 1.99399 -71.77278 617.00294
4840.0000 -74.79813 -71.85240 2.94572 1.99126 -71.79974 619.22147
4845.0000 -73.90844 -71.60749 2.30095 1.99417 -71.77102 619.91118
4850.0000 -74.15748 -72.19280 1.96468 1.98155 -71.89548 600.62756
4855.0000 -73.76882 -71.29741 2.47141 2.01946 -71.52145 610.33502
4860.0000 -74.11068 -71.61120 2.49948 2.03080 -71.40954 634.75578
4865.0000 -74.30538 -71.65330 2.65208 1.98693 -71.84246 615.39629
4870.0000 -75.35507 -72.57577 2.77929 1.98729 -71.83892 612.80763
4875.0000 -74.28242 -72.19012 2.09230 1.93742 -72.33105 548.33571
4880.0000 -74.67958 -72.83222 1.84736 1.91715 -72.53107 522.03784
4885.0000 -73.80759 -71.72904 2.07855 1.93083 -72.39600 517.61317
4890.0000 -74.05805 -71.96201 2.09604 2.02789 -71.43827 634.36962
4895.0000 -74.83691 -71.74109 3.09582 1.94908 -72.21597 516.63942
4900.0000 -73.71643 -71.19069 2.52574 2.00881 -71.62649 594.87696
4905.0000 -73.65143 -71.45791 2.19353 2.05787 -71.14242 659.53710
4910.0000 -73.35217 -70.99459 2.35758 2.06787 -71.04371 704.51123
4915.0000 -74.29157 -72.50637 1.78520 2.00594 -71.65480 623.01547
4920.0000 -74.89496 -72.05967 2.83529 1.98362 -71.87511 604.28168
4925.0000 -73.87569 -71.00484 2.87085 2.00927 -71.62196 635.40378
4930.0000 -74.60828 -71.54505 3.06323 2.04946 -71.22537 640.57037
4935.0000 -74.63734 -72.29340 2.34394 1.96035 -72.10478 595.07027
4940.0000 -75.01721 -72.83067 2.18654 1.91099 -72.59187 526.53201
4945.0000 -74.21187 -72.06776 2.14411 1.91676 -72.53489 534.04904
4950.0000 -74.89017 -72.95426 1.93591 1.91862 -72.51652 537.92803
4955.0000 -74.80437 -72.69847 2.10590 1.87564 -72.94067 496.07375
4960.0000 -73.49917 -71.54124 1.95793 1.94184 -72.28738 559.24381
4965.0000 -73.77160 -71.69379 2.07781 2.03247 -71.39299 626.48089
4970.0000 -73.85259 -71.92236 1.93024 1.99113 -71.80102 552.43311
4975.0000 -74.65960 -72.17996 2.47963 1.98412 -71.87013 569.17102
4980.0000 -74.57740 -72.95279 1.62460 1.90537 -72.64732 524.63540
4985.0000 -74.32719 -72.26518 2.06201 1.93085 -72.39584 560.78313
4990.0000 -74.09204 -71.81361 2.27842 1.93966 -72.30886 556.17826
4995.0000 -74.23112 -71.70509 2.52603 2.01440 -71.57133 627.74545
5000.0000 -74.44769 -72.11255 2.33514 1.97995 -71.91133 588.25630
FREEZING PROCESS: loop number 21 T-loop= 552.00000000000000
main_MD> interactions number 21 at Temperature= 552.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.25730 -0.47768 -0.05425
force_rgl> df(natom) -3.78909 2.85539 3.55439
5005.0000 -75.01778 -73.08890 1.92888 1.90732 -72.62809 516.70917
5010.0000 -74.84734 -72.72714 2.12020 1.85975 -73.09752 457.82342
5015.0000 -74.48682 -72.57890 1.90792 1.89714 -72.72848 485.75569
5020.0000 -74.58894 -72.54611 2.04283 1.91449 -72.55730 539.54071
5025.0000 -74.60726 -72.01973 2.58754 1.93790 -72.32624 554.86752
5030.0000 -75.13846 -73.22666 1.91181 1.89278 -72.77155 508.56193
5035.0000 -74.61400 -72.39517 2.21882 1.89082 -72.79086 521.80427
5040.0000 -74.54159 -72.27373 2.26787 1.94170 -72.28877 584.19224
5045.0000 -74.77190 -72.56516 2.20674 1.93504 -72.35455 579.04546
5050.0000 -74.50201 -72.33773 2.16429 1.95052 -72.20172 572.42991
5055.0000 -75.27388 -73.34248 1.93140 1.87472 -72.94977 500.32464
5060.0000 -74.68381 -72.50320 2.18061 1.85282 -73.16585 484.50256
5065.0000 -74.48833 -71.99192 2.49641 1.96444 -72.06433 611.68184
5070.0000 -74.26236 -72.02248 2.23988 1.97415 -71.96853 623.52693
5075.0000 -74.71370 -72.16911 2.54459 1.93879 -72.31745 570.22891
5080.0000 -74.17496 -71.98808 2.18688 1.92733 -72.43057 567.05074
5085.0000 -74.00204 -71.52350 2.47854 2.00947 -71.62004 627.19929
5090.0000 -74.01761 -71.52472 2.49289 2.01733 -71.54241 596.11179
5095.0000 -73.38108 -71.84701 1.53407 1.98821 -71.82976 561.89719
5100.0000 -73.60051 -71.35501 2.24549 2.01406 -71.57470 557.79765
5105.0000 -74.54272 -71.70231 2.84041 1.98511 -71.86036 616.29886
5110.0000 -74.89101 -72.58582 2.30519 1.94936 -72.21317 570.41095
5115.0000 -73.90039 -71.78463 2.11577 1.96478 -72.06097 567.39125
5120.0000 -74.78017 -72.79845 1.98172 1.93286 -72.37602 558.11539
5125.0000 -74.33700 -72.75534 1.58166 1.88356 -72.86255 490.86012
5130.0000 -75.15499 -72.73007 2.42493 1.86047 -73.09042 475.98270
5135.0000 -75.01360 -72.47557 2.53803 1.89189 -72.78031 503.11447
5140.0000 -74.15928 -72.20692 1.95237 1.91091 -72.59265 529.84571
5145.0000 -74.55832 -72.18166 2.37667 1.96500 -72.05887 580.16598
5150.0000 -75.08751 -72.02479 3.06273 1.99428 -71.76990 611.66276
5155.0000 -73.91452 -72.12317 1.79136 1.96735 -72.03561 583.64311
5160.0000 -74.58357 -71.73627 2.84729 1.96604 -72.04861 570.50118
5165.0000 -74.34631 -72.20027 2.14604 1.96895 -72.01987 566.61926
5170.0000 -75.07297 -72.75309 2.31988 1.88560 -72.84241 484.92024
5175.0000 -74.65277 -72.38266 2.27012 1.91912 -72.51163 530.39773
5180.0000 -74.78416 -72.59892 2.18524 1.97116 -71.99804 603.37415
5185.0000 -75.19752 -73.33555 1.86196 1.86122 -73.08300 489.96180
5190.0000 -75.21949 -73.07903 2.14046 1.84429 -73.25008 462.95048
5195.0000 -74.63855 -72.98859 1.64996 1.86716 -73.02434 460.51184
5200.0000 -74.77976 -72.45501 2.32474 1.91315 -72.57049 533.19855
5205.0000 -74.57562 -72.48096 2.09466 1.92889 -72.41515 532.31166
5210.0000 -74.42082 -71.73642 2.68440 1.96918 -72.01762 610.42039
5215.0000 -74.68221 -72.62259 2.05962 1.96255 -72.08304 585.25327
5220.0000 -74.72369 -72.67568 2.04801 1.90487 -72.65218 496.63951
5225.0000 -74.04264 -72.28721 1.75544 1.91750 -72.52763 497.25060
5230.0000 -74.21501 -71.40149 2.81352 1.96158 -72.09260 549.75218
5235.0000 -74.08635 -70.97772 3.10864 2.03516 -71.36644 614.17120
5240.0000 -74.63787 -72.39805 2.23983 1.98916 -71.82044 603.38012
5245.0000 -74.81847 -72.37782 2.44065 1.90990 -72.60255 526.04693
5250.0000 -74.25196 -72.18113 2.07083 1.92319 -72.47143 541.69408
FREEZING PROCESS: loop number 22 T-loop= 527.00000000000000
main_MD> interactions number 22 at Temperature= 527.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.24507 -1.83085 -2.32025
force_rgl> df(natom) -3.73450 1.13320 -2.53828
5255.0000 -74.15364 -71.94249 2.21115 1.98937 -71.81837 612.44131
5260.0000 -74.84326 -72.65236 2.19090 1.91374 -72.56470 507.30307
5265.0000 -75.23040 -73.62510 1.60530 1.85935 -73.10142 477.25192
5270.0000 -75.05770 -73.20136 1.85634 1.81077 -73.58086 400.76757
5275.0000 -74.89200 -72.80939 2.08262 1.89500 -72.74966 497.00141
5280.0000 -74.20406 -72.37012 1.83394 1.91145 -72.58731 521.22790
5285.0000 -74.46636 -72.52199 1.94438 1.93823 -72.32306 531.02999
5290.0000 -74.19494 -72.39051 1.80442 1.92227 -72.48056 524.24944
5295.0000 -74.23543 -71.89533 2.34009 1.94921 -72.21462 581.01401
5300.0000 -74.17360 -71.78309 2.39051 1.97574 -71.95290 590.52138
5305.0000 -74.68694 -72.09109 2.59584 1.96557 -72.05320 570.30357
5310.0000 -73.90743 -71.80488 2.10255 1.93453 -72.35953 561.60466
5315.0000 -74.90172 -72.31952 2.58220 1.92902 -72.41386 566.63993
5320.0000 -75.00241 -72.87866 2.12375 1.84833 -73.21018 476.78106
5325.0000 -75.24217 -73.11274 2.12943 1.92350 -72.46833 554.04440
5330.0000 -74.25554 -72.60757 1.64797 1.88409 -72.85730 506.25513
5335.0000 -75.04169 -72.81190 2.22980 1.91053 -72.59641 544.85429
5340.0000 -74.83068 -72.74403 2.08664 1.85697 -73.12494 483.33156
5345.0000 -74.64518 -72.63265 2.01253 1.90198 -72.68078 535.21654
5350.0000 -75.48180 -73.63730 1.84450 1.87629 -72.93428 500.68030
5355.0000 -74.97593 -73.05519 1.92074 1.85832 -73.11161 493.16144
5360.0000 -75.08541 -73.26793 1.81748 1.89894 -72.71073 527.59077
5365.0000 -75.12400 -72.78702 2.33698 1.82352 -73.45502 445.30894
5370.0000 -75.01649 -72.97163 2.04486 1.85719 -73.12274 479.73405
5375.0000 -74.90811 -73.16571 1.74240 1.86817 -73.01435 486.60561
5380.0000 -74.31849 -72.76785 1.55064 1.86585 -73.03728 475.43399
5385.0000 -74.51263 -72.88292 1.62970 1.87127 -72.98384 472.39562
5390.0000 -74.77117 -73.01599 1.75518 1.89614 -72.73834 499.89479
5395.0000 -74.82718 -72.84348 1.98370 1.84076 -73.28492 457.79714
5400.0000 -75.10107 -73.08688 2.01420 1.88311 -72.86698 497.14592
5405.0000 -74.90740 -72.79256 2.11485 1.89794 -72.72056 521.90802
5410.0000 -75.29367 -73.05462 2.23906 1.86921 -73.00408 507.01670
5415.0000 -74.44689 -72.13961 2.30728 1.90690 -72.63216 542.22058
5420.0000 -74.55311 -71.86946 2.68365 1.94433 -72.26279 575.21408
5425.0000 -74.54096 -72.06792 2.47305 1.96579 -72.05102 594.15276
5430.0000 -75.07945 -72.87741 2.20204 1.90859 -72.61554 517.78149
5435.0000 -74.29603 -72.40126 1.89478 1.89685 -72.73138 523.94502
5440.0000 -74.54702 -72.04579 2.50124 1.95100 -72.19701 576.50777
5445.0000 -74.13122 -71.79924 2.33199 1.99471 -71.76563 587.73520
5450.0000 -74.23138 -71.35590 2.87548 2.00739 -71.64057 577.98981
5455.0000 -73.98548 -71.81338 2.17210 2.02522 -71.46459 581.58751
5460.0000 -74.53712 -72.77626 1.76085 1.90824 -72.61900 480.62803
5465.0000 -73.75924 -72.12867 1.63056 1.93533 -72.35167 520.36562
5470.0000 -74.32164 -72.31470 2.00694 1.94941 -72.21267 520.42943
5475.0000 -74.31746 -72.16695 2.15052 1.96322 -72.07645 581.58326
5480.0000 -74.90598 -72.12318 2.78280 1.99491 -71.76367 602.55844
5485.0000 -74.90539 -72.76242 2.14297 1.93486 -72.35629 564.72382
5490.0000 -75.13830 -73.63665 1.50164 1.81983 -73.49142 436.69547
5495.0000 -74.34861 -71.96857 2.38004 1.89765 -72.72343 513.02190
5500.0000 -74.58227 -72.41368 2.16859 1.93880 -72.31741 538.20643
FREEZING PROCESS: loop number 23 T-loop= 502.00000000000000
main_MD> interactions number 23 at Temperature= 502.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.16333 2.74652 0.53922
force_rgl> df(natom) -1.49538 1.09688 0.55991
5505.0000 -75.24468 -73.24046 2.00421 1.87219 -72.97473 489.52344
5510.0000 -75.00996 -72.90342 2.10655 1.86677 -73.02820 487.37574
5515.0000 -74.75091 -72.63436 2.11655 1.88517 -72.84664 500.61377
5520.0000 -75.53386 -73.51050 2.02336 1.87631 -72.93409 501.87432
5525.0000 -74.55035 -72.37103 2.17933 1.88349 -72.86322 513.53746
5530.0000 -74.95045 -72.92314 2.02732 1.91785 -72.52409 537.05221
5535.0000 -74.65126 -72.80644 1.84482 1.88753 -72.82338 472.16420
5540.0000 -74.71971 -72.40980 2.30992 1.89220 -72.77724 502.46021
5545.0000 -74.63532 -72.89793 1.73738 1.89447 -72.75486 517.99118
5550.0000 -74.64724 -72.52812 2.11912 1.89253 -72.77402 526.25752
5555.0000 -75.20959 -72.63982 2.56977 1.89313 -72.76807 531.10192
5560.0000 -74.66988 -72.64905 2.02083 1.89172 -72.78203 530.73306
5565.0000 -75.01886 -73.26259 1.75627 1.86718 -73.02417 491.11872
5570.0000 -75.17169 -73.05269 2.11901 1.84735 -73.21982 470.66204
5575.0000 -74.82106 -72.70692 2.11413 1.87558 -72.94124 496.01484
5580.0000 -74.96363 -72.48068 2.48294 1.90913 -72.61014 520.44028
5585.0000 -74.84629 -72.70467 2.14162 1.89679 -72.73200 513.70276
5590.0000 -74.77166 -72.67911 2.09255 1.90082 -72.69219 518.79110
5595.0000 -74.51014 -72.76239 1.74775 1.91044 -72.59726 516.86331
5600.0000 -74.71209 -72.31583 2.39626 1.91337 -72.56835 522.02133
5605.0000 -74.74682 -72.78216 1.96465 1.92970 -72.40720 582.86161
5610.0000 -74.81351 -72.98945 1.82405 1.89784 -72.72159 516.66753
5615.0000 -75.19259 -72.99244 2.20015 1.87564 -72.94070 502.58382
5620.0000 -74.86955 -72.64811 2.22143 1.93292 -72.37542 561.74790
5625.0000 -74.70095 -72.48253 2.21842 1.91722 -72.53038 514.26413
5630.0000 -74.61564 -72.65323 1.96241 1.92998 -72.40447 495.41631
5635.0000 -75.07841 -72.92584 2.15257 1.88118 -72.88602 492.21389
5640.0000 -75.22301 -73.07733 2.14568 1.89737 -72.72620 540.34059
5645.0000 -74.82473 -72.98005 1.84468 1.88894 -72.80945 516.78933
5650.0000 -75.15739 -73.37148 1.78591 1.87133 -72.98317 500.42900
5655.0000 -74.81556 -73.01631 1.79925 1.84090 -73.28345 462.95574
5660.0000 -74.81913 -73.15981 1.65932 1.87861 -72.91134 496.03818
5665.0000 -75.12477 -73.00610 2.11867 1.83842 -73.30797 481.72967
5670.0000 -75.40611 -73.27220 2.13391 1.83099 -73.38133 455.43085
5675.0000 -75.02733 -73.09819 1.92914 1.88349 -72.86316 508.14699
5680.0000 -74.36989 -72.70815 1.66175 1.87969 -72.90069 485.46208
5685.0000 -74.76554 -72.80847 1.95706 1.93685 -72.33662 560.82176
5690.0000 -74.83330 -72.73080 2.10249 1.93368 -72.36787 575.42900
5695.0000 -74.84957 -72.81377 2.03580 1.88807 -72.81803 507.53524
5700.0000 -74.35195 -72.58175 1.77020 1.91079 -72.59384 548.99933
5705.0000 -74.37006 -72.30984 2.06021 1.91161 -72.58569 531.32422
5710.0000 -75.42288 -73.20322 2.21966 1.93247 -72.37990 531.20030
5715.0000 -74.93901 -73.14090 1.79810 1.87913 -72.90620 498.59703
5720.0000 -74.33041 -72.32396 2.00645 1.91053 -72.59639 525.99041
5725.0000 -74.77474 -72.53496 2.23978 1.91835 -72.51918 518.24797
5730.0000 -75.09887 -73.37711 1.72175 1.90465 -72.65435 525.27974
5735.0000 -75.20809 -72.95655 2.25154 1.87318 -72.96490 481.57198
5740.0000 -74.76214 -72.90633 1.85581 1.88588 -72.83962 529.12914
5745.0000 -75.03454 -72.59161 2.44293 1.86985 -72.99783 495.01257
5750.0000 -74.62301 -72.12645 2.49656 1.94335 -72.27247 551.32693
FREEZING PROCESS: loop number 24 T-loop= 477.00000000000000
main_MD> interactions number 24 at Temperature= 477.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.24413 1.53344 -2.73784
force_rgl> df(natom) -1.66134 1.01054 1.28828
5755.0000 -74.70880 -72.48827 2.22052 1.95088 -72.19815 552.01667
5760.0000 -74.90380 -72.29568 2.60812 1.95227 -72.18449 606.96407
5765.0000 -74.41060 -71.98727 2.42333 1.91848 -72.51790 540.07892
5770.0000 -74.98487 -73.06512 1.91975 1.91719 -72.53065 527.16474
5775.0000 -75.42620 -73.33615 2.09004 1.85128 -73.18104 449.98568
5780.0000 -75.36655 -73.75932 1.60723 1.82539 -73.43660 424.93972
5785.0000 -74.97291 -73.61887 1.35403 1.81649 -73.52438 416.59836
5790.0000 -74.91089 -73.23310 1.67779 1.84491 -73.24392 459.16681
5795.0000 -75.45281 -73.42920 2.02362 1.83659 -73.32598 456.30697
5800.0000 -74.55972 -72.69415 1.86557 1.83821 -73.31000 464.68240
5805.0000 -75.41052 -73.57669 1.83383 1.84512 -73.24181 465.61431
5810.0000 -74.90139 -72.85121 2.05018 1.88218 -72.87609 512.32398
5815.0000 -75.23265 -73.55123 1.68142 1.89133 -72.78579 484.83340
5820.0000 -74.85966 -73.06509 1.79457 1.83516 -73.34017 452.58270
5825.0000 -75.49335 -73.52195 1.97140 1.83639 -73.32797 446.31154
5830.0000 -74.87902 -72.95175 1.92727 1.85828 -73.11199 485.19623
5835.0000 -74.85967 -73.16739 1.69228 1.87334 -72.96339 484.74390
5840.0000 -74.80572 -73.12153 1.68419 1.83090 -73.38217 441.25581
5845.0000 -75.09844 -73.25998 1.83847 1.82160 -73.47393 435.89429
5850.0000 -75.25830 -73.39418 1.86413 1.81969 -73.49283 430.28426
5855.0000 -75.20866 -73.74671 1.46195 1.80878 -73.60048 442.81605
5860.0000 -74.93269 -72.98030 1.95239 1.82005 -73.48928 446.04121
5865.0000 -74.87678 -72.74874 2.12805 1.87858 -72.91168 477.12623
5870.0000 -75.21310 -73.26613 1.94697 1.85561 -73.13831 474.32366
5875.0000 -75.00654 -73.25387 1.75268 1.85468 -73.14754 487.08793
5880.0000 -75.17968 -73.59798 1.58170 1.83480 -73.34367 436.49014
5885.0000 -75.03760 -73.24472 1.79289 1.83428 -73.34886 450.91010
5890.0000 -74.52615 -72.91490 1.61125 1.85700 -73.12462 478.87725
5895.0000 -74.84895 -72.59641 2.25254 1.86670 -73.02893 495.28232
5900.0000 -75.25755 -73.10126 2.15629 1.88901 -72.80877 522.55969
5905.0000 -75.37429 -73.52030 1.85399 1.84938 -73.19985 478.47035
5910.0000 -74.99101 -72.54193 2.44908 1.87028 -72.99359 488.39771
5915.0000 -74.69023 -72.71400 1.97624 1.93024 -72.40185 531.22091
5920.0000 -75.39964 -73.27708 2.12255 1.84182 -73.27447 474.46160
5925.0000 -74.72002 -72.58434 2.13568 1.86178 -73.07748 480.83335
5930.0000 -75.24671 -73.59030 1.65642 1.84501 -73.24290 448.88325
5935.0000 -75.59912 -74.02076 1.57836 1.79098 -73.77615 388.78301
5940.0000 -75.09166 -73.48336 1.60830 1.78860 -73.79959 416.24003
5945.0000 -75.17881 -73.23662 1.94219 1.82755 -73.41524 427.87132
5950.0000 -74.58843 -72.40106 2.18737 1.89293 -72.77000 513.78165
5955.0000 -74.28553 -72.41882 1.86671 1.96561 -72.05283 572.86372
5960.0000 -74.67737 -72.87977 1.79760 1.90672 -72.63399 527.37425
5965.0000 -74.89948 -73.22793 1.67155 1.89051 -72.79396 520.69456
5970.0000 -74.91517 -72.79441 2.12076 1.87668 -72.93037 477.17328
5975.0000 -74.29235 -72.24414 2.04821 1.93073 -72.39703 518.48389
5980.0000 -74.04823 -72.66833 1.37990 1.91762 -72.52645 493.39772
5985.0000 -74.95132 -72.87444 2.07689 1.86208 -73.07444 482.69246
5990.0000 -74.49761 -72.94756 1.55005 1.89319 -72.76745 531.31976
5995.0000 -74.99030 -73.23634 1.75396 1.87515 -72.94547 500.30231
6000.0000 -74.54505 -72.70063 1.84442 1.85727 -73.12192 465.11848
FREEZING PROCESS: loop number 25 T-loop= 452.00000000000000
main_MD> interactions number 25 at Temperature= 452.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.31096 0.65136 0.43308
force_rgl> df(natom) -0.41732 -1.26428 -2.71165
6005.0000 -75.02836 -72.78832 2.24004 1.87117 -72.98481 488.22434
6010.0000 -74.77560 -72.90626 1.86934 1.89347 -72.76472 510.48797
6015.0000 -75.14848 -73.24543 1.90305 1.88584 -72.84000 497.41370
6020.0000 -75.21412 -73.23411 1.98001 1.87193 -72.97733 494.58046
6025.0000 -74.83080 -73.08286 1.74794 1.85105 -73.18336 475.58914
6030.0000 -75.38176 -73.84216 1.53961 1.83939 -73.29837 464.52129
6035.0000 -75.34745 -73.82079 1.52666 1.80123 -73.67497 416.70337
6040.0000 -75.68734 -73.78841 1.89893 1.77498 -73.93400 390.89933
6045.0000 -75.70454 -74.03287 1.67167 1.78007 -73.88375 384.31008
6050.0000 -75.12174 -73.18668 1.93506 1.81308 -73.55803 417.36902
6055.0000 -75.17093 -73.09712 2.07380 1.83382 -73.35335 474.36321
6060.0000 -74.55785 -72.59719 1.96066 1.90594 -72.64166 511.07589
6065.0000 -74.73510 -73.12247 1.61263 1.88561 -72.84232 511.97080
6070.0000 -75.30253 -73.55753 1.74499 1.82511 -73.43934 430.08347
6075.0000 -75.13236 -73.49685 1.63551 1.81075 -73.58105 417.86619
6080.0000 -75.07311 -73.15900 1.91412 1.83061 -73.38501 444.17887
6085.0000 -75.61868 -73.83406 1.78462 1.80326 -73.65490 414.13346
6090.0000 -75.42004 -73.40902 2.01103 1.80472 -73.64057 418.11261
6095.0000 -75.10726 -73.23263 1.87463 1.85931 -73.10183 485.34446
6100.0000 -74.62675 -72.82845 1.79830 1.87642 -72.93301 500.22519
6105.0000 -75.07855 -73.46897 1.60958 1.81719 -73.51751 438.02614
6110.0000 -75.09127 -73.29097 1.80030 1.81548 -73.53439 434.57934
6115.0000 -74.92523 -73.39016 1.53507 1.86514 -73.04429 504.31343
6120.0000 -75.42413 -73.79937 1.62476 1.80376 -73.65005 434.81558
6125.0000 -75.13709 -73.36642 1.77066 1.80125 -73.67480 406.70335
6130.0000 -75.64339 -73.55332 2.09007 1.82719 -73.41876 419.54614
6135.0000 -75.22462 -73.54852 1.67610 1.79278 -73.75841 416.86762
6140.0000 -74.98554 -73.24598 1.73957 1.85017 -73.19202 493.67408
6145.0000 -75.13373 -73.49649 1.63724 1.83925 -73.29982 463.54319
6150.0000 -75.31767 -73.23848 2.07918 1.83402 -73.35142 458.77781
6155.0000 -75.04492 -73.07277 1.97215 1.86892 -73.00703 502.02191
6160.0000 -75.28628 -73.76163 1.52465 1.82527 -73.43774 451.42284
6165.0000 -75.39079 -73.65897 1.73182 1.78097 -73.87487 394.74145
6170.0000 -75.26651 -73.63002 1.63649 1.79937 -73.69335 405.11729
6175.0000 -74.77000 -72.79373 1.97627 1.85379 -73.15631 469.88502
6180.0000 -75.05587 -73.00125 2.05462 1.86705 -73.02545 498.40856
6185.0000 -75.39584 -73.21518 2.18066 1.84854 -73.20814 444.73977
6190.0000 -75.13370 -73.11183 2.02187 1.80589 -73.62895 436.63914
6195.0000 -75.28535 -74.00709 1.27826 1.79608 -73.72576 430.11046
6200.0000 -75.15690 -73.61713 1.53977 1.79324 -73.75383 407.45470
6205.0000 -75.68292 -73.98478 1.69814 1.77534 -73.93045 393.66520
6210.0000 -75.49995 -73.45591 2.04404 1.80728 -73.61525 435.93324
6215.0000 -75.48224 -73.48714 1.99510 1.84733 -73.22006 493.07459
6220.0000 -74.82360 -73.08461 1.73899 1.81308 -73.55806 437.24994
6225.0000 -75.28076 -73.59970 1.68106 1.81977 -73.49203 433.64352
6230.0000 -75.17424 -73.29696 1.87728 1.85900 -73.10490 496.16723
6235.0000 -74.88575 -73.14681 1.73894 1.81119 -73.57669 442.72654
6240.0000 -75.00620 -73.31597 1.69023 1.82738 -73.41694 454.33759
6245.0000 -75.12755 -73.50272 1.62483 1.81320 -73.55682 448.00896
6250.0000 -75.58043 -74.03491 1.54552 1.79778 -73.70900 439.88162
FREEZING PROCESS: loop number 26 T-loop= 427.00000000000000
main_MD> interactions number 26 at Temperature= 427.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.14308 1.47891 -0.34717
force_rgl> df(natom) 0.20285 0.59579 -0.59331
6255.0000 -75.34814 -74.00386 1.34428 1.76838 -73.99913 403.61978
6260.0000 -75.76031 -74.09658 1.66373 1.75696 -74.11186 382.22847
6265.0000 -75.30431 -73.65993 1.64437 1.78201 -73.86461 413.51510
6270.0000 -75.57951 -74.18280 1.39671 1.77549 -73.92894 395.15259
6275.0000 -75.46329 -73.88783 1.57546 1.76424 -74.03999 379.58635
6280.0000 -75.38509 -73.60767 1.77742 1.79749 -73.71184 414.78126
6285.0000 -75.44995 -73.30054 2.14941 1.80537 -73.63413 415.33163
6290.0000 -75.23976 -73.39286 1.84690 1.80099 -73.67733 430.68222
6295.0000 -75.07035 -73.63223 1.43811 1.79806 -73.70626 399.19727
6300.0000 -75.71746 -74.00566 1.71179 1.78814 -73.80411 384.67044
6305.0000 -75.39756 -73.53853 1.85903 1.78185 -73.86623 399.26128
6310.0000 -75.39814 -73.61081 1.78732 1.79088 -73.77710 413.75035
6315.0000 -75.58032 -73.52810 2.05223 1.80652 -73.62273 437.20234
6320.0000 -75.10490 -72.85470 2.25020 1.85921 -73.10282 481.72198
6325.0000 -74.92956 -73.59187 1.33768 1.87359 -72.96087 505.41402
6330.0000 -74.92699 -73.23098 1.69602 1.82544 -73.43603 454.69368
6335.0000 -75.58225 -73.91477 1.66749 1.80833 -73.60488 446.76198
6340.0000 -75.88168 -73.55444 2.32724 1.79822 -73.70469 415.80148
6345.0000 -75.20364 -73.61338 1.59025 1.80824 -73.60584 426.32572
6350.0000 -75.07678 -73.07816 1.99862 1.83065 -73.38469 426.58724
6355.0000 -74.88110 -73.04426 1.83684 1.86719 -73.02404 464.91655
6360.0000 -75.31785 -73.38382 1.93403 1.83483 -73.34341 445.44742
6365.0000 -75.00572 -73.67473 1.33099 1.80178 -73.66959 410.26321
6370.0000 -75.85143 -73.90661 1.94481 1.81708 -73.51857 442.88000
6375.0000 -75.32928 -73.79262 1.53666 1.82524 -73.43808 439.58652
6380.0000 -74.81855 -73.23038 1.58817 1.81582 -73.53095 416.59068
6385.0000 -74.44720 -72.56821 1.87899 1.87178 -72.97875 493.31900
6390.0000 -74.99637 -73.61006 1.38631 1.89402 -72.75927 513.94885
6395.0000 -75.10952 -73.62188 1.48764 1.80217 -73.66567 425.85088
6400.0000 -75.71730 -74.05797 1.65934 1.77309 -73.95262 398.04845
6405.0000 -75.80138 -74.09412 1.70726 1.76039 -74.07798 386.36706
6410.0000 -75.72805 -74.28047 1.44759 1.73935 -74.28566 365.72424
6415.0000 -75.30094 -73.95801 1.34293 1.74934 -74.18708 378.52309
6420.0000 -75.66460 -73.92120 1.74340 1.76854 -73.99760 393.34146
6425.0000 -75.36269 -73.16947 2.19322 1.80574 -73.63044 434.21488
6430.0000 -75.23255 -73.22613 2.00642 1.82968 -73.39420 457.98372
6435.0000 -75.58415 -73.95872 1.62543 1.79773 -73.70949 424.55701
6440.0000 -75.74830 -73.72787 2.02043 1.77620 -73.92197 391.20718
6445.0000 -75.51875 -73.45374 2.06501 1.78331 -73.85180 413.04082
6450.0000 -75.28038 -73.39643 1.88395 1.84613 -73.23191 478.49236
6455.0000 -75.58712 -73.84518 1.74194 1.82471 -73.44324 447.79845
6460.0000 -75.24177 -73.87438 1.36739 1.77244 -73.95905 393.61937
6465.0000 -75.54828 -74.03354 1.51473 1.78412 -73.84377 405.67434
6470.0000 -75.34082 -73.75420 1.58663 1.77268 -73.95671 381.03698
6475.0000 -75.53332 -73.84168 1.69164 1.78662 -73.81911 408.78603
6480.0000 -75.44239 -73.48367 1.95872 1.79154 -73.77062 421.72458
6485.0000 -75.40605 -74.16718 1.23887 1.77540 -73.92991 394.31374
6490.0000 -75.39023 -73.38022 2.01000 1.81294 -73.55944 421.88886
6495.0000 -75.26174 -73.38297 1.87877 1.81589 -73.53025 451.34192
6500.0000 -74.50851 -72.83050 1.67801 1.85565 -73.13792 489.14592
FREEZING PROCESS: loop number 27 T-loop= 402.00000000000000
main_MD> interactions number 27 at Temperature= 402.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.02397 -1.55892 -1.02470
force_rgl> df(natom) 1.81493 2.28444 -1.75255
6505.0000 -74.63012 -72.50904 2.12108 1.90463 -72.65456 508.87150
6510.0000 -75.18244 -73.36127 1.82117 1.85163 -73.17765 462.00868
6515.0000 -74.75890 -73.32998 1.42892 1.82064 -73.48343 438.79330
6520.0000 -75.06640 -73.62092 1.44548 1.81034 -73.58506 436.90007
6525.0000 -75.45089 -74.23380 1.21708 1.80178 -73.66954 417.57565
6530.0000 -75.15854 -73.73270 1.42584 1.75353 -74.14573 364.46137
6535.0000 -75.86706 -74.49618 1.37088 1.77251 -73.95840 384.72496
6540.0000 -75.60314 -74.11949 1.48365 1.73490 -74.32954 344.97000
6545.0000 -75.65179 -73.89691 1.75488 1.76888 -73.99420 384.20513
6550.0000 -74.95314 -73.44857 1.50457 1.77600 -73.92393 389.43974
6555.0000 -75.75461 -74.26552 1.48909 1.79569 -73.72964 406.48470
6560.0000 -75.57564 -73.81584 1.75980 1.80682 -73.61980 424.14516
6565.0000 -75.29824 -73.75569 1.54256 1.79566 -73.72994 405.28611
6570.0000 -75.40639 -73.78780 1.61859 1.79491 -73.73730 396.77529
6575.0000 -75.91630 -74.65002 1.26628 1.74883 -74.19211 366.90068
6580.0000 -75.67519 -74.38045 1.29474 1.72321 -74.44486 326.74064
6585.0000 -75.86824 -74.55982 1.30842 1.73102 -74.36778 343.38786
6590.0000 -75.53730 -74.11137 1.42593 1.73982 -74.28098 349.28652
6595.0000 -75.22330 -73.63837 1.58493 1.78101 -73.87452 383.35975
6600.0000 -75.28106 -73.80247 1.47859 1.76737 -74.00914 353.08255
6605.0000 -75.25659 -73.45476 1.80183 1.81965 -73.49324 407.16463
6610.0000 -75.48779 -73.64976 1.83803 1.82242 -73.46589 451.95265
6615.0000 -75.66796 -74.01900 1.64896 1.75983 -74.08348 389.61791
6620.0000 -75.70560 -74.42554 1.28006 1.75732 -74.10828 388.40508
6625.0000 -75.12077 -73.64103 1.47974 1.76343 -74.04795 405.11222
6630.0000 -75.34147 -73.59670 1.74477 1.79569 -73.72964 438.52676
6635.0000 -75.29791 -73.47422 1.82368 1.81325 -73.55632 453.80568
6640.0000 -74.89861 -73.26720 1.63141 1.82280 -73.46208 439.47609
6645.0000 -75.48868 -74.18150 1.30718 1.76158 -74.06622 368.03550
6650.0000 -75.42867 -74.05663 1.37204 1.74123 -74.26703 356.42834
6655.0000 -75.63464 -74.24118 1.39346 1.76747 -74.00816 382.64261
6660.0000 -75.66105 -74.29717 1.36388 1.77884 -73.89592 387.82145
6665.0000 -75.58677 -74.10960 1.47717 1.76535 -74.02906 382.73591
6670.0000 -75.02218 -73.61513 1.40705 1.79382 -73.74813 407.46356
6675.0000 -75.47992 -74.12351 1.35641 1.75353 -74.14569 364.41497
6680.0000 -75.64967 -73.91647 1.73320 1.75700 -74.11141 365.18699
6685.0000 -75.42637 -73.57240 1.85397 1.77185 -73.96486 382.43390
6690.0000 -75.28194 -73.47706 1.80488 1.80021 -73.68503 413.35679
6695.0000 -75.08939 -73.74600 1.34339 1.76970 -73.98614 382.05054
6700.0000 -75.25117 -73.73918 1.51199 1.78910 -73.79470 400.35844
6705.0000 -75.42442 -73.73644 1.68798 1.79994 -73.68769 410.22213
6710.0000 -75.75183 -74.32240 1.42942 1.77219 -73.96156 382.28197
6715.0000 -75.55225 -74.11419 1.43807 1.74942 -74.18628 345.34665
6720.0000 -76.08279 -74.71394 1.36885 1.74525 -74.22738 357.46489
6725.0000 -75.36091 -73.80778 1.55313 1.75863 -74.09534 372.87990
6730.0000 -75.61077 -74.06909 1.54168 1.82087 -73.48116 421.55520
6735.0000 -75.28725 -73.40013 1.88711 1.82851 -73.40572 434.30606
6740.0000 -75.75431 -74.11589 1.63842 1.78051 -73.87947 384.10299
6745.0000 -75.39249 -73.57173 1.82076 1.78071 -73.87749 413.54278
6750.0000 -74.94130 -73.44970 1.49160 1.81962 -73.49348 453.82875
FREEZING PROCESS: loop number 28 T-loop= 377.00000000000000
main_MD> interactions number 28 at Temperature= 377.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.15696 0.56913 3.68106
force_rgl> df(natom) -1.19615 2.98197 -2.65346
6755.0000 -75.51818 -73.74998 1.76819 1.80665 -73.62146 439.59460
6760.0000 -75.83650 -74.33270 1.50380 1.76105 -74.07143 371.26446
6765.0000 -75.57081 -74.27747 1.29334 1.72639 -74.41356 343.87424
6770.0000 -75.86379 -74.38693 1.47686 1.73690 -74.30978 352.19668
6775.0000 -76.13190 -74.41834 1.71356 1.72080 -74.46872 337.47664
6780.0000 -75.82608 -74.06064 1.76544 1.74448 -74.23499 375.28461
6785.0000 -75.33404 -73.76248 1.57156 1.76838 -73.99913 396.56636
6790.0000 -75.56480 -73.89938 1.66542 1.79333 -73.75297 411.89848
6795.0000 -75.47022 -74.26768 1.20253 1.76539 -74.02867 351.92882
6800.0000 -75.69323 -73.87538 1.81785 1.74091 -74.27020 339.87358
6805.0000 -75.36178 -74.04121 1.32057 1.76552 -74.02732 369.88911
6810.0000 -75.28648 -73.79107 1.49541 1.76147 -74.06736 372.04340
6815.0000 -75.30905 -74.13311 1.17594 1.75640 -74.11736 371.89581
6820.0000 -75.34279 -74.22253 1.12026 1.74875 -74.19289 356.77567
6825.0000 -75.59722 -74.21578 1.38144 1.74310 -74.24857 352.80430
6830.0000 -75.28617 -73.50970 1.77647 1.77140 -73.96934 386.48935
6835.0000 -75.79365 -74.17987 1.61378 1.77761 -73.90808 405.30772
6840.0000 -75.25436 -73.47972 1.77464 1.77830 -73.90126 397.39786
6845.0000 -75.39965 -73.78283 1.61682 1.78542 -73.83095 412.45875
6850.0000 -75.82489 -74.07236 1.75253 1.77828 -73.90141 417.59228
6855.0000 -75.73050 -74.50424 1.22626 1.69959 -74.67801 318.95445
6860.0000 -75.69826 -74.06224 1.63602 1.73321 -74.34626 353.88626
6865.0000 -75.88889 -74.32445 1.56444 1.75170 -74.16375 361.90389
6870.0000 -75.65548 -73.79067 1.86482 1.76125 -74.06951 386.96024
6875.0000 -75.35582 -73.66231 1.69351 1.77242 -73.95933 395.63543
6880.0000 -75.81445 -74.39781 1.41664 1.74348 -74.24487 364.00339
6885.0000 -75.61247 -74.21036 1.40211 1.75324 -74.14855 365.98899
6890.0000 -75.56122 -73.87242 1.68880 1.74977 -74.18278 372.08319
6895.0000 -75.31132 -73.64283 1.66849 1.81865 -73.50303 454.12298
6900.0000 -75.68531 -74.08059 1.60471 1.78394 -73.84563 407.84584
6905.0000 -75.98092 -74.52979 1.45113 1.74598 -74.22018 365.22882
6910.0000 -75.63132 -74.09747 1.53385 1.72982 -74.37968 339.36958
6915.0000 -75.26638 -73.61147 1.65491 1.77377 -73.94591 408.39743
6920.0000 -75.58158 -73.95845 1.62313 1.79400 -73.74632 408.37552
6925.0000 -75.33999 -73.82382 1.51618 1.78670 -73.81841 386.77537
6930.0000 -75.77358 -74.33052 1.44306 1.75693 -74.11213 369.78410
6935.0000 -75.59300 -73.94338 1.64962 1.75773 -74.10419 376.57646
6940.0000 -75.40365 -73.74171 1.66195 1.78037 -73.88087 390.89728
6945.0000 -75.69457 -73.79837 1.89619 1.79179 -73.76813 418.43431
6950.0000 -75.77891 -74.00641 1.77250 1.77544 -73.92946 399.84447
6955.0000 -75.99152 -74.49689 1.49463 1.73623 -74.31638 353.96723
6960.0000 -75.36747 -73.83875 1.52872 1.74523 -74.22759 362.50525
6965.0000 -75.05668 -73.78030 1.27638 1.77369 -73.94672 402.33016
6970.0000 -75.29955 -73.61126 1.68830 1.79366 -73.74963 430.60871
6975.0000 -76.05414 -75.03218 1.02197 1.74636 -74.21645 370.91638
6980.0000 -75.67824 -74.31783 1.36041 1.70728 -74.60207 330.40730
6985.0000 -75.43457 -73.72558 1.70899 1.76979 -73.98519 390.32065
6990.0000 -75.60549 -73.91898 1.68651 1.77095 -73.97374 377.21629
6995.0000 -75.74581 -74.28353 1.46227 1.76325 -74.04981 385.21707
7000.0000 -75.69312 -74.00730 1.68581 1.76400 -74.04236 388.85214
FREEZING PROCESS: loop number 29 T-loop= 352.00000000000000
main_MD> interactions number 29 at Temperature= 352.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.31886 0.91090 0.39104
force_rgl> df(natom) 1.04510 -1.99373 -1.21633
7005.0000 -75.81330 -74.59232 1.22098 1.74364 -74.24326 364.23013
7010.0000 -75.80121 -74.52752 1.27369 1.70934 -74.58181 325.68973
7015.0000 -75.94591 -74.48862 1.45729 1.72517 -74.42559 358.13509
7020.0000 -76.01457 -74.64738 1.36718 1.71680 -74.50815 349.65342
7025.0000 -75.09589 -73.94329 1.15260 1.71852 -74.49118 328.77940
7030.0000 -75.38808 -73.70133 1.68675 1.77283 -73.95519 385.32390
7035.0000 -75.83838 -74.18222 1.65617 1.77994 -73.88503 405.08141
7040.0000 -75.92520 -74.79456 1.13064 1.72694 -74.40805 339.63245
7045.0000 -75.61696 -74.36453 1.25243 1.70843 -74.59073 316.32959
7050.0000 -75.59581 -73.84070 1.75511 1.75480 -74.13312 357.09040
7055.0000 -75.28324 -73.86671 1.41653 1.76795 -74.00340 381.16691
7060.0000 -75.12007 -73.85267 1.26740 1.75784 -74.10313 377.48935
7065.0000 -75.89784 -74.30296 1.59487 1.77629 -73.92105 404.55469
7070.0000 -75.67182 -74.11596 1.55585 1.75597 -74.12164 372.57763
7075.0000 -75.66287 -74.66622 0.99665 1.71877 -74.48874 311.38407
7080.0000 -75.72709 -74.22633 1.50076 1.72387 -74.43835 340.12418
7085.0000 -75.92838 -74.41836 1.51001 1.73108 -74.36724 346.79928
7090.0000 -75.55987 -74.20784 1.35203 1.72621 -74.41526 346.47059
7095.0000 -75.71045 -74.34371 1.36674 1.75119 -74.16882 362.45526
7100.0000 -75.67138 -73.98794 1.68344 1.72672 -74.41030 337.00309
7105.0000 -75.78025 -74.51063 1.26962 1.75787 -74.10286 378.03183
7110.0000 -75.72908 -74.38758 1.34151 1.71710 -74.50516 331.33155
7115.0000 -75.73643 -73.74731 1.98912 1.75841 -74.09752 379.71001
7120.0000 -75.35375 -74.17605 1.17770 1.76854 -73.99757 363.75151
7125.0000 -75.63672 -74.22258 1.41414 1.76296 -74.05259 357.31021
7130.0000 -75.82504 -74.33778 1.48725 1.72790 -74.39865 335.46781
7135.0000 -75.90894 -74.60320 1.30574 1.71706 -74.50560 337.02954
7140.0000 -75.62903 -74.28854 1.34049 1.72817 -74.39598 346.94459
7145.0000 -75.87819 -74.56014 1.31804 1.72793 -74.39835 346.60761
7150.0000 -75.90982 -74.51445 1.39537 1.72777 -74.39985 353.18963
7155.0000 -75.75542 -74.54368 1.21174 1.69519 -74.72137 306.88385
7160.0000 -75.77995 -74.16923 1.61072 1.75002 -74.18031 368.52329
7165.0000 -75.67212 -74.55741 1.11471 1.73167 -74.36137 365.82766
7170.0000 -75.97452 -74.69759 1.27693 1.71870 -74.48942 345.77244
7175.0000 -75.81448 -74.43749 1.37699 1.72067 -74.46997 340.59190
7180.0000 -76.01925 -74.91198 1.10728 1.72606 -74.41679 338.76512
7185.0000 -75.92180 -74.41801 1.50379 1.68786 -74.79369 280.54956
7190.0000 -75.42726 -74.27464 1.15261 1.73643 -74.31447 343.35831
7195.0000 -75.53596 -74.23021 1.30575 1.75545 -74.12675 367.85275
7200.0000 -75.66550 -73.83232 1.83318 1.75545 -74.12677 373.72894
7205.0000 -75.87712 -74.30949 1.56763 1.78324 -73.85250 408.32326
7210.0000 -75.64504 -74.39825 1.24679 1.75270 -74.15392 355.69239
7215.0000 -75.33447 -73.83529 1.49917 1.76142 -74.06784 360.96648
7220.0000 -75.88524 -74.07991 1.80533 1.78166 -73.86813 392.47567
7225.0000 -75.45968 -74.07188 1.38779 1.74021 -74.27714 341.78882
7230.0000 -75.82862 -74.32060 1.50803 1.76715 -74.01128 392.27254
7235.0000 -75.29479 -73.75388 1.54091 1.75431 -74.13801 395.08928
7240.0000 -75.24591 -73.88555 1.36036 1.77953 -73.88913 386.12960
7245.0000 -76.13707 -74.59599 1.54108 1.73397 -74.33868 339.74426
7250.0000 -75.92491 -74.50218 1.42273 1.72776 -74.39995 331.44950
FREEZING PROCESS: loop number 30 T-loop= 327.00000000000000
main_MD> interactions number 30 at Temperature= 327.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.72346 0.68858 -1.55857
force_rgl> df(natom) 0.35212 -1.98427 1.78336
7255.0000 -75.76593 -74.48867 1.27726 1.71261 -74.54951 308.84529
7260.0000 -75.64811 -74.15872 1.48939 1.74874 -74.19294 372.31904
7265.0000 -75.71071 -74.39229 1.31841 1.74695 -74.21058 369.01941
7270.0000 -75.91998 -74.61509 1.30489 1.71660 -74.51013 329.14129
7275.0000 -75.88502 -74.70865 1.17637 1.69639 -74.70952 307.04231
7280.0000 -76.05847 -75.01281 1.04566 1.66431 -75.02613 273.91007
7285.0000 -75.78498 -74.69420 1.09078 1.65849 -75.08358 267.62228
7290.0000 -75.96851 -74.55314 1.41537 1.71785 -74.49776 330.15624
7295.0000 -75.63875 -74.36598 1.27277 1.71372 -74.53851 330.85217
7300.0000 -75.91766 -74.53599 1.38167 1.73477 -74.33081 360.05924
7305.0000 -76.06999 -75.20810 0.86189 1.69748 -74.69880 323.97069
7310.0000 -76.11593 -75.04179 1.07414 1.68337 -74.83802 299.57941
7315.0000 -75.76508 -74.37063 1.39445 1.69175 -74.75531 304.85342
7320.0000 -76.08887 -74.78053 1.30833 1.69666 -74.70689 310.51161
7325.0000 -75.84829 -74.81417 1.03412 1.68384 -74.83337 299.01150
7330.0000 -75.87051 -74.03261 1.83790 1.72775 -74.40013 344.52021
7335.0000 -75.97297 -74.74137 1.23160 1.72871 -74.39065 339.39774
7340.0000 -75.95064 -74.49330 1.45734 1.70313 -74.64309 310.66220
7345.0000 -75.65776 -74.24037 1.41740 1.73945 -74.28467 358.13316
7350.0000 -76.23429 -74.95881 1.27548 1.74003 -74.27886 362.34994
7355.0000 -75.82164 -74.56407 1.25757 1.69686 -74.70497 312.50633
7360.0000 -75.96437 -74.60866 1.35571 1.72084 -74.46833 337.43743
7365.0000 -75.99388 -74.62737 1.36651 1.71858 -74.49060 336.05676
7370.0000 -75.58948 -74.13521 1.45427 1.73460 -74.33252 353.26063
7375.0000 -76.18140 -74.89165 1.28974 1.70973 -74.57794 327.63467
7380.0000 -75.95999 -74.77640 1.18359 1.67859 -74.88522 299.92183
7385.0000 -75.87864 -74.47523 1.40342 1.70685 -74.60629 326.64491
7390.0000 -75.97609 -75.03639 0.93970 1.68784 -74.79392 302.73872
7395.0000 -75.93325 -74.79867 1.13458 1.66281 -75.04092 258.83291
7400.0000 -75.89946 -74.40833 1.49113 1.72935 -74.38433 344.64998
7405.0000 -75.74055 -74.20860 1.53195 1.72748 -74.40279 346.48660
7410.0000 -75.94186 -74.42764 1.51422 1.72142 -74.46254 341.75082
7415.0000 -75.88699 -74.54667 1.34031 1.73033 -74.37459 342.85410
7420.0000 -75.20203 -73.82455 1.37748 1.74978 -74.18265 348.92651
7425.0000 -75.75969 -74.12262 1.63707 1.76689 -74.01389 382.89591
7430.0000 -75.45068 -74.14930 1.30138 1.74397 -74.24007 354.34054
7435.0000 -75.78156 -74.58283 1.19873 1.72430 -74.43418 331.08255
7440.0000 -76.15010 -75.34918 0.80093 1.67169 -74.95334 276.96214
7445.0000 -76.36197 -75.36240 0.99957 1.63339 -75.33126 226.22274
7450.0000 -75.84368 -74.68563 1.15805 1.66706 -74.99898 270.66057
7455.0000 -75.88819 -74.39851 1.48967 1.73881 -74.29097 351.42060
7460.0000 -76.10263 -75.08347 1.01916 1.72171 -74.45971 334.27177
7465.0000 -75.73350 -74.53816 1.19534 1.68277 -74.84393 292.90413
7470.0000 -76.17123 -74.70466 1.46658 1.69372 -74.73593 301.79075
7475.0000 -76.21162 -74.83665 1.37496 1.69092 -74.76351 293.34332
7480.0000 -75.71411 -74.52724 1.18687 1.69886 -74.68515 315.57838
7485.0000 -75.89440 -74.55831 1.33609 1.72037 -74.47289 333.90270
7490.0000 -75.91271 -74.22398 1.68873 1.72808 -74.39688 349.05833
7495.0000 -76.01853 -74.75935 1.25918 1.69651 -74.70834 310.12817
7500.0000 -75.53276 -74.31537 1.21739 1.72927 -74.38514 329.22252
FREEZING PROCESS: loop number 31 T-loop= 302.00000000000000
main_MD> interactions number 31 at Temperature= 302.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.34627 -0.59812 1.75105
force_rgl> df(natom) 0.55434 -0.78483 -0.40089
7505.0000 -75.39141 -74.09521 1.29620 1.75364 -74.14463 343.67298
7510.0000 -75.85563 -74.57457 1.28105 1.74271 -74.25250 355.47754
7515.0000 -75.94030 -74.46647 1.47383 1.72039 -74.47277 334.83798
7520.0000 -75.97380 -74.81917 1.15463 1.70169 -74.65729 320.84128
7525.0000 -76.07195 -74.70810 1.36385 1.67703 -74.90063 289.26652
7530.0000 -75.99796 -74.41297 1.58499 1.71539 -74.52209 322.04406
7535.0000 -75.84970 -74.57465 1.27506 1.71705 -74.50566 328.55463
7540.0000 -75.88169 -74.70984 1.17186 1.71118 -74.56361 323.05325
7545.0000 -75.96807 -74.62925 1.33882 1.70444 -74.63011 318.20433
7550.0000 -75.93850 -74.67588 1.26262 1.70839 -74.59114 314.19413
7555.0000 -75.91756 -74.83474 1.08282 1.67354 -74.93504 275.00976
7560.0000 -75.99800 -74.68963 1.30838 1.69230 -74.74993 290.49405
7565.0000 -75.66207 -74.28196 1.38011 1.71919 -74.48460 321.62230
7570.0000 -75.56691 -74.28080 1.28611 1.72390 -74.43806 329.50784
7575.0000 -75.59168 -74.35301 1.23867 1.73997 -74.27948 338.59219
7580.0000 -75.56449 -74.30569 1.25881 1.73398 -74.33863 353.76044
7585.0000 -75.91176 -74.90877 1.00299 1.70539 -74.62072 316.73699
7590.0000 -75.96051 -74.85739 1.10312 1.68556 -74.81642 291.87935
7595.0000 -75.76439 -74.24994 1.51445 1.70184 -74.65580 313.55851
7600.0000 -75.59531 -74.08716 1.50814 1.71053 -74.57002 326.79014
7605.0000 -75.72280 -74.30167 1.42113 1.73144 -74.36367 347.87426
7610.0000 -75.83243 -74.87243 0.96000 1.71536 -74.52238 335.58853
7615.0000 -76.20809 -74.97122 1.23687 1.68718 -74.80042 300.37204
7620.0000 -76.31766 -75.27900 1.03866 1.66622 -75.00732 287.91551
7625.0000 -76.24087 -75.12868 1.11219 1.63141 -75.35084 236.31992
7630.0000 -76.19117 -75.12506 1.06612 1.67113 -74.95887 276.57256
7635.0000 -76.25017 -75.15221 1.09795 1.65310 -75.13673 257.65429
7640.0000 -76.16816 -75.13961 1.02856 1.64869 -75.18027 252.42366
7645.0000 -76.20590 -75.16501 1.04088 1.66268 -75.04219 273.90959
7650.0000 -75.83845 -74.58153 1.25692 1.66383 -75.03091 272.71014
7655.0000 -76.23811 -74.72004 1.51807 1.69646 -74.70886 317.97923
7660.0000 -75.90036 -74.41249 1.48788 1.69701 -74.70346 310.78950
7665.0000 -76.01615 -74.53987 1.47629 1.71363 -74.53939 330.58266
7670.0000 -76.08597 -74.79825 1.28772 1.69489 -74.72437 317.10310
7675.0000 -75.88724 -74.44640 1.44084 1.71633 -74.51284 336.82852
7680.0000 -76.15717 -74.84210 1.31506 1.70032 -74.67077 317.61582
7685.0000 -76.11516 -74.66755 1.44761 1.69650 -74.70852 314.36418
7690.0000 -75.93384 -74.59752 1.33632 1.68678 -74.80440 301.81698
7695.0000 -75.87006 -74.82309 1.04697 1.68671 -74.80506 295.91985
7700.0000 -75.96184 -74.58247 1.37937 1.70074 -74.66666 314.09439
7705.0000 -75.93359 -74.70412 1.22946 1.70307 -74.64369 320.06829
7710.0000 -76.23978 -75.21445 1.02534 1.66520 -75.01734 277.49465
7715.0000 -76.03457 -74.89548 1.13909 1.66838 -74.98600 279.58656
7720.0000 -76.31247 -75.24744 1.06503 1.64956 -75.17171 255.63466
7725.0000 -76.12374 -75.05758 1.06615 1.66544 -75.01498 283.75361
7730.0000 -76.14451 -74.85230 1.29220 1.66762 -74.99344 279.30387
7735.0000 -76.03282 -74.79275 1.24007 1.67916 -74.87958 296.28206
7740.0000 -76.02794 -74.60150 1.42644 1.70545 -74.62019 315.17523
7745.0000 -76.07075 -74.80190 1.26886 1.66684 -75.00115 273.47793
7750.0000 -75.75984 -74.08470 1.67514 1.72033 -74.47332 337.50898
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 4 [min], 57.0799685 [s].
main_MD> Deallocating global variables
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