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_91.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 = 91 ntipo2 = 0 read_input> Finish reading input main_MD> Allocating global variables main_MD> Number of outputs that will be created: 1700 main_MD> Size of nv and nvoiz: 91 9100 main_MD> Size of nv and nvoiz: 91 9100 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 = 91 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> 3.6369926650143256E-002 -1.7667301062908463E-002 6.0538955166523453E-002 initial drift of cluster / NP1 for coalescence init> 0.29738026830326370 0.31422861030762100 0.29838675440453616 scaling for velocity /for coalescence NP1 init.f90 > facguy = 3.6708773045307000E-003 preparo> IN BIGVOI : LIMIT 1.2247448652052084 1.2247448652052084 1.2247448652052084 preparo> END t=0 TIME STEP force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 2.30739 1.15790 -3.68335 force_rgl> df(natom) -1.04688 -13.82430 -1.03676 preparo> THERMALIZATION PROCESS AT 1166.4114935355499 preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA 5000 -203.40408500127657 12.670983907649152 -216.07506890892572 6.7569803170593841E-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 34 FREEZING PROCESS: loop number 1 T-loop= 1144.0000000000000 main_MD> interactions number 1 at Temperature= 1144.0000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -4.99056 -2.08289 -0.40935 force_rgl> df(natom) -5.12292 -0.73719 -2.16804 5.0000 -219.14361 -204.95841 14.18521 3.20277 -203.65327 1140.54295 10.0000 -219.09962 -204.65208 14.44754 3.15125 -204.69555 1115.11304 15.0000 -220.36615 -206.48378 13.88237 3.12153 -205.29687 1111.79733 20.0000 -219.27840 -205.85380 13.42460 3.09038 -205.92695 1046.70872 25.0000 -218.32262 -205.68764 12.63497 3.03647 -207.01772 1047.40588 30.0000 -219.27268 -203.60166 15.67102 3.20938 -203.51959 1171.16617 35.0000 -216.59490 -202.99889 13.59600 3.13513 -205.02170 1106.21207 40.0000 -215.80060 -202.56289 13.23771 3.28411 -202.00768 1194.02391 45.0000 -217.37531 -205.07396 12.30135 3.22656 -203.17185 1151.69731 50.0000 -214.62266 -200.05601 14.56665 3.24880 -202.72194 1171.77769 55.0000 -217.15884 -203.48501 13.67384 3.32837 -201.11213 1247.85756 60.0000 -217.49089 -204.59488 12.89601 3.14804 -204.76056 1111.06856 65.0000 -218.46110 -203.86365 14.59745 3.13035 -205.11845 1115.19374 70.0000 -218.24597 -205.46701 12.77896 3.13264 -205.07207 1114.18605 75.0000 -216.45655 -204.23110 12.22545 3.12824 -205.16108 1093.38048 80.0000 -216.16408 -203.46462 12.69946 3.22233 -203.25749 1164.47353 85.0000 -217.56269 -204.41488 13.14781 3.20753 -203.55700 1135.87370 90.0000 -217.61755 -204.94959 12.66796 3.11132 -205.50336 1093.36445 95.0000 -217.19529 -204.19121 13.00408 3.13550 -205.01420 1130.84980 100.0000 -218.09814 -202.99801 15.10013 3.15512 -204.61719 1103.05296 105.0000 -218.02164 -202.74844 15.27320 3.21610 -203.38347 1155.74058 110.0000 -215.42593 -201.56828 13.85765 3.27480 -202.19588 1185.11652 115.0000 -217.26108 -200.66273 16.59835 3.28755 -201.93794 1191.60278 120.0000 -217.13842 -203.22984 13.90858 3.22321 -203.23971 1128.30241 125.0000 -219.70233 -206.52440 13.17793 3.14451 -204.83189 1106.52642 130.0000 -217.10081 -204.44188 12.65893 3.12357 -205.25561 1107.87705 135.0000 -218.20187 -205.11000 13.09187 3.19786 -203.75250 1125.65374 140.0000 -214.71369 -199.73685 14.97685 3.26599 -202.37419 1174.83180 145.0000 -215.79849 -202.76666 13.03183 3.30846 -201.51499 1207.07201 150.0000 -214.01627 -200.89153 13.12474 3.24736 -202.75121 1167.73632 155.0000 -215.67186 -201.89879 13.77306 3.29533 -201.78071 1186.26522 160.0000 -216.12172 -203.48201 12.63971 3.21031 -203.50075 1152.82919 165.0000 -217.29987 -203.96979 13.33008 3.20503 -203.60755 1135.69797 170.0000 -220.42392 -206.84148 13.58244 3.14561 -204.80959 1130.72691 175.0000 -220.16722 -206.76317 13.40405 3.08057 -206.12545 1063.33457 180.0000 -219.55897 -204.38135 15.17762 3.08200 -206.09656 1076.99383 185.0000 -217.80827 -204.48752 13.32075 3.19437 -203.82319 1148.58681 190.0000 -215.43266 -201.80775 13.62491 3.24732 -202.75182 1179.79455 195.0000 -217.35223 -205.40058 11.95164 3.25686 -202.55884 1163.95688 200.0000 -218.52939 -205.83168 12.69771 3.15962 -204.52631 1146.66569 205.0000 -218.54033 -206.87690 11.66343 3.11969 -205.33407 1068.51007 210.0000 -219.55662 -208.02093 11.53570 2.99456 -207.86572 989.90812 215.0000 -219.26675 -206.89472 12.37203 3.00383 -207.67802 1004.29725 220.0000 -218.88490 -205.52014 13.36476 3.05917 -206.55851 1052.49831 225.0000 -217.25651 -204.34983 12.90668 3.15040 -204.71278 1125.86736 230.0000 -217.45112 -203.30716 14.14396 3.21113 -203.48402 1155.42319 235.0000 -216.82420 -202.36074 14.46346 3.21138 -203.47899 1142.38636 240.0000 -215.39193 -200.66289 14.72904 3.27803 -202.13061 1145.61650 245.0000 -218.24889 -206.20451 12.04438 3.26480 -202.39831 1200.56645 250.0000 -218.30519 -205.33780 12.96739 3.09662 -205.80082 1067.26864 FREEZING PROCESS: loop number 2 T-loop= 1119.0000000000000 main_MD> interactions number 2 at Temperature= 1119.0000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 2.30740 -0.93883 -1.28814 force_rgl> df(natom) -3.26582 2.12543 -0.71300 255.0000 -218.82068 -206.51515 12.30553 3.13707 -204.98244 1120.74882 260.0000 -219.28132 -206.37071 12.91061 3.02500 -207.24983 1034.31990 265.0000 -218.63517 -207.60868 11.02649 3.04140 -206.91807 1034.78200 270.0000 -219.39508 -205.59997 13.79511 3.01609 -207.43006 1038.38975 275.0000 -216.25349 -202.88333 13.37016 3.18779 -203.95623 1142.42241 280.0000 -219.03467 -205.17220 13.86247 3.16171 -204.48392 1136.37257 285.0000 -216.27800 -202.24984 14.02815 3.14393 -204.84359 1073.93947 290.0000 -218.11715 -205.55499 12.56217 3.18262 -204.06096 1123.90673 295.0000 -216.27178 -204.77538 11.49640 3.16047 -204.50912 1124.41441 300.0000 -216.74700 -202.77520 13.97180 3.18109 -204.09193 1130.17485 305.0000 -217.59672 -202.74334 14.85337 3.21806 -203.34395 1181.62488 310.0000 -215.82632 -201.96740 13.85892 3.21957 -203.31338 1143.64574 315.0000 -216.18219 -204.34025 11.84194 3.20704 -203.56678 1131.27301 320.0000 -218.13993 -204.58222 13.55770 3.16545 -204.40824 1102.87866 325.0000 -218.16874 -204.32647 13.84227 3.22730 -203.15697 1128.36254 330.0000 -218.45642 -205.04642 13.41000 3.19119 -203.88761 1129.15839 335.0000 -218.15031 -205.53699 12.61333 3.17364 -204.24256 1134.11361 340.0000 -217.28613 -202.75966 14.52647 3.13350 -205.05476 1122.05413 345.0000 -221.59494 -209.26187 12.33307 3.07651 -206.20767 1061.28760 350.0000 -219.37819 -204.79394 14.58425 3.03540 -207.03936 1064.38611 355.0000 -218.34139 -203.78840 14.55299 3.20048 -203.69955 1162.19778 360.0000 -215.95213 -203.42723 12.52490 3.22668 -203.16950 1165.59161 365.0000 -219.17184 -204.45942 14.71242 3.20208 -203.66714 1111.93416 370.0000 -217.82696 -204.52969 13.29727 3.16954 -204.32550 1134.10173 375.0000 -219.40225 -206.87061 12.53163 3.08544 -206.02705 1095.62724 380.0000 -218.36156 -205.42804 12.93351 3.03984 -206.94957 1026.80880 385.0000 -219.04611 -206.01582 13.03029 3.13909 -204.94167 1102.07233 390.0000 -218.53513 -206.66115 11.87398 3.05606 -206.62145 1066.46481 395.0000 -218.84486 -204.54042 14.30445 3.08489 -206.03822 1048.29430 400.0000 -215.75586 -203.12794 12.62792 3.23848 -202.93070 1175.30433 405.0000 -219.03144 -206.64564 12.38580 3.23946 -202.91087 1201.22668 410.0000 -220.01417 -207.59070 12.42346 3.05593 -206.62401 1062.01565 415.0000 -216.92300 -204.35585 12.56715 3.06916 -206.35637 1037.93470 420.0000 -219.73659 -205.32770 14.40890 3.15658 -204.58780 1108.17941 425.0000 -220.34433 -205.93135 14.41298 3.04754 -206.79372 1072.31298 430.0000 -217.74994 -204.62258 13.12736 3.13592 -205.00562 1106.02078 435.0000 -217.65455 -205.15844 12.49610 3.15934 -204.53184 1099.49645 440.0000 -215.30691 -201.87598 13.43093 3.19085 -203.89431 1082.78437 445.0000 -217.25208 -201.99934 15.25274 3.27033 -202.28637 1115.72724 450.0000 -213.57127 -200.22747 13.34380 3.31202 -201.44289 1200.06628 455.0000 -216.12876 -202.27351 13.85525 3.31519 -201.37883 1234.12998 460.0000 -217.86376 -205.53339 12.33038 3.19752 -203.75943 1141.26889 465.0000 -218.38225 -205.20902 13.17323 3.14463 -204.82958 1096.45993 470.0000 -219.92283 -206.28592 13.63691 3.07547 -206.22878 1044.78813 475.0000 -217.29299 -203.84094 13.45205 3.12316 -205.26378 1076.08887 480.0000 -218.44161 -206.10177 12.33983 3.14024 -204.91836 1102.49608 485.0000 -217.07266 -203.48750 13.58516 3.15253 -204.66971 1120.71564 490.0000 -216.94399 -203.34661 13.59739 3.19680 -203.77408 1150.27984 495.0000 -217.16644 -202.75152 14.41492 3.18162 -204.08119 1127.26565 500.0000 -214.20389 -199.84022 14.36368 3.31317 -201.41964 1216.48277 FREEZING PROCESS: loop number 3 T-loop= 1094.0000000000000 main_MD> interactions number 3 at Temperature= 1094.0000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 4.08808 1.48411 1.77744 force_rgl> df(natom) 0.77952 0.01990 -2.45343 505.0000 -216.42910 -202.34867 14.08044 3.36204 -200.43090 1258.98511 510.0000 -220.51116 -206.16505 14.34611 3.19774 -203.75499 1115.49934 515.0000 -217.60392 -203.81333 13.79059 3.13101 -205.10495 1116.10215 520.0000 -218.47964 -203.52286 14.95678 3.17954 -204.12314 1106.32755 525.0000 -219.01108 -205.28594 13.72514 3.20944 -203.51833 1145.76527 530.0000 -218.96396 -205.62199 13.34196 3.06577 -206.42501 1060.50708 535.0000 -220.39916 -207.78623 12.61292 3.14291 -204.86421 1105.53396 540.0000 -218.65699 -206.70206 11.95493 3.02318 -207.28666 1044.84010 545.0000 -218.60369 -206.34046 12.26323 3.06132 -206.51505 1045.00668 550.0000 -218.08099 -206.59240 11.48859 3.07467 -206.24481 1076.95494 555.0000 -218.76363 -206.66573 12.09790 3.05034 -206.73713 1060.35468 560.0000 -218.84344 -205.68630 13.15714 3.08431 -206.04987 1044.00588 565.0000 -215.21772 -202.72952 12.48820 3.15897 -204.53929 1122.62429 570.0000 -216.93396 -203.45994 13.47401 3.22043 -203.29599 1117.97191 575.0000 -215.59962 -204.51145 11.08817 3.19699 -203.77011 1158.31030 580.0000 -219.16404 -205.37146 13.79257 3.10624 -205.60614 1095.81434 585.0000 -217.41618 -204.14893 13.26725 3.15019 -204.71703 1123.44171 590.0000 -215.44127 -203.74539 11.69588 3.17506 -204.21383 1144.63717 595.0000 -218.98125 -204.77854 14.20272 3.25364 -202.62409 1170.56395 600.0000 -218.03661 -206.41378 11.62283 3.12295 -205.26801 1073.61447 605.0000 -220.13279 -207.58936 12.54342 3.00794 -207.59498 1015.70755 610.0000 -218.60010 -205.97313 12.62698 3.03413 -207.06514 1028.37220 615.0000 -220.17376 -206.25773 13.91603 3.08196 -206.09742 1044.48542 620.0000 -218.55012 -206.96863 11.58149 3.05560 -206.63070 1079.45217 625.0000 -218.64993 -204.96573 13.68419 3.05049 -206.73404 1052.54096 630.0000 -218.34467 -205.05715 13.28752 3.07828 -206.17181 1079.64426 635.0000 -216.28201 -205.90040 10.38160 3.12518 -205.22302 1063.80733 640.0000 -220.06155 -207.34173 12.71982 3.06885 -206.36263 1053.50382 645.0000 -216.27807 -204.69515 11.58292 3.11208 -205.48801 1088.02208 650.0000 -219.88708 -204.56009 15.32698 3.13917 -204.93996 1095.05036 655.0000 -215.89902 -203.07051 12.82852 3.27656 -202.16031 1171.65712 660.0000 -215.57666 -199.52791 16.04875 3.25931 -202.50926 1179.32488 665.0000 -215.00563 -200.81046 14.19517 3.35110 -200.65233 1215.19569 670.0000 -216.37653 -204.02389 12.35264 3.33447 -200.98880 1215.19650 675.0000 -218.03703 -206.51922 11.51781 3.11694 -205.38960 1094.77848 680.0000 -217.28535 -203.30657 13.97878 3.09574 -205.81866 1093.15857 685.0000 -218.60475 -205.46016 13.14460 3.15809 -204.55714 1110.49553 690.0000 -217.87269 -205.07910 12.79359 3.15825 -204.55402 1127.18291 695.0000 -217.26495 -204.71745 12.54750 3.18418 -204.02926 1113.12655 700.0000 -218.90507 -205.68672 13.21835 3.17917 -204.13066 1124.45797 705.0000 -218.79063 -206.53682 12.25381 3.08077 -206.12139 1077.11593 710.0000 -218.24571 -206.03508 12.21063 3.00684 -207.61715 1019.88689 715.0000 -216.73942 -203.21887 13.52056 3.14200 -204.88269 1114.18974 720.0000 -219.08719 -204.72976 14.35743 3.12800 -205.16604 1094.06431 725.0000 -218.48738 -203.44430 15.04308 3.18571 -203.99847 1108.53697 730.0000 -215.78428 -202.29076 13.49352 3.27727 -202.14601 1179.45839 735.0000 -217.63393 -202.63837 14.99556 3.22932 -203.11607 1152.61098 740.0000 -214.56886 -200.96525 13.60361 3.25233 -202.65063 1186.15026 745.0000 -218.91905 -203.67021 15.24884 3.28271 -202.03602 1178.53305 750.0000 -218.63286 -204.07108 14.56179 3.21821 -203.34086 1136.50532 FREEZING PROCESS: loop number 4 T-loop= 1069.0000000000000 main_MD> interactions number 4 at Temperature= 1069.0000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -4.68652 3.44597 3.20385 force_rgl> df(natom) 0.73974 -2.36819 0.29754 755.0000 -218.10472 -206.64695 11.45777 3.14478 -204.82650 1124.01920 760.0000 -219.80138 -206.39908 13.40230 3.07224 -206.29397 1059.88347 765.0000 -219.45722 -207.25631 12.20091 3.07925 -206.15218 1061.42975 770.0000 -217.29310 -204.10787 13.18523 3.15360 -204.64795 1105.65934 775.0000 -218.42150 -206.36113 12.06036 3.20509 -203.60629 1175.62869 780.0000 -217.53055 -201.73002 15.80054 3.17299 -204.25567 1105.48798 785.0000 -216.53870 -203.14408 13.39462 3.22337 -203.23639 1148.92061 790.0000 -217.24202 -205.29882 11.94319 3.15445 -204.63077 1088.54285 795.0000 -218.06127 -205.54353 12.51774 3.09736 -205.78593 1065.22789 800.0000 -219.42616 -206.99583 12.43033 3.02901 -207.16870 1049.56766 805.0000 -218.55072 -205.75331 12.79741 3.02821 -207.18481 1046.14580 810.0000 -221.60758 -209.20545 12.40213 3.00512 -207.65196 1038.99286 815.0000 -222.91902 -211.11850 11.80052 2.87206 -210.34391 953.93969 820.0000 -218.97163 -206.74395 12.22768 2.94956 -208.77596 995.06173 825.0000 -218.79550 -206.60875 12.18675 3.04033 -206.93955 1050.41170 830.0000 -219.39702 -207.05798 12.33904 3.06777 -206.38447 1075.79807 835.0000 -215.83064 -203.10198 12.72866 3.14360 -204.85035 1097.34904 840.0000 -216.80763 -203.18221 13.62542 3.23385 -203.02436 1135.90708 845.0000 -218.20493 -205.46076 12.74417 3.13926 -204.93804 1079.20645 850.0000 -217.07528 -206.39524 10.68003 3.07382 -206.26200 1074.92374 855.0000 -219.14498 -208.43042 10.71456 3.04326 -206.88039 1013.11238 860.0000 -219.06412 -207.48236 11.58176 3.03467 -207.05407 1031.87440 865.0000 -222.39422 -211.81772 10.57649 2.92461 -209.28080 961.04170 870.0000 -222.09260 -209.27502 12.81757 2.89455 -209.88888 964.85291 875.0000 -219.39330 -207.13276 12.26054 3.04422 -206.86097 1070.79846 880.0000 -220.38566 -209.73539 10.65027 3.00825 -207.58857 1012.50331 885.0000 -220.07109 -207.18904 12.88205 2.96539 -208.45570 956.67558 890.0000 -217.49941 -205.42524 12.07417 3.04738 -206.79697 1037.21780 895.0000 -217.66572 -204.74105 12.92467 3.14872 -204.74679 1105.48098 900.0000 -214.78071 -202.19785 12.58287 3.20456 -203.61711 1145.95054 905.0000 -215.14938 -201.12566 14.02372 3.30455 -201.59402 1213.07342 910.0000 -217.15977 -203.15133 14.00844 3.25269 -202.64334 1163.59767 915.0000 -217.15532 -203.45803 13.69728 3.12732 -205.17966 1093.22163 920.0000 -217.13476 -203.31436 13.82040 3.23636 -202.97370 1161.26930 925.0000 -217.75534 -205.64952 12.10581 3.14726 -204.77624 1125.11692 930.0000 -217.79245 -202.91159 14.88087 3.21324 -203.44149 1175.01811 935.0000 -218.10451 -204.53899 13.56552 3.21572 -203.39119 1154.93901 940.0000 -218.78767 -206.80507 11.98260 3.13617 -205.00065 1123.48508 945.0000 -218.99194 -208.09341 10.89853 3.04791 -206.78637 1040.60777 950.0000 -218.30575 -204.93426 13.37150 3.01156 -207.52172 1017.94692 955.0000 -217.62247 -206.69149 10.93099 3.09878 -205.75714 1062.22670 960.0000 -219.07948 -206.75682 12.32267 3.03748 -206.99731 1049.64912 965.0000 -218.95600 -206.49902 12.45698 3.10743 -205.58202 1086.09282 970.0000 -217.63776 -206.32108 11.31668 3.05120 -206.71962 1038.69725 975.0000 -219.30994 -207.62981 11.68013 3.02206 -207.30922 1019.02204 980.0000 -221.43793 -209.01809 12.41984 2.98616 -208.03561 1019.00990 985.0000 -218.29567 -204.74492 13.55075 3.07753 -206.18701 1055.61691 990.0000 -216.50134 -204.35578 12.14556 3.18060 -204.10175 1147.72814 995.0000 -219.45467 -208.73127 10.72340 3.07870 -206.16331 1072.29930 1000.0000 -220.00942 -208.26720 11.74222 2.96711 -208.42106 987.25306 FREEZING PROCESS: loop number 5 T-loop= 1044.0000000000000 main_MD> interactions number 5 at Temperature= 1044.0000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -0.90140 -1.68259 3.14830 force_rgl> df(natom) -3.06783 -1.47845 -0.64177 1005.0000 -220.59177 -209.15756 11.43421 2.95352 -208.69601 986.28793 1010.0000 -219.59106 -207.99804 11.59302 2.92787 -209.21483 960.00329 1015.0000 -220.32078 -207.41556 12.90523 2.99933 -207.76912 1009.07926 1020.0000 -220.76568 -208.54975 12.21593 2.99412 -207.87447 1030.37411 1025.0000 -219.48140 -205.61908 13.86232 3.02177 -207.31517 1053.39058 1030.0000 -220.08306 -208.73246 11.35060 3.03967 -206.95306 1067.85635 1035.0000 -220.39703 -207.82996 12.56707 3.02714 -207.20653 1040.31532 1040.0000 -219.05957 -209.08509 9.97448 3.00049 -207.74570 999.68096 1045.0000 -220.08415 -207.78127 12.30288 2.94611 -208.84575 982.83934 1050.0000 -220.90577 -209.26641 11.63936 2.94333 -208.90213 1002.10053 1055.0000 -221.50607 -209.64425 11.86182 2.99999 -207.75584 1016.47860 1060.0000 -220.81541 -208.44193 12.37347 2.89900 -209.79887 947.74587 1065.0000 -219.59741 -206.01977 13.57763 3.04167 -206.91243 1050.38535 1070.0000 -220.41394 -206.50929 13.90465 3.07142 -206.31067 1042.90709 1075.0000 -217.89662 -205.73861 12.15801 3.13234 -205.07817 1094.85832 1080.0000 -218.72760 -206.14322 12.58438 3.11666 -205.39541 1116.38142 1085.0000 -218.68209 -205.28290 13.39919 3.08944 -205.94599 1078.89841 1090.0000 -222.50900 -208.48603 14.02297 2.97762 -208.20842 1019.67746 1095.0000 -220.53380 -209.30815 11.22565 2.98519 -208.05513 1042.44852 1100.0000 -221.09561 -209.23962 11.85600 2.95365 -208.69327 997.53749 1105.0000 -221.36073 -209.85325 11.50747 2.89787 -209.82185 965.44313 1110.0000 -217.75300 -206.27486 11.47814 3.01079 -207.53726 1045.40197 1115.0000 -219.30305 -206.16958 13.13347 3.07797 -206.17818 1040.15336 1120.0000 -220.13113 -208.18650 11.94463 3.04564 -206.83221 1048.18052 1125.0000 -221.13029 -209.15012 11.98017 2.97753 -208.21015 1022.54815 1130.0000 -221.66263 -208.56222 13.10041 2.93521 -209.06639 984.42403 1135.0000 -221.26335 -209.83395 11.42940 2.91238 -209.52828 950.59958 1140.0000 -222.41135 -209.01987 13.39148 2.94756 -208.81642 983.77692 1145.0000 -220.82170 -208.79976 12.02194 2.91899 -209.39460 961.36220 1150.0000 -221.35496 -209.90980 11.44516 2.93284 -209.11435 974.99668 1155.0000 -219.04190 -205.32821 13.71369 3.00253 -207.70442 1021.28969 1160.0000 -221.01620 -209.21921 11.79698 2.97328 -208.29606 1004.80187 1165.0000 -220.99502 -206.38071 14.61431 3.02910 -207.16677 1032.53382 1170.0000 -220.62988 -206.43324 14.19664 3.06087 -206.52410 1065.04915 1175.0000 -219.48928 -206.21728 13.27199 3.05303 -206.68273 1063.82047 1180.0000 -218.88372 -205.94875 12.93497 3.03800 -206.98673 1030.84433 1185.0000 -218.14931 -205.68122 12.46809 3.06716 -206.39685 1055.60565 1190.0000 -219.45498 -206.81299 12.64199 3.02411 -207.26788 1035.96576 1195.0000 -219.84007 -207.04251 12.79756 3.11183 -205.49304 1080.46255 1200.0000 -219.42128 -206.38490 13.03638 3.07954 -206.14633 1048.88862 1205.0000 -219.92157 -205.87456 14.04701 3.09418 -205.85020 1057.87644 1210.0000 -218.98746 -207.80702 11.18044 3.03637 -207.01967 1037.89181 1215.0000 -217.98765 -206.06850 11.91915 3.03149 -207.11857 1003.55923 1220.0000 -216.81615 -204.10759 12.70856 3.09903 -205.75210 1095.87427 1225.0000 -217.81436 -205.53223 12.28213 3.15573 -204.60496 1110.76122 1230.0000 -220.15097 -209.26838 10.88260 3.01730 -207.40555 1022.24044 1235.0000 -220.68363 -208.63014 12.05349 2.96379 -208.48816 980.48458 1240.0000 -221.40326 -208.76045 12.64281 2.97365 -208.28858 961.95116 1245.0000 -219.48797 -205.45164 14.03632 2.97249 -208.31208 1006.92521 1250.0000 -217.00898 -205.03534 11.97364 3.07203 -206.29829 1054.51903 FREEZING PROCESS: loop number 6 T-loop= 1019.0000000000000 main_MD> interactions number 6 at Temperature= 1019.0000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 2.13483 3.95259 -0.26113 force_rgl> df(natom) 1.41457 -0.10058 -2.94167 1255.0000 -217.02682 -204.53858 12.48824 3.10098 -205.71261 1089.70056 1260.0000 -217.60515 -206.02827 11.57689 3.11433 -205.44250 1055.39057 1265.0000 -219.54710 -207.71063 11.83648 3.02090 -207.33265 1047.41092 1270.0000 -222.79704 -212.00415 10.79289 2.91905 -209.39323 1001.01337 1275.0000 -220.55926 -205.69671 14.86255 2.95163 -208.73410 984.76251 1280.0000 -218.67741 -207.39800 11.27941 3.01541 -207.44386 1056.03573 1285.0000 -217.64796 -206.23227 11.41570 3.10393 -205.65295 1095.68128 1290.0000 -221.21288 -209.69983 11.51305 3.00693 -207.61527 1048.75129 1295.0000 -219.04562 -207.47943 11.56618 2.90859 -209.60493 946.55797 1300.0000 -219.73970 -207.37318 12.36652 2.91514 -209.47248 947.52289 1305.0000 -220.22900 -209.40015 10.82885 3.00390 -207.67659 1015.61941 1310.0000 -219.71791 -208.13060 11.58731 2.96450 -208.47386 1016.29837 1315.0000 -217.95926 -206.11572 11.84354 3.00641 -207.62590 1012.82385 1320.0000 -221.21530 -209.51526 11.70004 2.97540 -208.25322 1000.28789 1325.0000 -222.78366 -211.11524 11.66842 2.89883 -209.80246 950.30917 1330.0000 -220.51337 -207.64544 12.86793 2.92105 -209.35291 969.99528 1335.0000 -219.54013 -207.15025 12.38987 3.03559 -207.03557 1050.20847 1340.0000 -219.30704 -207.31775 11.98929 2.99207 -207.91602 1015.42803 1345.0000 -219.78233 -208.66484 11.11749 3.01050 -207.54320 1046.52479 1350.0000 -220.75711 -209.00616 11.75094 2.95053 -208.75635 967.31470 1355.0000 -221.60931 -207.93550 13.67381 2.95212 -208.72417 999.15597 1360.0000 -220.46621 -209.06312 11.40309 3.01178 -207.51731 1016.37813 1365.0000 -220.94320 -208.28717 12.65604 2.94250 -208.91889 993.46000 1370.0000 -219.45749 -207.70419 11.75330 2.95803 -208.60473 988.80641 1375.0000 -223.67718 -211.77231 11.90487 2.89688 -209.84189 956.79707 1380.0000 -221.78501 -211.37224 10.41277 2.83234 -211.14764 935.92239 1385.0000 -220.63898 -208.58474 12.05424 2.90349 -209.70804 968.52426 1390.0000 -219.65397 -207.40381 12.25016 2.95213 -208.72406 961.02939 1395.0000 -218.02532 -206.31394 11.71137 3.02017 -207.34754 1022.94525 1400.0000 -217.60244 -204.85468 12.74776 3.07231 -206.29267 1068.06243 1405.0000 -217.86121 -204.72775 13.13347 3.12715 -205.18312 1100.39883 1410.0000 -217.21814 -203.03985 14.17829 3.19651 -203.77993 1151.76180 1415.0000 -220.42360 -206.78948 13.63413 3.15830 -204.55297 1103.73779 1420.0000 -219.63396 -207.75167 11.88229 3.02054 -207.34008 1042.09538 1425.0000 -221.50636 -211.41752 10.08884 2.91417 -209.49199 975.75380 1430.0000 -218.42239 -205.18632 13.23607 2.94127 -208.94375 960.51772 1435.0000 -217.26183 -204.32290 12.93893 3.10694 -205.59211 1069.84712 1440.0000 -218.29669 -206.07058 12.22611 3.12691 -205.18806 1099.49704 1445.0000 -220.55318 -207.45966 13.09352 3.00144 -207.72640 1008.51885 1450.0000 -219.73423 -207.82008 11.91415 3.04027 -206.94093 1031.75998 1455.0000 -219.99528 -208.50113 11.49415 2.97452 -208.27114 982.40767 1460.0000 -221.72784 -209.88918 11.83867 2.91712 -209.43234 952.14558 1465.0000 -218.75484 -208.49887 10.25596 2.89605 -209.85855 932.44394 1470.0000 -220.97398 -209.57816 11.39582 2.96062 -208.55223 1015.96868 1475.0000 -221.60052 -209.19899 12.40154 2.94246 -208.91975 985.44139 1480.0000 -221.86518 -208.97077 12.89440 2.88531 -210.07583 922.15984 1485.0000 -220.19078 -209.14175 11.04903 2.96607 -208.44204 999.03748 1490.0000 -222.65231 -211.00993 11.64237 2.89910 -209.79693 958.99430 1495.0000 -217.37769 -206.84914 10.52854 2.94124 -208.94428 978.89629 1500.0000 -218.97016 -206.95309 12.01708 3.07247 -206.28937 1049.44668 FREEZING PROCESS: loop number 7 T-loop= 994.00000000000000 main_MD> interactions number 7 at Temperature= 994.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 3.51319 -1.60289 -3.02662 force_rgl> df(natom) 0.41152 0.23207 -5.89488 1505.0000 -219.05407 -207.36459 11.68948 3.06521 -206.43628 1034.72594 1510.0000 -222.74108 -210.86128 11.87980 2.91573 -209.46049 947.29860 1515.0000 -221.11282 -209.78646 11.32637 2.88627 -210.05655 970.92953 1520.0000 -221.37148 -210.95193 10.41955 2.86802 -210.42571 943.43311 1525.0000 -221.14221 -209.90666 11.23556 2.84551 -210.88103 915.40610 1530.0000 -220.85998 -209.49376 11.36623 2.90776 -209.62173 964.06633 1535.0000 -220.74184 -208.70813 12.03371 2.92175 -209.33872 958.00904 1540.0000 -219.65120 -209.20537 10.44583 2.95421 -208.68193 996.53134 1545.0000 -219.25362 -206.32249 12.93113 2.95902 -208.58461 978.33890 1550.0000 -221.48114 -209.28895 12.19219 2.99674 -207.82156 1017.06131 1555.0000 -220.31780 -209.11153 11.20627 2.92979 -209.17610 984.32011 1560.0000 -218.74090 -206.42947 12.31144 2.91075 -209.56129 989.43560 1565.0000 -219.62813 -208.05711 11.57102 3.03125 -207.12329 1037.83685 1570.0000 -219.49073 -206.62222 12.86851 3.05689 -206.60452 1054.99650 1575.0000 -219.45541 -205.92860 13.52681 3.08324 -206.07154 1057.04608 1580.0000 -219.46759 -209.32352 10.14408 2.99400 -207.87701 1003.30711 1585.0000 -221.63204 -207.25582 14.37622 2.97488 -208.26383 986.26996 1590.0000 -218.99204 -206.04562 12.94643 3.05056 -206.73263 1057.67690 1595.0000 -216.92781 -204.91915 12.00866 3.10762 -205.57831 1072.30449 1600.0000 -221.17088 -208.92158 12.24930 2.97068 -208.34886 1029.26485 1605.0000 -220.90332 -208.88199 12.02133 2.96626 -208.43810 997.07652 1610.0000 -220.28008 -208.00972 12.27036 2.99804 -207.79516 1030.80452 1615.0000 -219.73392 -209.14311 10.59081 3.00469 -207.66066 1005.82667 1620.0000 -219.91103 -208.98134 10.92969 2.92630 -209.24654 967.16914 1625.0000 -221.09281 -211.54099 9.55182 2.88182 -210.14643 922.30709 1630.0000 -221.93936 -210.46641 11.47295 2.88005 -210.18225 932.67323 1635.0000 -219.67801 -208.54453 11.13348 2.96125 -208.53958 996.93036 1640.0000 -220.63411 -208.73518 11.89893 2.94220 -208.92502 987.36615 1645.0000 -220.78901 -209.27067 11.51834 2.95876 -208.59000 981.08865 1650.0000 -220.55174 -209.98722 10.56452 2.89183 -209.94392 946.73329 1655.0000 -221.28367 -210.04578 11.23790 2.93379 -209.09506 962.08211 1660.0000 -219.40657 -208.08156 11.32501 2.95172 -208.73242 1018.80169 1665.0000 -221.71825 -210.35998 11.35827 2.86503 -210.48620 946.29144 1670.0000 -221.62969 -210.03280 11.59689 2.86447 -210.49758 938.94528 1675.0000 -220.56191 -207.70865 12.85326 2.93911 -208.98743 1000.65029 1680.0000 -220.55992 -209.10106 11.45886 2.95652 -208.63518 982.10425 1685.0000 -220.77491 -209.53885 11.23605 2.92488 -209.27541 971.48457 1690.0000 -221.58569 -208.92247 12.66321 2.89584 -209.86283 940.82045 1695.0000 -222.00074 -210.86069 11.14005 2.91854 -209.40370 1001.64404 1700.0000 -220.47488 -207.97734 12.49754 2.90041 -209.77035 968.30282 1705.0000 -220.65927 -207.89855 12.76072 3.03918 -206.96291 1039.17858 1710.0000 -221.89470 -210.46239 11.43230 2.95626 -208.64040 1006.02154 1715.0000 -222.90737 -209.30920 13.59817 2.86241 -210.53921 923.47781 1720.0000 -220.84769 -208.89193 11.95576 2.95270 -208.71244 971.46984 1725.0000 -219.44375 -206.52630 12.91745 3.05190 -206.70563 1065.98488 1730.0000 -218.99832 -207.36833 11.62999 3.04792 -206.78617 1052.24718 1735.0000 -218.60474 -205.66377 12.94097 3.07578 -206.22247 1081.81643 1740.0000 -218.58393 -207.13888 11.44505 3.06288 -206.48347 1056.44653 1745.0000 -220.34844 -207.84482 12.50362 3.02859 -207.17713 1039.81546 1750.0000 -220.18346 -208.85366 11.32980 2.99461 -207.86457 1019.49332 FREEZING PROCESS: loop number 8 T-loop= 969.00000000000000 main_MD> interactions number 8 at Temperature= 969.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -3.02006 -0.52677 0.63763 force_rgl> df(natom) -0.74490 -0.44786 -2.09084 1755.0000 -219.90569 -209.18538 10.72030 2.94520 -208.86423 976.64556 1760.0000 -221.78657 -211.32234 10.46424 2.85062 -210.77781 903.30769 1765.0000 -219.85341 -206.22124 13.63216 2.96564 -208.45078 1008.01068 1770.0000 -220.37570 -209.26947 11.10622 3.00320 -207.69091 1019.06657 1775.0000 -221.92063 -209.49765 12.42297 2.99473 -207.86228 1021.06243 1780.0000 -222.07334 -210.36873 11.70461 2.89625 -209.85458 971.03916 1785.0000 -220.47796 -210.96464 9.51332 2.88027 -210.17779 953.08948 1790.0000 -221.87752 -210.23380 11.64372 2.83035 -211.18776 927.87617 1795.0000 -220.62966 -208.65628 11.97338 2.90755 -209.62593 970.37808 1800.0000 -220.77061 -210.43343 10.33717 2.93450 -209.08064 970.61707 1805.0000 -221.32284 -210.75391 10.56893 2.83007 -211.19354 897.83400 1810.0000 -221.64327 -210.61244 11.03082 2.86638 -210.45897 942.89269 1815.0000 -220.73972 -211.01539 9.72432 2.85653 -210.65811 920.98921 1820.0000 -222.00845 -210.87476 11.13369 2.87787 -210.22650 960.44830 1825.0000 -221.88657 -211.95040 9.93616 2.84557 -210.87997 911.95760 1830.0000 -219.18535 -208.16300 11.02235 2.89197 -209.94118 927.07828 1835.0000 -221.84205 -209.71722 12.12482 2.95722 -208.62110 1011.91175 1840.0000 -220.29782 -209.84090 10.45692 2.91639 -209.44718 973.45610 1845.0000 -221.15574 -209.24700 11.90874 2.91868 -209.40086 949.93240 1850.0000 -218.45696 -208.30917 10.14779 2.92259 -209.32162 964.48109 1855.0000 -220.85891 -208.22124 12.63767 2.96160 -208.53255 990.76029 1860.0000 -219.21891 -206.86999 12.34892 2.99493 -207.85808 1023.75322 1865.0000 -219.18611 -207.79497 11.39114 2.99252 -207.90689 1013.97764 1870.0000 -219.33951 -208.47330 10.86622 3.04820 -206.78042 1043.56271 1875.0000 -220.41438 -208.30463 12.10975 2.96075 -208.54956 985.15548 1880.0000 -220.08284 -204.99556 15.08729 3.09056 -205.92340 1067.06664 1885.0000 -221.08643 -208.64815 12.43828 3.06978 -206.34384 1032.66069 1890.0000 -220.74066 -210.14320 10.59746 2.90998 -209.57680 955.75502 1895.0000 -222.08630 -210.20737 11.87893 2.88215 -210.13988 949.54068 1900.0000 -220.03953 -209.65047 10.38906 2.89280 -209.92445 941.93882 1905.0000 -220.66660 -209.23215 11.43445 2.95174 -208.73197 970.75045 1910.0000 -219.33076 -209.54596 9.78481 2.91046 -209.56707 953.74412 1915.0000 -220.55025 -208.67556 11.87470 2.89230 -209.93442 932.22828 1920.0000 -221.36477 -211.77064 9.59413 2.92306 -209.31224 979.79067 1925.0000 -221.21787 -211.45635 9.76152 2.77510 -212.30553 872.75552 1930.0000 -220.46347 -209.45148 11.01200 2.86148 -210.55811 926.87513 1935.0000 -220.43331 -209.06810 11.36521 2.89867 -209.80571 956.22000 1940.0000 -222.60174 -212.49484 10.10690 2.86068 -210.57422 943.24020 1945.0000 -220.07834 -208.44367 11.63467 2.85419 -210.70556 924.03956 1950.0000 -220.44848 -208.53678 11.91169 2.93579 -209.05455 980.55589 1955.0000 -220.08249 -208.38337 11.69912 2.98295 -208.10058 989.35024 1960.0000 -220.73408 -209.48031 11.25376 2.98871 -207.98388 1040.76299 1965.0000 -219.03151 -207.54603 11.48548 2.97109 -208.34054 1004.67730 1970.0000 -219.46023 -209.66728 9.79295 2.95717 -208.62218 988.39811 1975.0000 -221.24025 -210.78787 10.45238 2.87547 -210.27490 944.53262 1980.0000 -221.36117 -209.69700 11.66417 2.87298 -210.32539 937.73568 1985.0000 -221.21040 -210.17029 11.04011 2.90742 -209.62851 941.44552 1990.0000 -221.39081 -210.90248 10.48833 2.89976 -209.78361 948.24925 1995.0000 -218.98337 -208.37607 10.60731 2.89955 -209.78773 951.68982 2000.0000 -222.05804 -210.37208 11.68596 2.90203 -209.73768 938.58184 FREEZING PROCESS: loop number 9 T-loop= 944.00000000000000 main_MD> interactions number 9 at Temperature= 944.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 1.27849 -1.47390 -2.41996 force_rgl> df(natom) 5.19926 5.86593 1.05632 2005.0000 -220.67135 -210.61794 10.05342 2.86014 -210.58522 927.92967 2010.0000 -220.10831 -209.62402 10.48429 2.88536 -210.07497 929.63434 2015.0000 -221.29687 -209.39762 11.89925 2.90838 -209.60918 960.25058 2020.0000 -220.54473 -209.66080 10.88393 2.89273 -209.92574 923.97914 2025.0000 -222.12162 -211.57079 10.55083 2.83733 -211.04653 901.89210 2030.0000 -220.00792 -210.46333 9.54459 2.86147 -210.55826 931.80356 2035.0000 -221.99325 -208.90994 13.08331 2.89926 -209.79360 970.04843 2040.0000 -221.53549 -208.91606 12.61944 2.93384 -209.09408 972.13050 2045.0000 -220.54238 -209.06217 11.48021 2.93620 -209.04628 973.70530 2050.0000 -222.34257 -211.47586 10.86672 2.87004 -210.38477 941.10249 2055.0000 -222.81495 -212.04600 10.76895 2.83988 -210.99494 946.28785 2060.0000 -220.37080 -208.34269 12.02811 2.81313 -211.53617 886.44167 2065.0000 -219.81879 -208.73799 11.08080 2.91531 -209.46903 952.30571 2070.0000 -220.22138 -209.04637 11.17501 2.93019 -209.16802 1005.45621 2075.0000 -217.59604 -205.88105 11.71498 2.99488 -207.85924 988.42412 2080.0000 -220.10241 -209.29534 10.80707 2.99601 -207.83626 1021.23678 2085.0000 -223.75512 -213.25023 10.50489 2.85359 -210.71760 956.56421 2090.0000 -222.41609 -212.81171 9.60438 2.82433 -211.30961 930.98637 2095.0000 -221.06344 -211.53404 9.52940 2.82287 -211.33909 912.99716 2100.0000 -222.23817 -213.00440 9.23378 2.79297 -211.94401 880.93793 2105.0000 -222.69670 -211.61475 11.08194 2.71394 -213.54306 851.09826 2110.0000 -220.95416 -211.03489 9.91927 2.86070 -210.57382 939.85406 2115.0000 -220.20465 -209.55874 10.64591 2.86976 -210.39052 966.36755 2120.0000 -221.73632 -209.58360 12.15272 2.84778 -210.83517 941.87628 2125.0000 -220.21098 -208.77315 11.43783 2.91573 -209.46056 973.36088 2130.0000 -218.74242 -208.15621 10.58620 2.98149 -208.13002 1032.40898 2135.0000 -220.72468 -208.89701 11.82767 3.00100 -207.73524 1006.93459 2140.0000 -220.66023 -209.56473 11.09550 2.94007 -208.96805 944.47644 2145.0000 -219.33389 -208.25151 11.08238 2.91861 -209.40226 940.63936 2150.0000 -222.96111 -212.07247 10.88863 2.87878 -210.20797 935.47395 2155.0000 -221.91243 -211.89881 10.01362 2.81983 -211.40074 908.61210 2160.0000 -222.97935 -213.27075 9.70860 2.74804 -212.85301 844.94811 2165.0000 -222.09614 -211.41284 10.68330 2.77437 -212.32045 885.46676 2170.0000 -222.64861 -211.24871 11.39990 2.82139 -211.36919 916.34675 2175.0000 -221.02225 -208.91620 12.10606 2.87497 -210.28518 942.27301 2180.0000 -220.53308 -209.69985 10.83322 2.90556 -209.66624 978.84662 2185.0000 -219.83487 -209.46432 10.37055 2.89162 -209.94820 932.12552 2190.0000 -222.16740 -211.79392 10.37348 2.87134 -210.35856 942.57180 2195.0000 -219.68124 -209.56819 10.11305 2.83928 -211.00714 909.89427 2200.0000 -220.70993 -208.48634 12.22359 2.90074 -209.76366 943.27002 2205.0000 -222.57279 -209.70933 12.86346 2.91708 -209.43307 977.08807 2210.0000 -221.91484 -211.21139 10.70345 2.85724 -210.64387 938.44245 2215.0000 -222.37232 -211.00346 11.36886 2.84223 -210.94752 915.87445 2220.0000 -220.55779 -207.67748 12.88031 2.95132 -208.74035 971.82538 2225.0000 -222.49608 -210.45648 12.03960 2.96709 -208.42134 1005.75001 2230.0000 -221.32884 -209.67699 11.65185 2.90177 -209.74283 977.42050 2235.0000 -221.27615 -211.30011 9.97605 2.82720 -211.25158 907.67393 2240.0000 -220.58513 -210.26598 10.31915 2.87208 -210.34367 917.98934 2245.0000 -221.70095 -210.94465 10.75631 2.86213 -210.54489 925.23217 2250.0000 -220.46126 -208.01659 12.44467 2.90969 -209.58264 973.03657 FREEZING PROCESS: loop number 10 T-loop= 919.00000000000000 main_MD> interactions number 10 at Temperature= 919.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -0.01869 -2.77194 -1.45170 force_rgl> df(natom) 3.11789 -1.08035 1.63576 2255.0000 -222.13457 -211.40860 10.72596 2.83281 -211.13809 916.77900 2260.0000 -221.90615 -212.01524 9.89090 2.80096 -211.78252 882.34378 2265.0000 -220.46610 -210.15444 10.31166 2.80864 -211.62708 873.53899 2270.0000 -221.45473 -211.57414 9.88059 2.82820 -211.23130 899.88779 2275.0000 -222.28480 -211.02371 11.26109 2.79514 -211.90021 864.91137 2280.0000 -219.53055 -208.11245 11.41810 2.89358 -209.90855 944.45849 2285.0000 -222.72604 -212.90962 9.81642 2.91906 -209.39311 984.54280 2290.0000 -221.58925 -211.02077 10.56848 2.79812 -211.83986 883.37450 2295.0000 -222.73843 -212.30089 10.43754 2.82898 -211.21552 915.18986 2300.0000 -223.24691 -210.92257 12.32434 2.81003 -211.59888 862.78998 2305.0000 -222.01619 -210.29031 11.72587 2.87409 -210.30287 958.70622 2310.0000 -222.54105 -210.96891 11.57215 2.87762 -210.23156 965.33503 2315.0000 -221.56466 -210.55903 11.00563 2.89430 -209.89399 953.80389 2320.0000 -222.13035 -208.98072 13.14963 2.89619 -209.85581 958.57603 2325.0000 -220.22625 -209.44600 10.78025 2.92778 -209.21669 988.49553 2330.0000 -221.11302 -209.74032 11.37270 2.88883 -210.00472 931.47593 2335.0000 -221.57415 -211.38754 10.18661 2.84811 -210.82861 928.15777 2340.0000 -223.88546 -212.03376 11.85170 2.82552 -211.28557 912.77393 2345.0000 -220.84643 -211.71829 9.12814 2.86408 -210.50542 916.15955 2350.0000 -222.43340 -210.72747 11.70593 2.80687 -211.66292 884.02439 2355.0000 -221.64637 -209.58464 12.06174 2.84970 -210.79642 943.38569 2360.0000 -221.20046 -210.25342 10.94704 2.85193 -210.75131 932.03697 2365.0000 -221.49786 -211.45754 10.04032 2.86456 -210.49577 913.84312 2370.0000 -221.88175 -211.36293 10.51882 2.82594 -211.27711 894.60396 2375.0000 -221.59629 -209.79902 11.79726 2.79461 -211.91094 894.00881 2380.0000 -221.10237 -210.59746 10.50491 2.88901 -210.00100 938.54890 2385.0000 -222.12699 -212.54202 9.58497 2.82572 -211.28150 909.86111 2390.0000 -223.43385 -213.22772 10.20613 2.79397 -211.92389 885.22330 2395.0000 -222.68033 -212.68162 9.99870 2.77180 -212.37242 876.38752 2400.0000 -222.42682 -211.69776 10.72905 2.72610 -213.29702 836.35148 2405.0000 -223.19780 -211.17651 12.02129 2.84143 -210.96367 938.71082 2410.0000 -222.48411 -211.34246 11.14165 2.82159 -211.36503 907.17389 2415.0000 -222.53846 -212.07214 10.46632 2.74710 -212.87208 867.10840 2420.0000 -219.02462 -208.37264 10.65199 2.88083 -210.16650 948.85964 2425.0000 -222.06588 -209.77816 12.28772 2.93674 -209.03549 975.47669 2430.0000 -220.35787 -209.86306 10.49481 2.95047 -208.75767 983.12825 2435.0000 -222.83792 -210.56555 12.27238 2.89592 -209.86128 975.84224 2440.0000 -222.33507 -211.33580 10.99927 2.82287 -211.33907 925.20881 2445.0000 -219.22256 -207.62034 11.60222 2.85902 -210.60771 936.41184 2450.0000 -220.98482 -210.27033 10.71448 2.91895 -209.39542 969.85961 2455.0000 -220.89026 -211.96359 8.92667 2.77463 -212.31515 853.56234 2460.0000 -222.69584 -212.21382 10.48203 2.81619 -211.47435 927.64200 2465.0000 -223.48726 -212.59978 10.88748 2.74899 -212.83396 878.76517 2470.0000 -221.65245 -212.23070 9.42175 2.79981 -211.80562 908.72005 2475.0000 -220.21269 -208.71998 11.49271 2.91327 -209.51026 979.13915 2480.0000 -220.37685 -209.88190 10.49495 2.90545 -209.66847 976.31753 2485.0000 -221.10469 -209.44448 11.66021 2.92573 -209.25809 979.80183 2490.0000 -220.70251 -210.99721 9.70530 2.90239 -209.73035 989.14965 2495.0000 -222.65801 -211.69857 10.95944 2.85313 -210.72697 936.62305 2500.0000 -219.87346 -209.18611 10.68734 2.88702 -210.04131 973.52542 FREEZING PROCESS: loop number 11 T-loop= 894.00000000000000 main_MD> interactions number 11 at Temperature= 894.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 3.49978 -0.39484 1.24293 force_rgl> df(natom) -0.70338 -0.65581 0.13981 2505.0000 -221.39287 -211.09475 10.29813 2.84276 -210.93673 919.90773 2510.0000 -220.32845 -210.23474 10.09370 2.87331 -210.31874 924.70644 2515.0000 -221.39925 -210.79495 10.60430 2.85226 -210.74456 926.82910 2520.0000 -223.25527 -211.00177 12.25350 2.84345 -210.92282 960.23766 2525.0000 -222.21090 -211.45011 10.76079 2.78330 -212.13973 900.24252 2530.0000 -221.30542 -209.30329 12.00213 2.86664 -210.45364 950.36799 2535.0000 -220.31297 -208.65392 11.65905 2.95157 -208.73542 976.03253 2540.0000 -221.91322 -209.33663 12.57659 2.94282 -208.91245 974.70656 2545.0000 -223.18522 -211.38414 11.80109 2.84629 -210.86535 924.95271 2550.0000 -221.86425 -213.00310 8.86115 2.77738 -212.25941 884.68383 2555.0000 -222.29106 -212.54954 9.74151 2.76932 -212.42263 845.54136 2560.0000 -223.24630 -213.16483 10.08146 2.79847 -211.83274 908.21324 2565.0000 -221.89347 -212.73276 9.16071 2.81170 -211.56506 917.34888 2570.0000 -221.07920 -211.25546 9.82373 2.79510 -211.90101 879.43126 2575.0000 -222.75142 -213.17259 9.57883 2.81803 -211.43707 904.11347 2580.0000 -223.62910 -214.05506 9.57404 2.73767 -213.06286 847.39535 2585.0000 -221.65214 -212.43264 9.21950 2.72023 -213.41582 845.38023 2590.0000 -225.15441 -212.93148 12.22293 2.70112 -213.80230 811.84100 2595.0000 -222.28710 -211.35353 10.93357 2.75495 -212.71331 864.52771 2600.0000 -224.06210 -215.32135 8.74075 2.70203 -213.78398 816.82563 2605.0000 -223.51925 -213.07842 10.44083 2.69609 -213.90405 811.12632 2610.0000 -224.46551 -214.00971 10.45580 2.69457 -213.93485 839.34526 2615.0000 -221.71805 -212.11669 9.60136 2.73427 -213.13176 859.62957 2620.0000 -224.36579 -214.61995 9.74584 2.71212 -213.57980 816.74495 2625.0000 -222.04089 -211.87242 10.16848 2.70366 -213.75099 853.62562 2630.0000 -222.14749 -209.91502 12.23247 2.85079 -210.77424 956.59835 2635.0000 -221.90829 -211.23388 10.67441 2.84273 -210.93742 911.80144 2640.0000 -222.36178 -212.75675 9.60503 2.81610 -211.47619 914.12764 2645.0000 -222.23657 -211.40467 10.83190 2.79293 -211.94485 884.28107 2650.0000 -223.50019 -212.15028 11.34991 2.81286 -211.54175 884.87819 2655.0000 -223.87392 -211.83293 12.04098 2.76304 -212.54953 850.34222 2660.0000 -223.78815 -214.38255 9.40560 2.74025 -213.01064 880.01022 2665.0000 -221.43474 -209.93382 11.50092 2.77409 -212.32608 906.38069 2670.0000 -220.80444 -209.40715 11.39728 2.90582 -209.66098 941.59627 2675.0000 -221.73693 -210.92593 10.81100 2.84531 -210.88508 920.62848 2680.0000 -222.28228 -211.23783 11.04445 2.83336 -211.12692 906.02842 2685.0000 -224.00306 -213.13411 10.86895 2.83004 -211.19403 910.05478 2690.0000 -224.52308 -213.15857 11.36451 2.73531 -213.11060 861.02773 2695.0000 -222.07081 -211.36159 10.70921 2.73577 -213.10130 860.68403 2700.0000 -222.51901 -212.21270 10.30631 2.77305 -212.34713 898.69732 2705.0000 -222.84528 -212.26508 10.58019 2.81076 -211.58417 900.71283 2710.0000 -220.62894 -209.22786 11.40108 2.87124 -210.36064 933.83474 2715.0000 -219.25559 -209.71812 9.53747 2.92137 -209.34646 961.37788 2720.0000 -220.96132 -209.50163 11.45969 2.91096 -209.55689 936.80028 2725.0000 -222.66687 -211.58389 11.08297 2.88099 -210.16336 964.26599 2730.0000 -222.74090 -212.77607 9.96482 2.72777 -213.26324 850.52897 2735.0000 -223.91392 -212.44383 11.47009 2.69056 -214.01603 826.07125 2740.0000 -222.51614 -213.30802 9.20812 2.76987 -212.41146 862.79885 2745.0000 -221.25003 -210.63471 10.61532 2.78987 -212.00686 897.31502 2750.0000 -222.65374 -213.11470 9.53903 2.76416 -212.52701 870.24626 FREEZING PROCESS: loop number 12 T-loop= 869.00000000000000 main_MD> interactions number 12 at Temperature= 869.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -3.91254 0.63947 -0.40646 force_rgl> df(natom) -3.71911 -8.06666 -1.29369 2755.0000 -223.75568 -213.41866 10.33702 2.68268 -214.17542 835.38572 2760.0000 -224.04183 -214.89160 9.15023 2.66759 -214.48075 821.70691 2765.0000 -221.71987 -212.50837 9.21149 2.69713 -213.88317 828.30588 2770.0000 -222.67090 -211.47171 11.19919 2.77451 -212.31755 866.78697 2775.0000 -222.10945 -212.71006 9.39939 2.78950 -212.01422 884.27595 2780.0000 -223.02523 -214.05066 8.97457 2.76963 -212.41638 872.09191 2785.0000 -222.83630 -211.65836 11.17794 2.72075 -213.40528 858.17749 2790.0000 -222.31839 -211.59345 10.72494 2.82836 -211.22800 909.10113 2795.0000 -220.87161 -210.59217 10.27945 2.82857 -211.22380 915.16170 2800.0000 -222.49526 -211.61995 10.87531 2.84179 -210.95640 909.00056 2805.0000 -223.29752 -212.47547 10.82205 2.78155 -212.17513 890.53879 2810.0000 -221.07450 -210.30784 10.76666 2.80877 -211.62441 890.90709 2815.0000 -222.38908 -212.70247 9.68661 2.75979 -212.61537 884.14740 2820.0000 -221.22872 -211.63776 9.59096 2.81251 -211.54869 891.63752 2825.0000 -221.42514 -211.60554 9.81960 2.85582 -210.67252 923.94727 2830.0000 -221.55569 -211.49926 10.05644 2.77340 -212.33999 882.64732 2835.0000 -222.05851 -211.47745 10.58106 2.80020 -211.79788 910.16351 2840.0000 -222.30254 -211.69391 10.60863 2.78991 -212.00603 899.92005 2845.0000 -222.11636 -212.30176 9.81460 2.78742 -212.05629 885.82199 2850.0000 -222.67452 -212.33065 10.34388 2.75533 -212.70567 872.64360 2855.0000 -223.93826 -212.55882 11.37945 2.71341 -213.55369 870.56248 2860.0000 -223.80207 -213.41387 10.38820 2.71679 -213.48535 830.70314 2865.0000 -223.27007 -212.91362 10.35645 2.74740 -212.86604 872.17903 2870.0000 -225.95210 -215.54681 10.40529 2.69328 -213.96100 843.23300 2875.0000 -224.66410 -214.05996 10.60414 2.66256 -214.58255 807.55825 2880.0000 -222.20242 -212.60801 9.59441 2.73637 -213.08923 850.80833 2885.0000 -223.27247 -211.66982 11.60266 2.76922 -212.42459 864.67602 2890.0000 -223.47173 -214.12447 9.34726 2.74295 -212.95612 883.37574 2895.0000 -223.54300 -213.64777 9.89523 2.68403 -214.14804 830.99166 2900.0000 -221.81519 -211.04449 10.77070 2.74961 -212.82139 864.93693 2905.0000 -220.90168 -210.42714 10.47454 2.80985 -211.60261 884.05714 2910.0000 -221.88377 -211.82763 10.05614 2.85401 -210.70913 946.23426 2915.0000 -221.60619 -211.36085 10.24534 2.77145 -212.37950 888.50996 2920.0000 -221.17224 -210.66651 10.50573 2.82029 -211.39139 899.51420 2925.0000 -221.41935 -211.39444 10.02491 2.85426 -210.70415 899.04400 2930.0000 -222.43188 -212.41804 10.01385 2.80917 -211.61629 897.13657 2935.0000 -223.67240 -213.28330 10.38910 2.74780 -212.85793 877.36158 2940.0000 -222.41753 -212.76015 9.65738 2.76651 -212.47936 881.28096 2945.0000 -223.18714 -213.44601 9.74114 2.75754 -212.66095 886.88019 2950.0000 -223.10962 -212.31094 10.79868 2.75454 -212.72160 897.40959 2955.0000 -221.13166 -211.55466 9.57700 2.81078 -211.58376 920.05601 2960.0000 -223.43073 -213.78122 9.64952 2.73107 -213.19643 847.84889 2965.0000 -221.35541 -212.43392 8.92150 2.72395 -213.34038 842.51807 2970.0000 -221.53409 -210.71737 10.81671 2.80176 -211.76619 898.53471 2975.0000 -222.45327 -212.40148 10.05179 2.79716 -211.85940 877.08550 2980.0000 -223.15090 -212.86697 10.28393 2.77565 -212.29453 879.43750 2985.0000 -223.23623 -213.19150 10.04473 2.74905 -212.83261 874.09880 2990.0000 -222.27175 -210.95038 11.32137 2.80125 -211.77667 898.39305 2995.0000 -224.31488 -213.10563 11.20925 2.81440 -211.51060 923.69603 3000.0000 -222.82363 -213.43379 9.38984 2.71474 -213.52679 837.46654 FREEZING PROCESS: loop number 13 T-loop= 844.00000000000000 main_MD> interactions number 13 at Temperature= 844.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 0.79911 1.89471 0.84941 force_rgl> df(natom) -1.19012 -0.40467 -3.36411 3005.0000 -223.41601 -212.95435 10.46166 2.73544 -213.10796 874.76773 3010.0000 -223.14969 -212.91524 10.23445 2.75847 -212.64208 867.48023 3015.0000 -222.93843 -211.93395 11.00448 2.73819 -213.05234 881.04480 3020.0000 -223.28971 -213.74466 9.54505 2.73336 -213.15008 866.65443 3025.0000 -223.97958 -214.84101 9.13858 2.66272 -214.57933 809.03060 3030.0000 -224.43640 -215.31170 9.12470 2.60262 -215.79522 773.08646 3035.0000 -223.68939 -214.42016 9.26923 2.66293 -214.57509 825.64478 3040.0000 -224.32041 -213.31044 11.00997 2.71417 -213.53825 839.04301 3045.0000 -222.30012 -212.69840 9.60172 2.74384 -212.93807 837.66511 3050.0000 -223.58165 -214.22888 9.35277 2.72370 -213.34562 826.33410 3055.0000 -219.98507 -210.30857 9.67649 2.78580 -212.08909 907.76547 3060.0000 -220.01580 -209.28594 10.72986 2.86704 -210.44553 924.73509 3065.0000 -222.22440 -211.32660 10.89780 2.84697 -210.85163 915.34110 3070.0000 -223.32712 -213.98443 9.34269 2.75450 -212.72244 837.42739 3075.0000 -223.90495 -214.16757 9.73738 2.64698 -214.89764 791.87796 3080.0000 -222.71952 -212.30184 10.41768 2.71375 -213.54683 843.23185 3085.0000 -223.81736 -213.22861 10.58875 2.76566 -212.49666 867.65699 3090.0000 -223.34282 -212.81398 10.52884 2.76473 -212.51543 863.66054 3095.0000 -222.08453 -212.63384 9.45069 2.76453 -212.51945 864.06957 3100.0000 -221.19831 -211.89576 9.30255 2.75977 -212.61583 858.69519 3105.0000 -223.41662 -213.37574 10.04088 2.76435 -212.52313 866.33939 3110.0000 -223.58188 -213.48610 10.09578 2.72437 -213.33207 839.85477 3115.0000 -223.29840 -214.80734 8.49106 2.63697 -215.10016 782.96190 3120.0000 -222.59088 -213.07999 9.51089 2.70151 -213.79448 819.73452 3125.0000 -222.68084 -212.95968 9.72117 2.72667 -213.28543 835.42731 3130.0000 -224.10234 -213.86078 10.24157 2.71723 -213.47643 829.97473 3135.0000 -223.15059 -212.65323 10.49736 2.77086 -212.39147 860.66004 3140.0000 -223.69923 -213.13203 10.56720 2.73677 -213.08109 854.15585 3145.0000 -223.13003 -212.98254 10.14750 2.74175 -212.98041 849.69660 3150.0000 -222.72693 -212.76956 9.95738 2.72959 -213.22637 844.48766 3155.0000 -223.01575 -212.53555 10.48020 2.73778 -213.06070 851.77505 3160.0000 -222.10108 -212.90991 9.19117 2.77659 -212.27549 876.08862 3165.0000 -222.67846 -211.95052 10.72795 2.72492 -213.32084 837.80126 3170.0000 -223.41761 -214.24946 9.16816 2.72652 -213.28840 844.49124 3175.0000 -222.62594 -211.81029 10.81565 2.80199 -211.76169 888.03201 3180.0000 -223.21066 -214.20868 9.00198 2.75516 -212.70904 846.37634 3185.0000 -224.54489 -213.96171 10.58318 2.71932 -213.43410 845.33335 3190.0000 -222.81430 -213.32801 9.48629 2.70704 -213.68264 838.84874 3195.0000 -223.72465 -212.98897 10.73567 2.69502 -213.92573 843.93786 3200.0000 -222.83520 -212.90322 9.93198 2.76784 -212.45243 863.55345 3205.0000 -222.91589 -213.20497 9.71091 2.76108 -212.58927 862.20425 3210.0000 -223.92157 -213.65310 10.26848 2.74621 -212.89019 854.80911 3215.0000 -222.73850 -212.89918 9.83932 2.71185 -213.58532 847.08386 3220.0000 -223.86439 -213.22827 10.63612 2.72678 -213.28319 874.78630 3225.0000 -222.59617 -212.63651 9.95966 2.77413 -212.32531 911.16758 3230.0000 -224.17214 -214.27404 9.89810 2.72551 -213.30899 866.61625 3235.0000 -224.24585 -214.20154 10.04430 2.64338 -214.97054 806.60789 3240.0000 -224.14521 -212.70744 11.43777 2.68060 -214.21748 838.64496 3245.0000 -223.62327 -214.34406 9.27921 2.66608 -214.51135 818.53273 3250.0000 -222.86074 -213.62941 9.23133 2.69426 -213.94106 832.69273 FREEZING PROCESS: loop number 14 T-loop= 819.00000000000000 main_MD> interactions number 14 at Temperature= 819.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 3.36807 0.94402 0.32846 force_rgl> df(natom) -0.15949 -3.27003 -2.02767 3255.0000 -224.38650 -213.99067 10.39583 2.69846 -213.85626 834.19151 3260.0000 -224.37804 -215.17932 9.19871 2.68215 -214.18616 787.45581 3265.0000 -223.59871 -213.86081 9.73790 2.70205 -213.78356 818.40222 3270.0000 -224.31581 -213.67396 10.64185 2.70550 -213.71380 845.32847 3275.0000 -225.54582 -215.94458 9.60124 2.69656 -213.89455 825.48554 3280.0000 -222.59204 -214.28206 8.30997 2.62047 -215.43394 770.10302 3285.0000 -222.81880 -213.91961 8.89919 2.71669 -213.48734 827.42257 3290.0000 -224.65387 -213.85347 10.80039 2.68982 -214.03101 827.36602 3295.0000 -224.66457 -214.66683 9.99775 2.65751 -214.68460 806.92954 3300.0000 -222.89250 -214.27662 8.61589 2.68656 -214.09687 816.63965 3305.0000 -223.53554 -215.22203 8.31351 2.65371 -214.76152 792.82033 3310.0000 -223.48702 -214.47840 9.00863 2.64464 -214.94502 815.27223 3315.0000 -223.43864 -213.35797 10.08067 2.70213 -213.78182 839.04765 3320.0000 -223.19213 -212.21453 10.97760 2.73275 -213.16252 871.31478 3325.0000 -224.19950 -215.39816 8.80134 2.66913 -214.44956 805.81506 3330.0000 -226.02624 -216.79573 9.23051 2.56718 -216.51213 732.19524 3335.0000 -227.36825 -218.11654 9.25171 2.52489 -217.36766 746.34092 3340.0000 -224.08314 -214.22959 9.85355 2.59534 -215.94248 776.99615 3345.0000 -224.26153 -213.44204 10.81949 2.70445 -213.73507 850.09596 3350.0000 -223.98788 -213.56839 10.41949 2.72254 -213.36901 837.22299 3355.0000 -225.37263 -214.01551 11.35712 2.69500 -213.92620 839.61487 3360.0000 -224.75759 -215.55324 9.20435 2.66650 -214.50277 795.14250 3365.0000 -224.31375 -214.07948 10.23428 2.66283 -214.57698 826.75285 3370.0000 -224.08476 -216.04965 8.03511 2.59357 -215.97815 762.01056 3375.0000 -225.22001 -217.09276 8.12724 2.57608 -216.33210 752.58905 3380.0000 -222.64392 -213.37310 9.27082 2.63417 -215.15686 781.57246 3385.0000 -224.36113 -213.84167 10.51947 2.75777 -212.65623 861.25951 3390.0000 -224.32057 -212.84943 11.47114 2.71550 -213.51151 845.14959 3395.0000 -223.33152 -212.76183 10.56969 2.72784 -213.26176 862.78112 3400.0000 -220.93226 -211.87137 9.06089 2.75343 -212.74414 845.57715 3405.0000 -222.87406 -212.75865 10.11541 2.74550 -212.90439 854.90660 3410.0000 -223.68179 -214.78076 8.90103 2.67376 -214.35590 814.17400 3415.0000 -223.17909 -212.88530 10.29379 2.69916 -213.84207 837.93526 3420.0000 -225.00280 -215.06208 9.94072 2.69373 -213.95188 822.14862 3425.0000 -224.27446 -214.62358 9.65088 2.64860 -214.86491 797.79145 3430.0000 -224.31347 -215.14319 9.17027 2.66895 -214.45314 811.85822 3435.0000 -223.85022 -215.71697 8.13325 2.60799 -215.68660 801.43513 3440.0000 -224.39093 -215.80630 8.58464 2.60552 -215.73658 771.22746 3445.0000 -224.64927 -214.51182 10.13746 2.60585 -215.72983 761.27354 3450.0000 -224.09836 -214.88873 9.20962 2.68401 -214.14858 808.26743 3455.0000 -225.28624 -215.91186 9.37439 2.65230 -214.79015 821.63964 3460.0000 -223.20228 -213.94817 9.25411 2.66027 -214.62887 842.87300 3465.0000 -223.73050 -214.38690 9.34360 2.69330 -213.96064 821.80848 3470.0000 -224.45777 -215.07747 9.38030 2.63863 -215.06669 783.10060 3475.0000 -225.32699 -216.43273 8.89426 2.63606 -215.11861 800.46439 3480.0000 -224.74134 -214.63280 10.10854 2.65526 -214.73023 812.98478 3485.0000 -224.10596 -215.78446 8.32150 2.62042 -215.43502 790.86632 3490.0000 -222.28660 -213.06504 9.22156 2.66281 -214.57742 819.43857 3495.0000 -223.35190 -214.38008 8.97182 2.72378 -213.34391 842.72630 3500.0000 -224.20513 -215.15434 9.05080 2.62757 -215.29044 785.62436 FREEZING PROCESS: loop number 15 T-loop= 794.00000000000000 main_MD> interactions number 15 at Temperature= 794.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 2.04871 -2.12195 3.39498 force_rgl> df(natom) 1.98905 -7.58306 3.99175 3505.0000 -225.26780 -216.38989 8.87790 2.56643 -216.52724 765.37707 3510.0000 -224.89331 -215.13058 9.76274 2.60045 -215.83905 793.38721 3515.0000 -226.74542 -215.44212 11.30330 2.61638 -215.51680 810.54638 3520.0000 -225.14517 -216.03576 9.10940 2.63914 -215.05634 810.18143 3525.0000 -225.10971 -216.24118 8.86853 2.60294 -215.78869 786.68208 3530.0000 -225.74899 -216.67778 9.07121 2.57633 -216.32702 743.02593 3535.0000 -225.14601 -216.92549 8.22052 2.58378 -216.17636 742.62634 3540.0000 -225.00093 -214.79375 10.20718 2.63838 -215.07174 799.85216 3545.0000 -223.59265 -215.21801 8.37464 2.67048 -214.42222 802.49298 3550.0000 -225.24078 -215.76705 9.47373 2.64274 -214.98353 788.66618 3555.0000 -225.93914 -216.85536 9.08378 2.58405 -216.17092 764.11309 3560.0000 -226.88769 -216.52887 10.35883 2.57694 -216.31465 764.85772 3565.0000 -223.48968 -214.74052 8.74916 2.58265 -216.19921 766.99243 3570.0000 -221.75043 -213.41098 8.33945 2.71787 -213.46354 864.36540 3575.0000 -223.63678 -212.80783 10.82895 2.70153 -213.79414 851.41576 3580.0000 -223.67447 -214.18059 9.49388 2.71508 -213.51985 857.09929 3585.0000 -225.42578 -215.87787 9.54791 2.62071 -215.42921 775.21115 3590.0000 -225.55061 -216.92077 8.62983 2.54168 -217.02800 746.31494 3595.0000 -225.74320 -216.94032 8.80288 2.52324 -217.40103 732.87695 3600.0000 -224.90330 -214.95614 9.94716 2.60143 -215.81924 783.48954 3605.0000 -224.92522 -214.87535 10.04987 2.62969 -215.24757 802.17197 3610.0000 -225.88041 -215.83975 10.04066 2.59321 -215.98546 780.73983 3615.0000 -224.66608 -215.57918 9.08690 2.55964 -216.66468 742.75624 3620.0000 -224.01010 -215.29374 8.71636 2.62651 -215.31178 805.08369 3625.0000 -223.19554 -215.35103 7.84451 2.67439 -214.34312 837.83490 3630.0000 -225.10259 -214.60456 10.49804 2.63153 -215.21022 788.67364 3635.0000 -226.62281 -218.64590 7.97690 2.53749 -217.11282 730.42069 3640.0000 -226.71184 -218.10902 8.60282 2.48224 -218.23067 718.62008 3645.0000 -225.46374 -215.58500 9.87874 2.53878 -217.08672 743.53489 3650.0000 -224.86354 -215.09261 9.77093 2.61422 -215.56038 784.41530 3655.0000 -224.37885 -215.00715 9.37170 2.61155 -215.61447 793.38084 3660.0000 -225.47491 -213.83988 11.63503 2.68162 -214.19680 833.95961 3665.0000 -224.20543 -215.42848 8.77694 2.68004 -214.22878 837.09249 3670.0000 -224.69783 -215.88526 8.81257 2.62763 -215.28920 794.45984 3675.0000 -225.69008 -216.65544 9.03463 2.56762 -216.50333 758.92454 3680.0000 -227.76142 -219.36502 8.39640 2.47906 -218.29489 701.09393 3685.0000 -225.18696 -216.64408 8.54289 2.46145 -218.65122 702.79066 3690.0000 -225.70719 -216.26712 9.44007 2.57722 -216.30913 765.73740 3695.0000 -225.23032 -215.88652 9.34380 2.60013 -215.84561 792.54157 3700.0000 -224.43324 -215.49985 8.93338 2.63146 -215.21163 798.92130 3705.0000 -224.86515 -216.59582 8.26933 2.58803 -216.09042 764.68626 3710.0000 -224.01213 -214.75633 9.25579 2.63772 -215.08510 798.22347 3715.0000 -225.77168 -217.49144 8.28024 2.59581 -215.93300 790.37622 3720.0000 -223.02190 -213.31648 9.70542 2.61740 -215.49607 792.54324 3725.0000 -224.02733 -215.36895 8.65839 2.72363 -213.34698 837.74254 3730.0000 -223.22999 -214.41342 8.81657 2.62334 -215.37604 765.00286 3735.0000 -224.34295 -214.90166 9.44129 2.71279 -213.56615 858.89485 3740.0000 -224.44188 -214.57433 9.86755 2.70265 -213.77146 835.17768 3745.0000 -223.71338 -214.76961 8.94377 2.66878 -214.45654 798.21261 3750.0000 -224.55797 -215.25922 9.29874 2.66745 -214.48351 818.36397 FREEZING PROCESS: loop number 16 T-loop= 769.00000000000000 main_MD> interactions number 16 at Temperature= 769.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 2.65004 2.21137 -0.91928 force_rgl> df(natom) -1.41728 0.53978 2.36567 3755.0000 -224.67551 -214.91960 9.75592 2.64816 -214.87372 817.73500 3760.0000 -225.13905 -215.51543 9.62362 2.64049 -215.02907 813.11327 3765.0000 -224.16061 -215.19091 8.96970 2.63121 -215.21677 797.52333 3770.0000 -222.35918 -213.33247 9.02671 2.68653 -214.09760 828.36932 3775.0000 -223.78350 -215.30757 8.47594 2.63665 -215.10658 804.62813 3780.0000 -224.85489 -214.61263 10.24227 2.65580 -214.71924 810.97145 3785.0000 -224.15094 -215.35180 8.79914 2.62971 -215.24716 797.31823 3790.0000 -225.77180 -216.73776 9.03404 2.57481 -216.35788 765.85496 3795.0000 -225.05365 -216.05939 8.99427 2.58548 -216.14197 772.71113 3800.0000 -224.64334 -216.38745 8.25589 2.56283 -216.60011 760.24293 3805.0000 -224.60518 -216.08149 8.52368 2.59061 -216.03808 781.18767 3810.0000 -224.81118 -216.88418 7.92700 2.61248 -215.59572 778.46920 3815.0000 -224.62603 -216.34515 8.28088 2.55915 -216.67456 725.33830 3820.0000 -226.68433 -217.52737 9.15697 2.56732 -216.50934 738.04943 3825.0000 -227.09999 -219.01649 8.08351 2.48244 -218.22664 699.54719 3830.0000 -225.27575 -217.59258 7.68316 2.50790 -217.71145 697.09347 3835.0000 -225.70722 -216.11464 9.59258 2.55824 -216.69306 724.88745 3840.0000 -224.91387 -215.47408 9.43979 2.62533 -215.33573 809.37456 3845.0000 -223.53215 -214.22165 9.31051 2.64422 -214.95361 818.14479 3850.0000 -223.49319 -215.25753 8.23566 2.66901 -214.45208 817.41866 3855.0000 -225.71240 -216.54964 9.16275 2.60255 -215.79659 774.17384 3860.0000 -224.32299 -216.14172 8.18127 2.56690 -216.51783 750.70174 3865.0000 -225.69909 -216.75563 8.94346 2.57464 -216.36115 752.57361 3870.0000 -225.00050 -216.35410 8.64640 2.54658 -216.92899 728.48823 3875.0000 -225.97916 -217.31868 8.66048 2.53826 -217.09733 729.75777 3880.0000 -227.39974 -218.82356 8.57618 2.48489 -218.17710 698.03175 3885.0000 -224.31043 -214.35127 9.95915 2.57176 -216.41941 771.37559 3890.0000 -223.62135 -214.51202 9.10933 2.69621 -213.90166 834.02051 3895.0000 -225.14846 -216.97866 8.16981 2.58718 -216.10759 759.46836 3900.0000 -225.28716 -216.55841 8.72875 2.54491 -216.96278 755.36868 3905.0000 -225.03499 -216.33249 8.70250 2.55683 -216.72165 759.77782 3910.0000 -224.67617 -214.97513 9.70105 2.62768 -215.28808 773.56831 3915.0000 -224.10220 -214.91317 9.18903 2.64604 -214.91668 799.93765 3920.0000 -225.18445 -215.38653 9.79792 2.63855 -215.06827 797.04111 3925.0000 -225.34782 -215.54395 9.80387 2.60139 -215.82004 771.48988 3930.0000 -225.65498 -217.86554 7.78944 2.55635 -216.73135 756.11147 3935.0000 -227.42383 -219.60993 7.81390 2.45276 -218.82714 688.35191 3940.0000 -226.38134 -217.79359 8.58775 2.48623 -218.14998 734.29031 3945.0000 -225.85230 -217.11097 8.74133 2.51067 -217.65534 734.68509 3950.0000 -224.23807 -215.86650 8.37158 2.54388 -216.98347 749.22293 3955.0000 -225.73097 -218.39151 7.33946 2.53734 -217.11584 746.53330 3960.0000 -225.16476 -216.44676 8.71800 2.53526 -217.15795 729.24711 3965.0000 -224.93178 -216.11059 8.82119 2.61090 -215.62761 760.85524 3970.0000 -226.00038 -217.31773 8.68265 2.55882 -216.68136 755.72568 3975.0000 -223.99111 -214.26748 9.72363 2.61177 -215.61003 784.40119 3980.0000 -224.90801 -215.30739 9.60062 2.61208 -215.60381 788.67456 3985.0000 -226.41793 -215.60074 10.81720 2.61492 -215.54636 778.45584 3990.0000 -222.57895 -214.63201 7.94693 2.61209 -215.60366 769.24974 3995.0000 -224.39257 -214.75290 9.63968 2.63156 -215.20965 776.85642 4000.0000 -225.43460 -218.30539 7.12921 2.51853 -217.49637 727.00850 FREEZING PROCESS: loop number 17 T-loop= 744.00000000000000 main_MD> interactions number 17 at Temperature= 744.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -0.11918 -0.36268 -2.28874 force_rgl> df(natom) -1.36442 1.96492 -1.77173 4005.0000 -225.06958 -217.14159 7.92799 2.50913 -217.68657 729.90768 4010.0000 -225.01175 -215.80026 9.21150 2.57369 -216.38043 766.27138 4015.0000 -225.55746 -216.55965 8.99780 2.54992 -216.86144 732.61009 4020.0000 -225.50288 -217.16830 8.33458 2.50689 -217.73200 712.93816 4025.0000 -227.12750 -218.15530 8.97220 2.49994 -217.87259 714.64974 4030.0000 -226.41700 -217.40073 9.01627 2.52812 -217.30246 752.51079 4035.0000 -226.76921 -217.58954 9.17967 2.50861 -217.69716 710.86702 4040.0000 -224.52409 -215.63207 8.89202 2.56426 -216.57125 720.51250 4045.0000 -225.56649 -215.34971 10.21678 2.63799 -215.07954 792.75532 4050.0000 -225.80773 -217.64159 8.16614 2.52784 -217.30808 753.97340 4055.0000 -226.19302 -217.58248 8.61054 2.49753 -217.92130 702.92120 4060.0000 -227.10220 -216.93185 10.17035 2.56753 -216.50500 748.79914 4065.0000 -226.10841 -217.57294 8.53547 2.51753 -217.51664 735.21244 4070.0000 -225.12810 -217.31798 7.81012 2.55085 -216.84251 742.71955 4075.0000 -227.27679 -218.45838 8.81841 2.52643 -217.33668 730.96877 4080.0000 -224.88066 -217.37353 7.50713 2.51842 -217.49871 706.43131 4085.0000 -224.86295 -217.54677 7.31618 2.56368 -216.58290 750.14431 4090.0000 -224.73101 -216.08372 8.64729 2.57240 -216.40659 730.83195 4095.0000 -223.71333 -216.97196 6.74137 2.53960 -217.07019 737.11934 4100.0000 -226.49651 -218.54474 7.95176 2.54054 -217.05103 729.18309 4105.0000 -225.55109 -216.77648 8.77461 2.49201 -218.03297 702.96312 4110.0000 -227.03399 -217.95468 9.07931 2.51730 -217.52132 734.16241 4115.0000 -226.90547 -218.63474 8.27073 2.46336 -218.61257 692.77204 4120.0000 -226.74983 -218.12334 8.62650 2.49430 -217.98655 709.39674 4125.0000 -226.20049 -218.60344 7.59706 2.46850 -218.50857 681.32295 4130.0000 -225.75058 -216.67710 9.07347 2.52857 -217.29329 720.78135 4135.0000 -225.67974 -215.48896 10.19079 2.55376 -216.78375 750.42250 4140.0000 -224.60968 -215.71391 8.89577 2.60222 -215.80316 789.19110 4145.0000 -224.78720 -216.99650 7.79070 2.61783 -215.48740 800.52937 4150.0000 -227.09501 -217.65596 9.43905 2.51730 -217.52134 735.11021 4155.0000 -226.60887 -218.03593 8.57294 2.47738 -218.32893 716.85061 4160.0000 -225.95716 -217.24964 8.70752 2.50429 -217.78444 699.43272 4165.0000 -224.82510 -215.60028 9.22483 2.55244 -216.81030 719.88296 4170.0000 -226.28719 -216.42968 9.85751 2.62326 -215.37762 783.81810 4175.0000 -226.05016 -216.81056 9.23959 2.57977 -216.25739 769.43698 4180.0000 -225.34313 -215.16859 10.17454 2.55516 -216.75532 758.51309 4185.0000 -223.64735 -214.01993 9.62742 2.65412 -214.75321 796.31424 4190.0000 -225.60408 -216.50247 9.10161 2.65265 -214.78290 788.94594 4195.0000 -225.26736 -217.02363 8.24373 2.57537 -216.34653 772.10183 4200.0000 -225.18325 -216.80950 8.37375 2.56874 -216.48062 759.24588 4205.0000 -226.23996 -216.88597 9.35398 2.56896 -216.47606 744.21842 4210.0000 -226.06257 -217.28454 8.77803 2.55824 -216.69300 753.20967 4215.0000 -225.67833 -217.05982 8.61852 2.53245 -217.21476 724.06819 4220.0000 -226.23172 -217.36192 8.86980 2.51827 -217.50176 725.26118 4225.0000 -225.87480 -217.60970 8.26510 2.50404 -217.78960 724.83047 4230.0000 -224.78435 -215.86867 8.91567 2.58674 -216.11650 764.78274 4235.0000 -225.11811 -215.75552 9.36258 2.59940 -215.86024 753.50187 4240.0000 -225.95878 -217.70902 8.24976 2.60273 -215.79285 782.62915 4245.0000 -227.17843 -218.11155 9.06688 2.54413 -216.97848 756.74374 4250.0000 -226.06180 -218.40304 7.65876 2.49811 -217.90952 736.97179 FREEZING PROCESS: loop number 18 T-loop= 719.00000000000000 main_MD> interactions number 18 at Temperature= 719.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -0.18313 3.35889 -1.00794 force_rgl> df(natom) 2.57342 -0.66347 1.18150 4255.0000 -227.38546 -219.18580 8.19966 2.45458 -218.79020 668.71618 4260.0000 -227.52024 -218.79132 8.72893 2.46071 -218.66615 675.41530 4265.0000 -227.96656 -220.08457 7.88199 2.38191 -220.26054 644.35342 4270.0000 -227.14968 -219.57581 7.57386 2.43929 -219.09946 671.05348 4275.0000 -226.87844 -218.60327 8.27517 2.48944 -218.08500 720.11283 4280.0000 -228.16889 -220.16148 8.00741 2.42696 -219.34905 658.58466 4285.0000 -228.02843 -220.52624 7.50219 2.43985 -219.08816 664.32522 4290.0000 -227.72200 -219.63645 8.08555 2.40417 -219.81000 654.68605 4295.0000 -227.58693 -220.44966 7.13726 2.38550 -220.18779 647.50873 4300.0000 -225.52375 -217.35933 8.16441 2.48508 -218.17310 699.83259 4305.0000 -227.20066 -218.58482 8.61584 2.49108 -218.05173 715.94432 4310.0000 -225.18174 -216.78564 8.39610 2.51530 -217.56173 709.82220 4315.0000 -224.06410 -215.21122 8.85289 2.57151 -216.42460 762.84115 4320.0000 -225.88575 -217.51917 8.36658 2.54601 -216.94053 741.96670 4325.0000 -226.13932 -216.26539 9.87393 2.53813 -217.09983 729.41720 4330.0000 -226.57796 -218.26404 8.31392 2.52797 -217.30542 742.23110 4335.0000 -227.20111 -218.98858 8.21253 2.50952 -217.67877 715.73299 4340.0000 -225.47868 -217.75793 7.72075 2.46083 -218.66371 694.60749 4345.0000 -225.59159 -216.65009 8.94149 2.54122 -217.03734 754.78755 4350.0000 -226.09250 -217.33581 8.75669 2.54210 -217.01951 731.09126 4355.0000 -225.53295 -217.09452 8.43842 2.51015 -217.66601 695.68747 4360.0000 -225.57064 -216.68051 8.89012 2.57052 -216.44451 731.17075 4365.0000 -225.19383 -216.98986 8.20396 2.56199 -216.61712 733.34519 4370.0000 -226.28474 -217.00784 9.27691 2.57365 -216.38116 736.57051 4375.0000 -226.99867 -218.51486 8.48381 2.50115 -217.84802 691.38528 4380.0000 -227.25525 -217.71981 9.53544 2.49921 -217.88729 749.29347 4385.0000 -226.60644 -217.67194 8.93450 2.51765 -217.51428 735.75753 4390.0000 -227.08733 -217.43704 9.65029 2.54219 -217.01778 744.05797 4395.0000 -225.37270 -217.36391 8.00879 2.52080 -217.45055 721.99824 4400.0000 -223.97202 -215.19392 8.77810 2.56234 -216.61011 739.12867 4405.0000 -226.12931 -216.66651 9.46280 2.58207 -216.21085 758.60341 4410.0000 -224.71347 -215.27167 9.44180 2.53014 -217.26163 727.17317 4415.0000 -225.83324 -217.27709 8.55614 2.59130 -216.02410 775.79998 4420.0000 -227.38807 -217.88070 9.50737 2.50041 -217.86307 723.82779 4425.0000 -226.98650 -217.87669 9.10980 2.52608 -217.34375 730.44192 4430.0000 -228.44936 -219.58003 8.86933 2.46559 -218.56745 691.90620 4435.0000 -227.06915 -219.38281 7.68634 2.40155 -219.86302 647.07470 4440.0000 -226.82319 -218.22051 8.60267 2.44153 -219.05419 670.19815 4445.0000 -227.02947 -219.53453 7.49494 2.44199 -219.04491 688.85080 4450.0000 -226.20957 -217.25604 8.95353 2.46932 -218.49196 678.94473 4455.0000 -226.79860 -217.49106 9.30753 2.52918 -217.28090 713.74720 4460.0000 -227.10750 -218.52000 8.58750 2.47805 -218.31547 709.51332 4465.0000 -226.98136 -218.60802 8.37334 2.48156 -218.24445 712.21120 4470.0000 -224.77766 -216.52857 8.24909 2.51653 -217.53696 733.32605 4475.0000 -226.88442 -217.87784 9.00658 2.51690 -217.52940 734.90574 4480.0000 -225.35280 -217.47046 7.88234 2.48858 -218.10233 677.65493 4485.0000 -225.86906 -217.64484 8.22422 2.51940 -217.47878 727.41387 4490.0000 -225.74145 -216.53393 9.20752 2.54021 -217.05771 732.44724 4495.0000 -225.59256 -215.73991 9.85265 2.55803 -216.69722 741.67409 4500.0000 -224.94093 -214.95701 9.98392 2.65206 -214.79481 781.70526 FREEZING PROCESS: loop number 19 T-loop= 694.00000000000000 main_MD> interactions number 19 at Temperature= 694.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -0.69461 0.88044 -0.69440 force_rgl> df(natom) -0.65839 4.09550 -4.69332 4505.0000 -225.82413 -216.08485 9.73929 2.59315 -215.98682 744.20932 4510.0000 -226.49680 -217.96433 8.53247 2.57436 -216.36697 757.56790 4515.0000 -226.38539 -218.80529 7.58010 2.48604 -218.15375 672.02506 4520.0000 -227.42393 -219.18577 8.23816 2.46321 -218.61558 669.65940 4525.0000 -224.97949 -216.90893 8.07056 2.51592 -217.54921 715.85794 4530.0000 -225.35079 -217.44199 7.90880 2.56137 -216.62961 754.58509 4535.0000 -225.97384 -216.65034 9.32350 2.54203 -217.02095 732.07403 4540.0000 -226.63188 -218.25572 8.37615 2.52206 -217.42504 728.30850 4545.0000 -226.39123 -218.22597 8.16526 2.48566 -218.16146 694.38694 4550.0000 -225.71283 -218.28300 7.42983 2.49702 -217.93170 701.00465 4555.0000 -226.97431 -219.18363 7.79067 2.48902 -218.09350 680.09092 4560.0000 -227.28351 -218.50427 8.77924 2.44221 -219.04056 688.25825 4565.0000 -226.87354 -218.92163 7.95191 2.46892 -218.50009 702.19966 4570.0000 -227.25633 -218.73114 8.52519 2.49338 -218.00532 726.85690 4575.0000 -226.93610 -218.78472 8.15138 2.47184 -218.44104 708.95939 4580.0000 -226.65663 -218.32361 8.33302 2.47950 -218.28599 709.93001 4585.0000 -227.32021 -218.21160 9.10861 2.46464 -218.58670 675.41729 4590.0000 -226.06960 -216.18219 9.88741 2.54211 -217.01927 730.15079 4595.0000 -226.79587 -216.89945 9.89642 2.58443 -216.16326 753.27980 4600.0000 -226.04497 -216.59297 9.45200 2.51649 -217.53769 735.05702 4605.0000 -227.02948 -218.69072 8.33876 2.50179 -217.83503 732.68788 4610.0000 -226.04569 -218.52889 7.51680 2.42707 -219.34686 662.57365 4615.0000 -225.99499 -217.92883 8.06616 2.48237 -218.22805 717.89528 4620.0000 -226.75321 -218.54718 8.20604 2.48699 -218.13444 705.23333 4625.0000 -227.55939 -219.63961 7.91977 2.43352 -219.21632 679.51094 4630.0000 -226.72631 -218.28500 8.44131 2.44861 -218.91105 679.97071 4635.0000 -226.04853 -218.96602 7.08251 2.46249 -218.63028 692.38037 4640.0000 -226.55135 -218.19348 8.35787 2.47346 -218.40834 699.94277 4645.0000 -225.43010 -215.83217 9.59793 2.53983 -217.06544 744.57517 4650.0000 -226.48359 -218.76459 7.71900 2.54808 -216.89855 734.58223 4655.0000 -226.31164 -217.54610 8.76554 2.48686 -218.13711 693.16323 4660.0000 -226.29138 -217.66063 8.63075 2.45706 -218.74001 686.14247 4665.0000 -226.59132 -218.64221 7.94911 2.47050 -218.46816 716.70971 4670.0000 -226.92431 -217.36197 9.56233 2.47449 -218.38738 719.75751 4675.0000 -222.85659 -215.04792 7.80867 2.56367 -216.58307 754.05609 4680.0000 -224.97860 -216.85394 8.12466 2.57554 -216.34296 741.45701 4685.0000 -226.23267 -217.38005 8.85262 2.56276 -216.60154 728.47199 4690.0000 -227.05844 -217.74655 9.31189 2.57520 -216.34995 772.63527 4695.0000 -227.37570 -218.60623 8.76946 2.46075 -218.66544 677.80340 4700.0000 -225.95655 -217.88445 8.07209 2.49954 -217.88052 722.94257 4705.0000 -226.92656 -218.24065 8.68591 2.52207 -217.42474 731.64782 4710.0000 -227.48040 -220.46192 7.01848 2.40385 -219.81659 649.47496 4715.0000 -227.79401 -219.03077 8.76324 2.39818 -219.93131 655.20429 4720.0000 -227.30256 -218.13120 9.17136 2.49373 -217.99811 709.79693 4725.0000 -227.50063 -219.22214 8.27849 2.46961 -218.48623 687.65616 4730.0000 -226.31428 -217.20750 9.10678 2.46339 -218.61206 694.19912 4735.0000 -225.94272 -217.16082 8.78190 2.49317 -218.00949 713.98155 4740.0000 -227.41017 -219.33687 8.07330 2.49715 -217.92891 715.66057 4745.0000 -226.85063 -218.08212 8.76851 2.44562 -218.97154 684.16574 4750.0000 -225.22630 -216.96018 8.26612 2.54223 -217.01685 741.24128 FREEZING PROCESS: loop number 20 T-loop= 669.00000000000000 main_MD> interactions number 20 at Temperature= 669.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 0.41374 -2.67813 -0.30540 force_rgl> df(natom) 5.04349 -15.44850 -1.86802 4755.0000 -227.87887 -219.56377 8.31510 2.45959 -218.68888 693.83180 4760.0000 -227.86598 -221.18565 6.68032 2.39411 -220.01356 645.40580 4765.0000 -228.03624 -219.51247 8.52378 2.37365 -220.42752 656.71998 4770.0000 -227.08851 -218.36006 8.72845 2.43001 -219.28730 694.01714 4775.0000 -226.92345 -217.55414 9.36931 2.46144 -218.65133 686.63192 4780.0000 -226.83520 -219.31289 7.52231 2.44665 -218.95062 670.87969 4785.0000 -228.87821 -220.56197 8.31624 2.37198 -220.46143 652.04384 4790.0000 -226.97594 -220.25324 6.72270 2.39976 -219.89922 669.12568 4795.0000 -228.21137 -219.56211 8.64926 2.40053 -219.88379 643.55923 4800.0000 -226.61982 -219.40284 7.21698 2.41301 -219.63128 668.62776 4805.0000 -226.84949 -218.96966 7.87983 2.42162 -219.45700 655.09754 4810.0000 -226.93245 -217.76594 9.16651 2.46065 -218.66738 669.19767 4815.0000 -226.10441 -217.70313 8.40128 2.49974 -217.87658 689.41763 4820.0000 -226.01060 -218.52659 7.48401 2.46911 -218.49617 676.85815 4825.0000 -226.49198 -217.76652 8.72546 2.48351 -218.20488 705.65936 4830.0000 -226.50614 -218.59955 7.90659 2.50001 -217.87116 690.15441 4835.0000 -227.08384 -219.63126 7.45258 2.44462 -218.99180 671.75500 4840.0000 -225.83044 -218.12351 7.70693 2.44783 -218.92679 672.40553 4845.0000 -226.30027 -218.16577 8.13449 2.46128 -218.65470 658.16548 4850.0000 -228.20172 -219.34222 8.85950 2.45837 -218.71345 676.65980 4855.0000 -228.47350 -221.04990 7.42360 2.39662 -219.96284 637.35928 4860.0000 -226.52732 -217.65134 8.87598 2.41666 -219.55746 656.93572 4865.0000 -225.81482 -218.78028 7.03454 2.50723 -217.72502 719.26518 4870.0000 -225.50437 -217.55700 7.94737 2.49948 -217.88191 699.27524 4875.0000 -225.49075 -219.11965 6.37110 2.50260 -217.81873 701.73273 4880.0000 -225.41462 -218.12522 7.28940 2.47069 -218.46438 668.52089 4885.0000 -226.99400 -218.30061 8.69339 2.49888 -217.89399 685.53011 4890.0000 -227.23016 -219.74175 7.48841 2.44600 -218.96373 675.81694 4895.0000 -227.06075 -219.59470 7.46605 2.39582 -219.97904 656.00434 4900.0000 -227.24524 -218.78056 8.46468 2.41157 -219.66041 650.38419 4905.0000 -228.14138 -219.83575 8.30563 2.46037 -218.67298 698.91710 4910.0000 -228.23169 -220.95827 7.27342 2.38455 -220.20713 658.90149 4915.0000 -227.51200 -217.90122 9.61078 2.39853 -219.92420 675.42468 4920.0000 -227.39065 -220.39987 6.99078 2.42362 -219.41657 666.01348 4925.0000 -227.29788 -219.02737 8.27050 2.42531 -219.38230 658.47186 4930.0000 -227.11002 -219.21023 7.89979 2.43478 -219.19076 667.48459 4935.0000 -227.46740 -219.79507 7.67233 2.40568 -219.77950 671.66079 4940.0000 -227.11463 -218.95386 8.16077 2.39351 -220.02581 662.17159 4945.0000 -226.40056 -218.14057 8.25999 2.46367 -218.60634 700.57666 4950.0000 -226.98185 -217.90605 9.07580 2.47132 -218.45147 706.70924 4955.0000 -228.06546 -220.93782 7.12764 2.36013 -220.70104 635.49292 4960.0000 -228.61864 -220.79488 7.82375 2.34963 -220.91358 647.31081 4965.0000 -226.84691 -219.20925 7.63766 2.39004 -220.09605 664.12593 4970.0000 -228.28993 -221.19921 7.09071 2.39383 -220.01934 670.33821 4975.0000 -227.06939 -219.25937 7.81003 2.40175 -219.85909 659.52799 4980.0000 -227.83938 -218.89722 8.94217 2.42861 -219.31565 668.88642 4985.0000 -228.09425 -221.15607 6.93818 2.37947 -220.30979 659.88576 4990.0000 -228.86274 -221.26291 7.59982 2.34096 -221.08898 619.56982 4995.0000 -227.58334 -219.30342 8.27992 2.37219 -220.45709 638.28839 5000.0000 -226.89181 -219.45507 7.43675 2.39659 -219.96346 632.00235 FREEZING PROCESS: loop number 21 T-loop= 644.00000000000000 main_MD> interactions number 21 at Temperature= 644.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -1.88448 -0.57043 0.39323 force_rgl> df(natom) -0.81851 -2.70298 2.24317 5005.0000 -227.89583 -219.97961 7.91622 2.41564 -219.57811 664.82527 5010.0000 -228.21939 -220.59416 7.62523 2.37143 -220.47246 636.79484 5015.0000 -227.65377 -220.58430 7.06947 2.37482 -220.40382 645.20850 5020.0000 -227.07534 -219.89485 7.18049 2.41113 -219.66932 645.32180 5025.0000 -226.49564 -218.83842 7.65722 2.42598 -219.36875 650.25618 5030.0000 -227.89899 -220.53174 7.36726 2.40428 -219.80780 644.58384 5035.0000 -228.37360 -221.59479 6.77881 2.31369 -221.64066 588.52022 5040.0000 -227.78761 -220.80912 6.97850 2.36950 -220.51157 629.42288 5045.0000 -228.51143 -221.19674 7.31469 2.34682 -220.97043 618.86016 5050.0000 -228.52979 -220.49622 8.03357 2.33539 -221.20166 625.60486 5055.0000 -227.76625 -220.52254 7.24371 2.37937 -220.31192 647.91190 5060.0000 -229.08690 -221.42645 7.66045 2.33320 -221.24583 628.51602 5065.0000 -228.00940 -220.57216 7.43725 2.32271 -221.45814 612.20549 5070.0000 -227.02307 -219.64504 7.37804 2.38833 -220.13051 644.59042 5075.0000 -227.95366 -219.97362 7.98005 2.37158 -220.46938 633.07941 5080.0000 -226.59394 -219.30150 7.29244 2.39299 -220.03631 646.28820 5085.0000 -227.58256 -220.83220 6.75036 2.40948 -219.70265 644.67450 5090.0000 -227.99485 -220.52975 7.46510 2.35339 -220.83741 621.24824 5095.0000 -227.61978 -220.24339 7.37639 2.43075 -219.27224 668.10943 5100.0000 -228.48422 -220.25151 8.23272 2.36811 -220.53970 631.21636 5105.0000 -226.41752 -218.29569 8.12183 2.40203 -219.85338 654.60969 5110.0000 -228.48594 -220.20268 8.28326 2.42325 -219.42401 665.57861 5115.0000 -229.11913 -221.85241 7.26672 2.35223 -220.86099 607.72545 5120.0000 -228.30189 -221.92272 6.37917 2.28413 -222.23858 567.04328 5125.0000 -228.28000 -220.81785 7.46215 2.30408 -221.83507 587.87245 5130.0000 -228.07457 -222.03099 6.04359 2.32690 -221.37339 611.14444 5135.0000 -227.93769 -220.64824 7.28945 2.34865 -220.93328 610.37515 5140.0000 -227.26379 -219.40571 7.85808 2.35046 -220.89672 639.26927 5145.0000 -227.66270 -220.22678 7.43592 2.37100 -220.48122 646.32394 5150.0000 -227.49357 -220.44388 7.04969 2.35594 -220.78580 635.25927 5155.0000 -228.94999 -221.02451 7.92548 2.36382 -220.62636 659.72534 5160.0000 -229.98171 -222.91156 7.07015 2.29577 -222.00318 602.89934 5165.0000 -228.64568 -221.21363 7.43205 2.30493 -221.81788 601.13810 5170.0000 -227.14076 -219.61172 7.52904 2.40289 -219.83590 654.61997 5175.0000 -228.28940 -221.23964 7.04976 2.35042 -220.89749 616.80228 5180.0000 -227.44787 -219.87127 7.57659 2.36696 -220.56287 628.57013 5185.0000 -227.27611 -220.25741 7.01870 2.41403 -219.61069 646.43389 5190.0000 -227.88716 -220.97049 6.91667 2.39161 -220.06417 642.25788 5195.0000 -227.97240 -220.73383 7.23857 2.34975 -220.91099 604.93406 5200.0000 -228.66386 -221.57518 7.08868 2.32138 -221.48497 617.34699 5205.0000 -227.45633 -221.61817 5.83817 2.29624 -221.99374 607.38702 5210.0000 -229.38298 -222.58840 6.79458 2.31203 -221.67415 593.57181 5215.0000 -228.65743 -222.64707 6.01036 2.28476 -222.22595 572.13945 5220.0000 -228.74754 -221.56953 7.17801 2.32042 -221.50449 625.90210 5225.0000 -227.16180 -219.33668 7.82513 2.32162 -221.48012 620.02917 5230.0000 -229.47418 -221.41686 8.05731 2.37680 -220.36375 645.49486 5235.0000 -228.74238 -222.00501 6.73738 2.31090 -221.69709 600.20340 5240.0000 -228.50684 -221.91685 6.58999 2.36490 -220.60465 638.03838 5245.0000 -229.90750 -222.30118 7.60632 2.32483 -221.41529 618.68162 5250.0000 -228.53958 -221.57293 6.96666 2.27963 -222.32971 591.52903 FREEZING PROCESS: loop number 22 T-loop= 619.00000000000000 main_MD> interactions number 22 at Temperature= 619.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -0.13748 0.29891 -0.28659 force_rgl> df(natom) 3.29398 0.59073 -1.17140 5255.0000 -228.68429 -221.73679 6.94750 2.32031 -221.50670 608.68980 5260.0000 -227.37745 -220.38179 6.99566 2.34104 -221.08737 620.22464 5265.0000 -227.65560 -219.31073 8.34487 2.38697 -220.15815 649.78039 5270.0000 -227.67080 -221.00411 6.66670 2.37094 -220.48243 639.53154 5275.0000 -227.89872 -220.88156 7.01716 2.35993 -220.70519 643.70639 5280.0000 -227.67338 -220.77293 6.90045 2.39998 -219.89488 647.49930 5285.0000 -227.08045 -219.80537 7.27508 2.37130 -220.47516 615.39953 5290.0000 -226.25782 -218.90724 7.35058 2.43918 -219.10179 683.68935 5295.0000 -227.37166 -220.58989 6.78176 2.39982 -219.89800 628.31225 5300.0000 -228.42858 -221.09247 7.33611 2.33808 -221.14721 596.69672 5305.0000 -228.06976 -221.05848 7.01129 2.38898 -220.11748 636.60317 5310.0000 -228.32423 -220.48579 7.83845 2.35645 -220.77549 625.55738 5315.0000 -228.02491 -220.21965 7.80525 2.35206 -220.86439 621.56594 5320.0000 -227.66613 -219.57783 8.08830 2.40468 -219.79984 660.24571 5325.0000 -228.44868 -221.68026 6.76842 2.33593 -221.19071 607.18762 5330.0000 -228.64958 -221.79698 6.85259 2.29309 -222.05736 598.53545 5335.0000 -228.62884 -221.13832 7.49052 2.30027 -221.91217 600.69388 5340.0000 -227.82535 -221.76070 6.06466 2.30325 -221.85191 589.48760 5345.0000 -227.00529 -220.23592 6.76938 2.36643 -220.57372 633.86757 5350.0000 -228.58492 -221.63631 6.94861 2.36771 -220.54764 645.48292 5355.0000 -229.25525 -221.66344 7.59182 2.31476 -221.61904 592.75518 5360.0000 -228.47066 -221.03686 7.43380 2.33292 -221.25153 606.05109 5365.0000 -229.08812 -222.08297 7.00515 2.33259 -221.25819 612.77332 5370.0000 -228.76005 -222.23502 6.52503 2.28947 -222.13071 571.84922 5375.0000 -228.76455 -222.01527 6.74928 2.29753 -221.96764 581.55748 5380.0000 -229.09547 -223.22199 5.87348 2.27581 -222.40706 550.23013 5385.0000 -227.17560 -220.68047 6.49512 2.32909 -221.32903 604.64637 5390.0000 -229.49258 -222.23619 7.25639 2.32186 -221.47530 616.79997 5395.0000 -228.42696 -221.35872 7.06825 2.30989 -221.71742 602.46833 5400.0000 -226.48537 -219.46228 7.02309 2.36007 -220.70233 648.87582 5405.0000 -228.91759 -221.15942 7.75817 2.37321 -220.43641 637.44016 5410.0000 -228.46696 -221.05612 7.41084 2.30143 -221.88875 602.61943 5415.0000 -228.98215 -221.70220 7.27995 2.34550 -220.99706 628.23367 5420.0000 -228.72182 -221.26538 7.45643 2.32614 -221.38867 625.58569 5425.0000 -227.59867 -219.61045 7.98822 2.36159 -220.67155 634.95672 5430.0000 -228.20980 -221.23871 6.97109 2.38965 -220.10392 667.46949 5435.0000 -229.07663 -221.89405 7.18258 2.31507 -221.61268 587.73533 5440.0000 -226.26590 -219.56074 6.70516 2.34909 -220.92444 637.16522 5445.0000 -226.84688 -220.19536 6.65151 2.38074 -220.28416 634.15324 5450.0000 -228.93513 -220.99892 7.93622 2.36674 -220.56745 647.01786 5455.0000 -228.84111 -222.02041 6.82070 2.31793 -221.55486 597.48205 5460.0000 -229.66460 -223.17929 6.48531 2.28209 -222.27995 575.02800 5465.0000 -229.53084 -222.94344 6.58740 2.26157 -222.69518 566.33463 5470.0000 -229.08155 -222.64355 6.43800 2.25359 -222.85661 567.53658 5475.0000 -229.31376 -222.55262 6.76113 2.30053 -221.90688 595.30590 5480.0000 -228.10412 -220.13292 7.97120 2.34059 -221.09644 601.21565 5485.0000 -228.07618 -220.92438 7.15180 2.36191 -220.66510 627.83415 5490.0000 -228.67892 -221.68628 6.99264 2.35133 -220.87906 623.51422 5495.0000 -228.77674 -221.64169 7.13505 2.31648 -221.58414 611.28916 5500.0000 -228.22066 -222.76442 5.45624 2.24389 -223.05279 590.46940 FREEZING PROCESS: loop number 23 T-loop= 594.00000000000000 main_MD> interactions number 23 at Temperature= 594.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -0.96191 0.46097 -2.35733 force_rgl> df(natom) -0.71151 -4.88167 1.23568 5505.0000 -228.67798 -222.08800 6.58998 2.30394 -221.83796 615.14935 5510.0000 -228.57550 -221.73835 6.83716 2.26085 -222.70963 580.98538 5515.0000 -229.14392 -222.06718 7.07674 2.32634 -221.38461 640.45320 5520.0000 -229.10223 -222.20844 6.89379 2.25764 -222.77460 565.27570 5525.0000 -228.76217 -221.82255 6.93962 2.28207 -222.28043 591.18654 5530.0000 -228.73948 -221.09927 7.64021 2.35753 -220.75362 638.62642 5535.0000 -228.99767 -221.08262 7.91505 2.35714 -220.76152 651.46601 5540.0000 -227.50210 -219.74324 7.75886 2.36381 -220.62664 637.73296 5545.0000 -229.49089 -222.01804 7.47285 2.32170 -221.47862 578.71885 5550.0000 -227.35322 -220.31797 7.03525 2.35253 -220.85477 608.08574 5555.0000 -229.03187 -221.78785 7.24401 2.34658 -220.97530 618.12638 5560.0000 -228.92396 -221.83314 7.09083 2.28255 -222.27070 570.63158 5565.0000 -228.58422 -222.02832 6.55590 2.27921 -222.33822 571.29160 5570.0000 -227.17854 -220.30619 6.87235 2.33378 -221.23419 609.27998 5575.0000 -228.20139 -220.73089 7.47050 2.37292 -220.44223 637.96419 5580.0000 -229.68387 -221.80993 7.87394 2.32907 -221.32948 628.04239 5585.0000 -229.48247 -222.90994 6.57253 2.28992 -222.12158 612.82808 5590.0000 -229.97636 -221.85980 8.11656 2.26952 -222.53419 595.79645 5595.0000 -229.00762 -221.73611 7.27151 2.30793 -221.75717 608.62261 5600.0000 -229.08076 -222.92485 6.15591 2.27297 -222.46449 580.41975 5605.0000 -229.63346 -223.19868 6.43478 2.23587 -223.21504 560.90450 5610.0000 -229.83521 -222.60282 7.23239 2.23760 -223.17998 574.95246 5615.0000 -227.76368 -222.64718 5.11650 2.25340 -222.86049 553.75406 5620.0000 -228.14370 -220.82805 7.31565 2.29630 -221.99252 562.03099 5625.0000 -229.49663 -222.39892 7.09770 2.32390 -221.43409 605.70929 5630.0000 -228.61754 -221.04761 7.56994 2.33086 -221.29335 604.12303 5635.0000 -228.53085 -221.63861 6.89224 2.33033 -221.30403 610.32883 5640.0000 -228.95879 -222.15604 6.80275 2.29676 -221.98320 608.95741 5645.0000 -228.88680 -220.94662 7.94018 2.32228 -221.46676 614.59008 5650.0000 -229.09356 -221.83499 7.25856 2.29368 -222.04554 591.74321 5655.0000 -229.63414 -223.36609 6.26805 2.26414 -222.64309 573.94903 5660.0000 -229.40346 -222.14794 7.25552 2.25392 -222.84981 562.58943 5665.0000 -229.13265 -222.08989 7.04276 2.29603 -221.99795 596.22474 5670.0000 -229.27703 -222.52418 6.75285 2.26306 -222.66493 569.26261 5675.0000 -228.51836 -221.91826 6.60010 2.26722 -222.58073 570.02756 5680.0000 -230.04409 -222.29067 7.75343 2.28186 -222.28466 605.17292 5685.0000 -230.27083 -223.76628 6.50455 2.25862 -222.75471 587.53879 5690.0000 -230.41102 -223.22974 7.18127 2.24745 -222.98077 581.35844 5695.0000 -231.13420 -223.41156 7.72264 2.23735 -223.18515 574.00651 5700.0000 -230.71628 -224.56398 6.15230 2.22298 -223.47574 566.74453 5705.0000 -230.12352 -223.82532 6.29819 2.17321 -224.48270 507.50663 5710.0000 -229.54349 -223.36543 6.17806 2.22086 -223.51864 540.66635 5715.0000 -228.01031 -221.34590 6.66442 2.30339 -221.84895 574.01568 5720.0000 -230.12405 -222.12826 7.99579 2.31393 -221.63578 609.24903 5725.0000 -228.40154 -221.18368 7.21786 2.32875 -221.33603 610.71046 5730.0000 -228.87011 -222.51482 6.35528 2.28987 -222.12250 574.36683 5735.0000 -228.31579 -220.87180 7.44399 2.28712 -222.17813 586.59183 5740.0000 -229.52082 -222.71372 6.80710 2.32313 -221.44975 596.95492 5745.0000 -228.05090 -221.61786 6.43305 2.28878 -222.14466 575.74989 5750.0000 -229.10058 -221.55171 7.54887 2.29552 -222.00826 582.24870 FREEZING PROCESS: loop number 24 T-loop= 569.00000000000000 main_MD> interactions number 24 at Temperature= 569.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -0.18203 -0.62503 0.27963 force_rgl> df(natom) -0.28114 0.25221 -1.46535 5755.0000 -229.43051 -222.77617 6.65435 2.26457 -222.63431 570.19358 5760.0000 -228.36694 -222.18616 6.18079 2.26566 -222.61231 568.22153 5765.0000 -228.77481 -221.52677 7.24804 2.29905 -221.93685 605.39865 5770.0000 -229.54420 -222.73204 6.81216 2.28983 -222.12343 584.49229 5775.0000 -230.18885 -224.23294 5.95590 2.21450 -223.64734 551.57304 5780.0000 -228.87811 -222.13410 6.74401 2.26038 -222.71919 568.22097 5785.0000 -229.64576 -222.99637 6.64939 2.23742 -223.18370 553.65582 5790.0000 -229.48496 -222.72084 6.76412 2.25243 -222.87996 576.45054 5795.0000 -231.12919 -224.55816 6.57103 2.19510 -224.03985 530.42657 5800.0000 -229.97335 -224.49554 5.47781 2.18833 -224.17690 520.15851 5805.0000 -230.39171 -223.69603 6.69569 2.19165 -224.10963 540.64576 5810.0000 -231.22899 -225.09442 6.13458 2.17336 -224.47970 546.84000 5815.0000 -229.92426 -223.35264 6.57163 2.16971 -224.55366 528.61380 5820.0000 -229.28480 -222.93073 6.35406 2.25456 -222.83702 556.46911 5825.0000 -228.70346 -222.30136 6.40211 2.28019 -222.31837 580.28869 5830.0000 -228.90427 -222.22071 6.68356 2.27286 -222.46663 549.45115 5835.0000 -229.76679 -223.98421 5.78258 2.25107 -222.90759 554.79631 5840.0000 -230.25883 -223.43830 6.82054 2.20890 -223.76078 522.96366 5845.0000 -228.73615 -222.70194 6.03421 2.25760 -222.77539 547.96833 5850.0000 -229.40620 -222.62358 6.78262 2.26473 -222.63126 570.85767 5855.0000 -229.69128 -221.99922 7.69206 2.26373 -222.65149 569.89569 5860.0000 -228.94576 -222.05171 6.89405 2.29265 -222.06623 601.06599 5865.0000 -230.43655 -224.04337 6.39317 2.21569 -223.62334 533.28875 5870.0000 -228.98387 -222.48628 6.49759 2.25000 -222.92913 556.38212 5875.0000 -229.31315 -223.13683 6.17632 2.21712 -223.59446 529.84524 5880.0000 -229.24818 -221.84736 7.40082 2.24702 -222.98947 553.13595 5885.0000 -229.13672 -223.01585 6.12088 2.31747 -221.56425 590.88697 5890.0000 -230.04964 -223.69174 6.35791 2.25171 -222.89454 556.60828 5895.0000 -230.33234 -223.36826 6.96408 2.22447 -223.44559 557.36308 5900.0000 -229.06265 -222.22740 6.83525 2.26549 -222.61578 593.51669 5905.0000 -229.66133 -222.72442 6.93691 2.26657 -222.59393 557.86358 5910.0000 -229.33451 -222.24372 7.09079 2.25159 -222.89706 557.81305 5915.0000 -229.87658 -222.76320 7.11338 2.26352 -222.65556 574.17513 5920.0000 -228.99439 -223.11551 5.87889 2.24986 -222.93201 546.71003 5925.0000 -228.39393 -222.00717 6.38676 2.27861 -222.35029 570.95631 5930.0000 -229.03722 -222.10213 6.93510 2.26597 -222.60615 548.02321 5935.0000 -229.85624 -222.72734 7.12890 2.27159 -222.49237 575.07789 5940.0000 -230.00367 -222.74519 7.25848 2.27406 -222.44246 595.90123 5945.0000 -230.21420 -223.13911 7.07509 2.25328 -222.86278 574.22277 5950.0000 -230.45388 -223.60386 6.85002 2.24741 -222.98160 593.05124 5955.0000 -229.39568 -222.90258 6.49310 2.22733 -223.38789 586.42311 5960.0000 -228.50125 -222.45035 6.05091 2.27156 -222.49305 589.28742 5965.0000 -230.10123 -222.66658 7.43465 2.27770 -222.36878 592.19132 5970.0000 -230.02243 -224.63129 5.39114 2.21708 -223.59522 571.59235 5975.0000 -230.39096 -223.47619 6.91477 2.20601 -223.81926 546.78055 5980.0000 -230.56858 -223.74979 6.81879 2.20349 -223.87014 550.09270 5985.0000 -231.90603 -224.99142 6.91461 2.19193 -224.10401 555.91075 5990.0000 -230.47909 -224.02267 6.45642 2.18487 -224.24695 551.12007 5995.0000 -232.25685 -225.10127 7.15558 2.17699 -224.40625 559.43222 6000.0000 -230.14448 -223.11824 7.02624 2.18574 -224.22924 555.26937 FREEZING PROCESS: loop number 25 T-loop= 544.00000000000000 main_MD> interactions number 25 at Temperature= 544.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 3.62575 2.33626 2.19054 force_rgl> df(natom) -3.51071 -11.71876 1.07167 6005.0000 -230.91148 -224.80194 6.10954 2.16979 -224.55202 546.19488 6010.0000 -229.59439 -222.98549 6.60890 2.22116 -223.51259 564.91857 6015.0000 -229.89543 -223.77757 6.11786 2.22262 -223.48308 559.02144 6020.0000 -231.13737 -225.11617 6.02120 2.18001 -224.34524 531.84344 6025.0000 -230.89669 -225.18721 5.70948 2.13856 -225.18376 521.60924 6030.0000 -231.19327 -224.16642 7.02686 2.14519 -225.04974 523.74665 6035.0000 -230.94412 -225.12001 5.82412 2.17856 -224.37449 556.80842 6040.0000 -232.13692 -226.08530 6.05162 2.10248 -225.91368 504.72904 6045.0000 -230.83202 -223.77044 7.06158 2.15673 -224.81618 549.60104 6050.0000 -230.15207 -224.22000 5.93207 2.20974 -223.74379 555.99969 6055.0000 -230.50463 -224.11154 6.39309 2.21714 -223.59398 553.31876 6060.0000 -230.73661 -224.73140 6.00521 2.21146 -223.70895 538.00278 6065.0000 -230.12545 -223.69870 6.42675 2.21178 -223.70233 526.39132 6070.0000 -229.20661 -223.37667 5.82994 2.20137 -223.91298 514.93155 6075.0000 -228.96852 -221.90061 7.06792 2.24778 -222.97401 564.21970 6080.0000 -230.09300 -223.59404 6.49895 2.24063 -223.11884 567.56919 6085.0000 -230.23025 -223.18848 7.04177 2.22961 -223.34162 563.71693 6090.0000 -228.35495 -221.51629 6.83865 2.28369 -222.24767 591.87268 6095.0000 -229.71456 -223.10631 6.60825 2.32231 -221.46629 602.07159 6100.0000 -228.22808 -222.26318 5.96490 2.26193 -222.68775 556.88675 6105.0000 -230.53523 -223.48393 7.05130 2.23159 -223.30173 544.57667 6110.0000 -232.51893 -225.20286 7.31607 2.18848 -224.17384 534.44140 6115.0000 -231.50937 -224.47444 7.03493 2.17954 -224.35474 558.53299 6120.0000 -231.78043 -225.10207 6.67836 2.15720 -224.80665 529.05848 6125.0000 -230.57442 -225.29521 5.27921 2.12643 -225.42914 519.47491 6130.0000 -230.11753 -224.26835 5.84918 2.18527 -224.23874 540.89671 6135.0000 -230.83383 -223.42919 7.40464 2.21563 -223.62463 563.32205 6140.0000 -231.91615 -225.93085 5.98530 2.18840 -224.17550 568.23677 6145.0000 -231.18888 -225.23970 5.94918 2.10365 -225.88998 513.20815 6150.0000 -231.35775 -225.04268 6.31507 2.14595 -225.03433 534.09885 6155.0000 -231.05540 -224.00193 7.05347 2.17178 -224.51172 563.74969 6160.0000 -230.75130 -225.25961 5.49169 2.16308 -224.68776 546.07984 6165.0000 -232.29330 -226.33890 5.95440 2.11383 -225.68418 501.82611 6170.0000 -231.47668 -225.57293 5.90374 2.11275 -225.70601 505.81279 6175.0000 -230.97628 -224.73632 6.23996 2.12731 -225.41136 513.23402 6180.0000 -230.90999 -224.47756 6.43243 2.15565 -224.83800 525.32833 6185.0000 -231.83159 -225.03488 6.79671 2.13971 -225.16050 497.62949 6190.0000 -230.08656 -225.18462 4.90194 2.14455 -225.06265 502.63181 6195.0000 -230.43855 -224.39207 6.04648 2.15711 -224.80853 512.84650 6200.0000 -230.03569 -223.15670 6.87899 2.21334 -223.67082 555.99503 6205.0000 -229.87535 -223.45303 6.42232 2.20826 -223.77365 567.44311 6210.0000 -229.73932 -223.80872 5.93060 2.21388 -223.65988 566.86995 6215.0000 -229.87555 -223.80106 6.07448 2.21218 -223.69427 546.76778 6220.0000 -229.85776 -223.17811 6.67965 2.25370 -222.85426 556.90613 6225.0000 -230.25957 -222.73204 7.52753 2.25740 -222.77942 580.20900 6230.0000 -231.24942 -223.78072 7.46870 2.24939 -222.94144 588.39540 6235.0000 -230.36250 -223.85228 6.51022 2.22887 -223.35662 569.27895 6240.0000 -230.14753 -223.74586 6.40167 2.19290 -224.08431 544.60007 6245.0000 -231.64849 -224.00166 7.64682 2.21390 -223.65960 572.85438 6250.0000 -230.89895 -224.85240 6.04655 2.15969 -224.75621 520.53964 FREEZING PROCESS: loop number 26 T-loop= 519.00000000000000 main_MD> interactions number 26 at Temperature= 519.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -0.04257 -2.45947 -1.60500 force_rgl> df(natom) 0.01696 1.02120 0.80042 6255.0000 -230.84813 -224.64789 6.20024 2.16529 -224.64296 520.46095 6260.0000 -230.77247 -224.37594 6.39653 2.16416 -224.66593 505.79827 6265.0000 -229.59163 -223.34161 6.25002 2.19209 -224.10085 537.04073 6270.0000 -230.26245 -224.31032 5.95213 2.20460 -223.84761 562.19139 6275.0000 -230.93150 -225.12976 5.80174 2.19239 -224.09464 538.92957 6280.0000 -231.03314 -225.24786 5.78527 2.12145 -225.52990 498.09379 6285.0000 -231.30973 -225.38582 5.92391 2.15179 -224.91615 539.37692 6290.0000 -231.15701 -225.43594 5.72107 2.12463 -225.46552 524.11685 6295.0000 -231.74537 -226.64333 5.10205 2.09437 -226.07785 496.92154 6300.0000 -231.94097 -225.94232 5.99865 2.11185 -225.72407 498.79241 6305.0000 -230.90268 -224.71735 6.18533 2.15541 -224.84290 539.29355 6310.0000 -231.75576 -225.20564 6.55012 2.14356 -225.08259 526.98063 6315.0000 -231.00324 -224.78135 6.22189 2.14809 -224.99091 518.64847 6320.0000 -231.36873 -225.46857 5.90016 2.15793 -224.79179 523.03481 6325.0000 -230.44905 -225.19165 5.25740 2.10143 -225.93495 478.32148 6330.0000 -231.63305 -225.57613 6.05692 2.13681 -225.21928 531.93277 6335.0000 -230.92451 -223.93116 6.99336 2.13400 -225.27613 538.69820 6340.0000 -231.62572 -225.18646 6.43926 2.17373 -224.47232 561.93646 6345.0000 -231.70744 -225.52336 6.18408 2.10954 -225.77094 523.72186 6350.0000 -231.82713 -226.10639 5.72074 2.08379 -226.29181 495.36727 6355.0000 -231.08267 -226.65521 4.42746 2.08218 -226.32442 491.51163 6360.0000 -231.60709 -225.29756 6.30953 2.11770 -225.60588 523.49343 6365.0000 -230.84821 -223.65661 7.19159 2.16270 -224.69536 546.35967 6370.0000 -231.51807 -224.88454 6.63353 2.19689 -224.00363 562.71863 6375.0000 -231.36881 -224.32387 7.04494 2.13708 -225.21373 528.62624 6380.0000 -230.53355 -224.12581 6.40775 2.17513 -224.44398 546.74260 6385.0000 -231.01545 -225.06974 5.94572 2.18836 -224.17629 538.74598 6390.0000 -230.03282 -224.87220 5.16061 2.17461 -224.45452 518.14807 6395.0000 -231.25122 -225.99606 5.25516 2.16228 -224.70386 521.77219 6400.0000 -231.32856 -226.34959 4.97897 2.09671 -226.03037 477.04910 6405.0000 -231.13247 -225.04072 6.09175 2.15016 -224.94900 524.49199 6410.0000 -232.53059 -225.76601 6.76458 2.10245 -225.91423 512.26797 6415.0000 -231.91232 -226.20180 5.71052 2.08786 -226.20942 495.85863 6420.0000 -231.61948 -225.84431 5.77517 2.10255 -225.91229 507.12112 6425.0000 -232.07924 -226.27362 5.80562 2.10435 -225.87595 513.80898 6430.0000 -231.46216 -225.04856 6.41360 2.12184 -225.52209 523.45295 6435.0000 -232.30415 -225.97638 6.32777 2.13888 -225.17737 536.77774 6440.0000 -232.53921 -227.01849 5.52072 2.04746 -227.02680 475.79247 6445.0000 -231.28616 -225.05991 6.22626 2.12425 -225.47326 519.94051 6450.0000 -232.53964 -226.87492 5.66472 2.07297 -226.51078 482.27140 6455.0000 -232.54473 -226.43133 6.11339 2.08367 -226.29418 494.60982 6460.0000 -232.63267 -225.90012 6.73255 2.11300 -225.70080 515.98250 6465.0000 -231.89512 -226.48896 5.40616 2.06537 -226.66445 475.49718 6470.0000 -231.59639 -225.77788 5.81851 2.10569 -225.84882 498.43832 6475.0000 -230.73165 -224.17757 6.55407 2.17205 -224.50628 526.01691 6480.0000 -232.64079 -225.71391 6.92688 2.15339 -224.88372 512.13629 6485.0000 -231.39685 -225.11382 6.28302 2.14245 -225.10502 505.24014 6490.0000 -231.02354 -225.86632 5.15722 2.14019 -225.15071 516.68610 6495.0000 -231.27623 -225.48837 5.78786 2.11871 -225.58534 493.68059 6500.0000 -230.55142 -223.61534 6.93608 2.15574 -224.83624 522.08819 FREEZING PROCESS: loop number 27 T-loop= 494.00000000000000 main_MD> interactions number 27 at Temperature= 494.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 1.36526 -2.45667 -4.01650 force_rgl> df(natom) -2.56936 0.58941 1.54632 6505.0000 -231.78245 -225.79220 5.99026 2.15184 -224.91508 524.22124 6510.0000 -231.44961 -225.17240 6.27721 2.10254 -225.91254 491.50400 6515.0000 -231.68784 -225.33831 6.34953 2.14521 -225.04919 529.91351 6520.0000 -232.63538 -226.48852 6.14686 2.10568 -225.84894 505.96081 6525.0000 -232.36148 -227.03524 5.32624 2.07068 -226.55710 481.51084 6530.0000 -231.08747 -224.22463 6.86285 2.09375 -226.09026 486.06292 6535.0000 -231.99457 -226.01859 5.97598 2.14301 -225.09367 544.25272 6540.0000 -232.63282 -227.07033 5.56249 2.08981 -226.17006 509.12148 6545.0000 -232.09063 -226.63496 5.45567 2.05728 -226.82814 480.21406 6550.0000 -232.58867 -227.54950 5.03917 2.05952 -226.78279 493.75105 6555.0000 -232.84719 -227.37579 5.47140 2.02765 -227.42773 468.11032 6560.0000 -233.13216 -227.95525 5.17692 2.02809 -227.41874 476.01845 6565.0000 -232.02516 -227.15752 4.86764 2.04157 -227.14606 473.91868 6570.0000 -231.85637 -226.17248 5.68389 2.05144 -226.94634 472.09744 6575.0000 -231.29362 -225.50848 5.78513 2.10420 -225.87887 512.48008 6580.0000 -232.52600 -226.58345 5.94255 2.07128 -226.54487 470.92250 6585.0000 -232.51589 -227.50219 5.01370 2.03253 -227.32891 461.65305 6590.0000 -233.14345 -227.94439 5.19906 2.03891 -227.19977 464.56485 6595.0000 -232.70663 -227.38318 5.32345 2.01564 -227.67062 453.90349 6600.0000 -232.71940 -227.46640 5.25299 2.06090 -226.75502 489.60739 6605.0000 -232.55270 -227.28365 5.26904 2.03995 -227.17881 481.00409 6610.0000 -232.30653 -226.16664 6.13990 2.04821 -227.01160 474.26476 6615.0000 -232.38375 -226.32394 6.05981 2.07948 -226.37901 488.51542 6620.0000 -231.75343 -226.29669 5.45674 2.08988 -226.16864 505.20861 6625.0000 -231.12750 -224.66595 6.46155 2.12588 -225.44024 537.61164 6630.0000 -230.87576 -225.55977 5.31599 2.16608 -224.62708 534.75532 6635.0000 -230.08463 -224.17836 5.90627 2.17350 -224.47687 539.64545 6640.0000 -231.63893 -224.96891 6.67002 2.14520 -225.04949 511.70520 6645.0000 -231.57247 -225.64970 5.92277 2.12274 -225.50377 499.50618 6650.0000 -230.98680 -225.60784 5.37896 2.10353 -225.89250 493.35653 6655.0000 -230.88827 -224.67555 6.21272 2.14659 -225.02136 524.21653 6660.0000 -230.90219 -224.74660 6.15559 2.16383 -224.67247 516.53483 6665.0000 -230.97791 -224.91385 6.06406 2.17048 -224.53791 503.02080 6670.0000 -230.79214 -225.21866 5.57348 2.14121 -225.13024 481.62020 6675.0000 -231.36425 -225.39782 5.96643 2.13840 -225.18695 501.51553 6680.0000 -231.89681 -225.86337 6.03344 2.10267 -225.90986 486.50418 6685.0000 -231.50619 -225.62890 5.87728 2.11911 -225.57730 508.28182 6690.0000 -231.92591 -226.27108 5.65483 2.07613 -226.44686 486.99939 6695.0000 -231.46916 -226.16515 5.30401 2.09041 -226.15788 495.64329 6700.0000 -231.19167 -225.26396 5.92771 2.12256 -225.50748 500.95532 6705.0000 -231.13655 -224.96293 6.17362 2.15072 -224.93777 506.62990 6710.0000 -231.63972 -225.65105 5.98867 2.15684 -224.81385 522.46445 6715.0000 -232.18977 -226.90093 5.28884 2.09060 -226.15404 480.23104 6720.0000 -231.21497 -225.31654 5.89843 2.09982 -225.96749 470.62241 6725.0000 -231.14366 -225.54662 5.59704 2.10708 -225.82057 471.02051 6730.0000 -231.12904 -224.20599 6.92305 2.15808 -224.78880 521.23612 6735.0000 -230.89664 -225.00952 5.88712 2.15911 -224.76807 530.17508 6740.0000 -231.44353 -225.15059 6.29294 2.12293 -225.50000 523.20921 6745.0000 -231.35678 -224.99791 6.35887 2.13166 -225.32340 534.28819 6750.0000 -231.59244 -225.66489 5.92755 2.14035 -225.14758 513.71310 FREEZING PROCESS: loop number 28 T-loop= 469.00000000000000 main_MD> interactions number 28 at Temperature= 469.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -1.43175 -0.91540 -0.94852 force_rgl> df(natom) -0.28111 -0.19465 0.63134 6755.0000 -232.46628 -226.76878 5.69750 2.09696 -226.02546 500.75416 6760.0000 -231.62328 -226.14409 5.47919 2.05393 -226.89594 470.75945 6765.0000 -232.39312 -226.40377 5.98935 2.05864 -226.80070 481.90134 6770.0000 -232.08977 -226.69150 5.39827 2.05624 -226.84924 470.19014 6775.0000 -232.30920 -226.36459 5.94461 2.05378 -226.89899 455.62746 6780.0000 -231.96018 -226.77386 5.18632 2.07836 -226.40177 507.35063 6785.0000 -232.59833 -227.16316 5.43517 2.05225 -226.92993 488.88098 6790.0000 -233.38720 -227.39000 5.99720 2.03587 -227.26125 480.75442 6795.0000 -232.39863 -226.78272 5.61590 2.02174 -227.54712 466.81319 6800.0000 -233.26790 -227.42100 5.84690 2.04996 -226.97629 489.21013 6805.0000 -232.77345 -226.55170 6.22175 2.04456 -227.08543 475.42499 6810.0000 -232.24740 -227.03546 5.21194 2.04429 -227.09094 476.79726 6815.0000 -232.50838 -227.22289 5.28548 2.06015 -226.77018 486.80938 6820.0000 -231.96237 -227.67944 4.28293 2.04663 -227.04373 477.46697 6825.0000 -233.14952 -227.35579 5.79374 2.02423 -227.49683 455.76963 6830.0000 -233.11476 -227.88057 5.23419 2.01200 -227.74427 450.22369 6835.0000 -233.38434 -227.39756 5.98678 2.02948 -227.39054 468.27994 6840.0000 -233.90251 -229.02061 4.88190 2.00514 -227.88309 448.06992 6845.0000 -232.75559 -227.14901 5.60658 1.96882 -228.61795 419.32347 6850.0000 -233.07852 -228.12544 4.95308 2.04390 -227.09890 483.15322 6855.0000 -233.40312 -228.51235 4.89078 1.98063 -228.37896 431.93138 6860.0000 -233.81653 -228.26516 5.55138 1.98351 -228.32065 427.55812 6865.0000 -233.46486 -227.64249 5.82237 2.01910 -227.60059 450.77333 6870.0000 -233.28472 -228.54006 4.74466 1.99009 -228.18761 438.57147 6875.0000 -232.07983 -227.27781 4.80201 2.01122 -227.76004 455.09811 6880.0000 -233.97859 -227.90329 6.07529 2.04147 -227.14808 464.89435 6885.0000 -233.11311 -227.55921 5.55389 2.01766 -227.62973 454.84222 6890.0000 -232.42721 -227.18855 5.23866 2.04399 -227.09703 480.37624 6895.0000 -232.96437 -227.64869 5.31568 2.04551 -227.06622 479.52825 6900.0000 -233.10184 -227.97157 5.13027 2.01905 -227.60158 456.61129 6905.0000 -233.31478 -227.47116 5.84362 2.01695 -227.64406 457.29651 6910.0000 -232.86062 -226.60054 6.26009 2.05357 -226.90332 489.87575 6915.0000 -232.67094 -226.96016 5.71079 2.05470 -226.88042 489.79185 6920.0000 -232.41149 -226.69065 5.72085 2.07971 -226.37440 507.27641 6925.0000 -232.67017 -226.04850 6.62167 2.10312 -225.90075 524.68393 6930.0000 -233.14385 -227.27525 5.86860 2.07088 -226.55312 495.33529 6935.0000 -230.42733 -225.35094 5.07639 2.06814 -226.60854 482.03157 6940.0000 -231.84522 -227.33390 4.51132 2.10607 -225.84109 495.22712 6945.0000 -233.39930 -228.32995 5.06936 2.01218 -227.74063 437.97154 6950.0000 -232.44234 -227.96080 4.48154 1.96634 -228.66799 420.00205 6955.0000 -232.61109 -227.75371 4.85738 1.99334 -228.12186 439.86883 6960.0000 -232.88082 -227.54061 5.34021 2.02717 -227.43738 468.15754 6965.0000 -233.06839 -227.75444 5.31395 2.01871 -227.60858 465.23826 6970.0000 -233.14664 -227.57633 5.57030 2.00771 -227.83116 451.02834 6975.0000 -232.89804 -227.65355 5.24449 2.01678 -227.64760 468.04987 6980.0000 -232.59131 -227.73989 4.85142 2.03522 -227.27442 467.27167 6985.0000 -233.47795 -228.88370 4.59425 2.01770 -227.62894 458.14912 6990.0000 -233.90080 -229.18898 4.71182 1.95210 -228.95618 413.38333 6995.0000 -233.04671 -228.06926 4.97745 1.96537 -228.68771 422.30505 7000.0000 -233.42178 -228.12299 5.29879 1.99888 -228.00968 447.15503 FREEZING PROCESS: loop number 29 T-loop= 444.00000000000000 main_MD> interactions number 29 at Temperature= 444.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -0.38914 1.36356 -0.51049 force_rgl> df(natom) 1.59962 -4.47738 -3.56260 7005.0000 -233.71504 -228.13950 5.57554 1.97685 -228.45550 435.81590 7010.0000 -233.27851 -227.84405 5.43446 2.00357 -227.91473 449.69237 7015.0000 -233.00454 -227.73393 5.27061 2.00396 -227.90683 448.52029 7020.0000 -234.08748 -228.02901 6.05846 2.00562 -227.87337 454.44367 7025.0000 -233.14482 -228.18815 4.95668 2.01454 -227.69281 460.48663 7030.0000 -233.31143 -228.94518 4.36625 1.94364 -229.12735 406.47816 7035.0000 -233.12626 -227.97971 5.14655 1.97158 -228.56199 423.93187 7040.0000 -233.21898 -227.84887 5.37011 1.99200 -228.14897 441.98987 7045.0000 -233.07159 -227.54389 5.52770 2.00563 -227.87308 447.26135 7050.0000 -232.41364 -226.54869 5.86495 2.04654 -227.04542 467.78412 7055.0000 -233.13322 -227.36764 5.76558 2.02038 -227.57467 458.14253 7060.0000 -233.23346 -228.28021 4.95324 2.00230 -227.94050 449.52972 7065.0000 -233.60238 -227.91564 5.68674 1.98833 -228.22310 440.08821 7070.0000 -232.35220 -227.04833 5.30387 1.99776 -228.03241 444.49766 7075.0000 -233.34959 -227.59197 5.75762 2.01466 -227.69054 459.92619 7080.0000 -233.22819 -227.76076 5.46743 2.01599 -227.66350 460.06581 7085.0000 -232.61602 -227.92139 4.69463 2.01556 -227.67222 457.46460 7090.0000 -233.93779 -228.93909 4.99870 1.99025 -228.18428 437.89137 7095.0000 -232.33083 -226.94578 5.38504 1.99469 -228.09452 439.13985 7100.0000 -232.62590 -227.60813 5.01777 2.04489 -227.07880 464.99075 7105.0000 -233.90255 -229.34627 4.55628 1.96514 -228.69224 411.66280 7110.0000 -233.09116 -228.67627 4.41489 1.95545 -228.88832 411.60301 7115.0000 -233.41543 -227.68711 5.72832 1.97257 -228.54190 431.75245 7120.0000 -232.67116 -227.49110 5.18005 2.02124 -227.55736 465.55480 7125.0000 -233.67938 -228.67517 5.00420 1.99500 -228.08830 444.75886 7130.0000 -233.11865 -227.83861 5.28004 1.99270 -228.13468 442.66091 7135.0000 -234.56513 -229.12729 5.43785 1.95820 -228.83276 416.67866 7140.0000 -233.98044 -228.97643 5.00401 1.94999 -228.99879 407.93196 7145.0000 -233.52984 -228.47466 5.05517 1.95754 -228.84604 417.01811 7150.0000 -232.48866 -227.84843 4.64023 2.00260 -227.93439 448.23544 7155.0000 -232.94903 -227.07638 5.87264 2.03858 -227.20652 470.93271 7160.0000 -233.20966 -227.86975 5.33990 2.03290 -227.32134 471.91983 7165.0000 -232.47622 -227.41796 5.05827 2.01271 -227.72995 455.39386 7170.0000 -232.40389 -227.23426 5.16963 2.03336 -227.31217 462.41676 7175.0000 -233.02681 -228.61722 4.40958 1.98308 -228.32932 421.35236 7180.0000 -233.40094 -227.64911 5.75183 2.02847 -227.41115 461.41531 7185.0000 -233.26522 -227.51416 5.75105 2.02964 -227.38743 470.78398 7190.0000 -232.96109 -228.06681 4.89428 2.01475 -227.68857 458.17480 7195.0000 -233.22141 -227.49903 5.72238 2.00926 -227.79969 461.13376 7200.0000 -233.69016 -228.64179 5.04836 1.99007 -228.18796 442.15503 7205.0000 -233.70780 -228.30052 5.40728 1.96699 -228.65481 431.99092 7210.0000 -233.72447 -228.80151 4.92296 1.98318 -228.32744 438.51219 7215.0000 -233.26932 -228.17763 5.09168 1.96330 -228.72963 422.42947 7220.0000 -233.66565 -227.96030 5.70535 1.99819 -228.02365 443.42869 7225.0000 -233.30346 -227.52157 5.78189 2.00289 -227.92867 443.52471 7230.0000 -232.87738 -227.43200 5.44538 2.00860 -227.81315 455.92139 7235.0000 -232.74922 -227.24042 5.50880 2.03872 -227.20364 473.84128 7240.0000 -234.18514 -229.01060 5.17454 1.98563 -228.27774 440.40081 7245.0000 -233.54339 -228.48104 5.06235 1.97101 -228.57362 418.88347 7250.0000 -233.70177 -228.13202 5.56975 1.97409 -228.51123 432.98267 FREEZING PROCESS: loop number 30 T-loop= 419.00000000000000 main_MD> interactions number 30 at Temperature= 419.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -0.66368 -1.13867 0.36756 force_rgl> df(natom) -0.84068 -1.49182 -0.86361 7255.0000 -233.36063 -228.35298 5.00764 2.00530 -227.87985 442.47739 7260.0000 -233.89665 -229.26454 4.63212 1.96299 -228.73574 413.23405 7265.0000 -233.58868 -228.06100 5.52768 1.96579 -228.67919 424.33609 7270.0000 -233.23053 -228.42228 4.80825 2.00037 -227.97961 446.74995 7275.0000 -234.46507 -229.70887 4.75619 1.94101 -229.18049 400.71238 7280.0000 -234.43741 -229.41152 5.02589 1.90791 -229.85023 375.69793 7285.0000 -233.61895 -229.26398 4.35497 1.91524 -229.70177 385.71365 7290.0000 -233.05589 -229.03722 4.01867 1.95650 -228.86710 412.22715 7295.0000 -233.89058 -229.34265 4.54793 1.96007 -228.79480 415.88990 7300.0000 -233.40110 -228.05238 5.34871 1.96669 -228.66090 432.35669 7305.0000 -233.14167 -228.04647 5.09520 2.00573 -227.87119 455.48461 7310.0000 -234.16187 -229.08664 5.07523 1.96662 -228.66238 428.32855 7315.0000 -233.79714 -229.10900 4.68814 1.92477 -229.50904 394.10937 7320.0000 -233.89552 -229.23447 4.66105 1.93000 -229.40321 398.13723 7325.0000 -234.70376 -229.80267 4.90109 1.94022 -229.19649 401.79960 7330.0000 -233.82041 -229.15643 4.66398 1.93589 -229.28400 400.99165 7335.0000 -234.03714 -229.23681 4.80034 1.92508 -229.50280 392.43478 7340.0000 -234.20259 -228.92068 5.28191 1.94930 -229.01282 407.11858 7345.0000 -233.70972 -229.33734 4.37238 1.96168 -228.76234 403.16444 7350.0000 -234.41693 -229.48380 4.93313 1.91740 -229.65807 371.94695 7355.0000 -233.31745 -228.96133 4.35612 1.92478 -229.50880 376.71396 7360.0000 -233.21322 -228.44659 4.76663 1.96693 -228.65620 413.44865 7365.0000 -233.11962 -228.03991 5.07971 1.98730 -228.24389 423.71969 7370.0000 -233.54464 -228.27807 5.26657 2.00038 -227.97927 441.74136 7375.0000 -234.07050 -229.46074 4.60976 1.95661 -228.86496 399.81522 7380.0000 -233.67263 -228.95540 4.71723 1.93495 -229.30315 392.89319 7385.0000 -233.79230 -229.27644 4.51586 1.92930 -229.41739 388.41185 7390.0000 -234.12540 -229.21976 4.90564 1.94123 -229.17611 403.08953 7395.0000 -233.96843 -229.36890 4.59953 1.93977 -229.20553 407.24156 7400.0000 -232.99292 -227.35827 5.63465 1.97728 -228.44670 429.19838 7405.0000 -233.31121 -228.30452 5.00669 2.00099 -227.96700 435.24677 7410.0000 -233.57419 -228.71937 4.85482 1.99365 -228.11543 430.23822 7415.0000 -232.82040 -228.08823 4.73217 1.96498 -228.69555 409.73013 7420.0000 -233.90542 -228.50995 5.39547 1.99831 -228.02118 428.69015 7425.0000 -234.32965 -229.37385 4.95580 1.95152 -228.96783 405.73405 7430.0000 -233.22082 -228.30110 4.91972 1.97204 -228.55276 419.25665 7435.0000 -233.10289 -228.24053 4.86236 1.98803 -228.22912 425.00989 7440.0000 -233.06649 -227.67768 5.38881 2.00742 -227.83691 446.39043 7445.0000 -233.65934 -228.78618 4.87316 1.99418 -228.10481 440.35546 7450.0000 -233.20679 -228.41593 4.79086 1.95419 -228.91385 409.73948 7455.0000 -233.63028 -228.25845 5.37183 2.00036 -227.97980 444.84111 7460.0000 -233.54833 -228.37038 5.17795 1.97946 -228.40258 430.59782 7465.0000 -233.69016 -229.09230 4.59787 1.95297 -228.93852 412.06822 7470.0000 -233.98019 -229.89215 4.08803 1.95138 -228.97061 401.94532 7475.0000 -232.96427 -227.60718 5.35709 1.98257 -228.33967 430.93887 7480.0000 -233.70717 -228.61193 5.09524 2.01868 -227.60913 463.42859 7485.0000 -234.36837 -229.02578 5.34259 1.97104 -228.57290 425.11177 7490.0000 -233.70615 -228.75573 4.95042 1.95252 -228.94769 418.07840 7495.0000 -233.55646 -228.39652 5.15993 1.96392 -228.71705 425.04954 7500.0000 -232.11217 -226.69240 5.41978 2.00528 -227.88024 428.68444 FREEZING PROCESS: loop number 31 T-loop= 394.00000000000000 main_MD> interactions number 31 at Temperature= 394.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 2.72708 -2.13080 -2.56602 force_rgl> df(natom) 3.56360 1.26963 1.14886 7505.0000 -232.77377 -227.34534 5.42843 2.02256 -227.53055 434.84708 7510.0000 -232.83441 -229.15076 3.68364 1.99162 -228.15662 403.40801 7515.0000 -233.08243 -228.66942 4.41301 1.96199 -228.75612 389.04170 7520.0000 -233.73199 -229.29023 4.44176 1.94363 -229.12752 393.69767 7525.0000 -233.97182 -229.20686 4.76496 1.95012 -228.99627 401.92833 7530.0000 -234.31903 -229.16512 5.15391 1.95849 -228.82682 412.55375 7535.0000 -233.17772 -228.53605 4.64167 1.95409 -228.91596 410.46363 7540.0000 -233.84401 -229.29833 4.54567 1.94954 -229.00798 411.51121 7545.0000 -234.38906 -229.66205 4.72701 1.91543 -229.69807 385.26012 7550.0000 -234.30377 -229.39983 4.90393 1.93940 -229.21303 396.47172 7555.0000 -233.61402 -229.14742 4.46659 1.92919 -229.41963 386.82206 7560.0000 -234.12177 -229.32879 4.79298 1.91707 -229.66475 379.30333 7565.0000 -235.04718 -230.06275 4.98443 1.91715 -229.66326 389.54273 7570.0000 -234.30665 -229.61798 4.68867 1.90988 -229.81034 380.89819 7575.0000 -233.58034 -228.81557 4.76476 1.93800 -229.24130 397.48685 7580.0000 -233.98033 -229.63758 4.34275 1.92917 -229.41997 392.97815 7585.0000 -234.16609 -229.24078 4.92531 1.94499 -229.10004 401.20913 7590.0000 -233.79503 -229.23583 4.55921 1.94444 -229.11109 396.54754 7595.0000 -233.04416 -228.50733 4.53683 1.94673 -229.06470 405.49172 7600.0000 -233.57543 -229.43830 4.13714 1.94954 -229.00797 404.68149 7605.0000 -233.57727 -228.92668 4.65058 1.94141 -229.17241 398.21794 7610.0000 -234.29777 -229.22957 5.06820 1.94050 -229.19086 396.75403 7615.0000 -233.20810 -228.72135 4.48675 1.93954 -229.21031 393.55095 7620.0000 -234.60256 -229.10332 5.49925 1.94964 -229.00600 407.54233 7625.0000 -234.35506 -229.97525 4.37982 1.93926 -229.21598 399.71072 7630.0000 -234.14791 -229.72825 4.41966 1.92661 -229.47178 383.01101 7635.0000 -233.53961 -229.11357 4.42604 1.91889 -229.62810 373.69206 7640.0000 -233.83150 -229.37781 4.45370 1.92040 -229.59738 380.29439 7645.0000 -234.08082 -229.24902 4.83180 1.92657 -229.47255 389.38828 7650.0000 -233.98695 -229.54619 4.44076 1.92500 -229.50437 392.98632 7655.0000 -233.20169 -229.49570 3.70598 1.92458 -229.51294 386.62332 7660.0000 -234.67004 -230.55252 4.11753 1.90172 -229.97535 376.88430 7665.0000 -234.98808 -231.03133 3.95675 1.86806 -230.65634 354.23537 7670.0000 -234.92595 -230.32839 4.59756 1.86101 -230.79901 351.54933 7675.0000 -234.75301 -230.25017 4.50284 1.90287 -229.95206 380.98389 7680.0000 -234.70932 -230.23242 4.47690 1.90289 -229.95178 382.95055 7685.0000 -233.47685 -229.01822 4.45863 1.92431 -229.51828 397.32079 7690.0000 -234.45507 -229.54724 4.90783 1.94721 -229.05512 417.20140 7695.0000 -234.65653 -229.42880 5.22773 1.91985 -229.60864 397.34441 7700.0000 -234.57590 -229.37691 5.19899 1.94560 -229.08764 417.25663 7705.0000 -234.11740 -229.69437 4.42303 1.94572 -229.08520 418.07838 7710.0000 -234.76029 -229.93152 4.82877 1.90608 -229.88721 375.67197 7715.0000 -235.01798 -230.91252 4.10546 1.88666 -230.28000 365.25283 7720.0000 -234.82304 -230.71490 4.10813 1.87120 -230.59284 352.55360 7725.0000 -234.25698 -230.05333 4.20365 1.88182 -230.37807 358.97054 7730.0000 -234.37934 -230.53346 3.84588 1.88972 -230.21823 366.26226 7735.0000 -234.44850 -229.98334 4.46516 1.88848 -230.24321 365.89730 7740.0000 -233.66833 -229.02984 4.63848 1.94390 -229.12202 404.68403 7745.0000 -234.69443 -230.11376 4.58067 1.91205 -229.76643 379.65419 7750.0000 -234.51283 -229.77381 4.73902 1.91061 -229.79553 385.16217 FREEZING PROCESS: loop number 32 T-loop= 369.00000000000000 main_MD> interactions number 32 at Temperature= 369.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -1.77025 -1.33953 -0.07600 force_rgl> df(natom) 0.52201 0.47085 -2.19792 7755.0000 -234.56260 -229.93366 4.62894 1.91168 -229.77385 387.19532 7760.0000 -234.33786 -229.15097 5.18689 1.91350 -229.73697 387.10287 7765.0000 -234.51680 -230.23954 4.27726 1.91698 -229.66667 386.95832 7770.0000 -234.83495 -230.16606 4.66889 1.88898 -230.23323 368.11299 7775.0000 -235.19826 -230.91300 4.28525 1.88734 -230.26627 370.74075 7780.0000 -234.82022 -230.60965 4.21057 1.86815 -230.65450 353.96494 7785.0000 -234.76175 -229.99215 4.76960 1.86945 -230.62821 352.32915 7790.0000 -234.39227 -229.56363 4.82863 1.90267 -229.95626 378.29659 7795.0000 -233.98518 -229.90036 4.08483 1.93615 -229.27882 398.27076 7800.0000 -234.77872 -230.55451 4.22421 1.88829 -230.24712 366.23090 7805.0000 -234.86736 -230.54103 4.32632 1.86045 -230.81028 344.88840 7810.0000 -235.28301 -230.98395 4.29906 1.88136 -230.38724 361.25458 7815.0000 -234.70489 -230.41441 4.29048 1.84953 -231.03123 335.24035 7820.0000 -235.16229 -231.12838 4.03391 1.86739 -230.66993 349.50271 7825.0000 -234.85057 -230.88946 3.96110 1.83328 -231.36006 322.90106 7830.0000 -234.96376 -230.81829 4.14547 1.84738 -231.07477 338.43016 7835.0000 -234.85978 -229.42495 5.43483 1.88554 -230.30282 373.18179 7840.0000 -234.47628 -229.27607 5.20021 1.91233 -229.76064 385.94880 7845.0000 -234.94690 -230.23314 4.71376 1.92160 -229.57323 394.89346 7850.0000 -234.47872 -230.17350 4.30523 1.89786 -230.05353 371.63423 7855.0000 -233.92659 -230.08696 3.83964 1.89270 -230.15792 367.54090 7860.0000 -234.84131 -230.89203 3.94928 1.87001 -230.61702 349.48996 7865.0000 -235.18779 -230.99435 4.19344 1.85272 -230.96684 336.34738 7870.0000 -234.44162 -230.48603 3.95559 1.86454 -230.72765 339.83635 7875.0000 -235.17869 -230.84780 4.33089 1.85553 -230.90986 342.34060 7880.0000 -234.41223 -230.32978 4.08245 1.86191 -230.78091 348.46161 7885.0000 -234.76089 -230.23632 4.52457 1.87411 -230.53406 358.54424 7890.0000 -235.08182 -230.73770 4.34412 1.86556 -230.70699 355.40592 7895.0000 -234.13486 -229.63363 4.50124 1.88451 -230.32363 368.72304 7900.0000 -233.48599 -229.24157 4.24442 1.89478 -230.11586 380.45967 7905.0000 -234.91222 -230.88058 4.03163 1.90384 -229.93252 380.28230 7910.0000 -234.93341 -230.33828 4.59513 1.89305 -230.15072 376.70352 7915.0000 -235.19605 -230.57540 4.62066 1.88933 -230.22613 372.52507 7920.0000 -234.66837 -230.65544 4.01292 1.87533 -230.50925 366.16935 7925.0000 -233.79567 -229.94276 3.85291 1.88341 -230.34588 367.19444 7930.0000 -234.74975 -230.90805 3.84170 1.89241 -230.16375 373.05775 7935.0000 -234.61362 -230.19550 4.41812 1.87302 -230.55599 359.87401 7940.0000 -234.66087 -231.08161 3.57926 1.86251 -230.76865 350.66022 7945.0000 -235.10966 -231.18912 3.92053 1.85588 -230.90285 349.77653 7950.0000 -234.37849 -229.95257 4.42592 1.86803 -230.65699 352.48328 7955.0000 -234.71097 -230.40547 4.30550 1.86408 -230.73695 352.85806 7960.0000 -234.53003 -230.44754 4.08248 1.88161 -230.38233 367.37933 7965.0000 -234.78571 -230.26113 4.52458 1.89772 -230.05640 382.72806 7970.0000 -234.78715 -230.84066 3.94649 1.85797 -230.86049 352.53145 7975.0000 -235.01153 -230.28995 4.72158 1.87975 -230.41996 368.45898 7980.0000 -234.01982 -229.26627 4.75354 1.90949 -229.81812 383.75291 7985.0000 -234.35122 -229.89596 4.45527 1.92252 -229.55465 395.81008 7990.0000 -234.94278 -230.88518 4.05759 1.88638 -230.28582 365.35361 7995.0000 -234.79769 -230.01703 4.78065 1.89988 -230.01270 383.04485 8000.0000 -234.64822 -230.12126 4.52696 1.88357 -230.34266 364.17365 FREEZING PROCESS: loop number 33 T-loop= 344.00000000000000 main_MD> interactions number 33 at Temperature= 344.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -0.04735 0.02446 -0.65402 force_rgl> df(natom) -0.48899 -2.46077 -2.65922 8005.0000 -234.90173 -230.45811 4.44362 1.87290 -230.55850 358.43499 8010.0000 -234.66083 -230.31791 4.34292 1.88077 -230.39924 362.23753 8015.0000 -235.32690 -231.30897 4.01793 1.84754 -231.07152 336.51135 8020.0000 -235.04736 -231.00946 4.03790 1.85421 -230.93654 340.34401 8025.0000 -235.11303 -231.25575 3.85727 1.85630 -230.89432 350.69134 8030.0000 -235.44551 -231.89750 3.54800 1.81869 -231.65515 316.37593 8035.0000 -234.67234 -231.16471 3.50763 1.83525 -231.32012 324.83128 8040.0000 -234.90806 -231.05060 3.85746 1.84696 -231.08322 335.90029 8045.0000 -234.55973 -230.46368 4.09605 1.85572 -230.90597 347.26177 8050.0000 -235.26492 -231.43687 3.82805 1.85139 -230.99370 341.80827 8055.0000 -235.28081 -231.22535 4.05546 1.82713 -231.48452 321.07171 8060.0000 -235.39592 -231.47983 3.91610 1.83510 -231.32323 327.95882 8065.0000 -235.25563 -231.25695 3.99867 1.83080 -231.41020 324.39566 8070.0000 -235.34600 -231.34152 4.00448 1.83773 -231.27003 331.04263 8075.0000 -235.39324 -232.17564 3.21761 1.81771 -231.67511 316.02923 8080.0000 -235.22086 -230.70865 4.51221 1.83115 -231.40320 325.75879 8085.0000 -234.46469 -231.12118 3.34350 1.84354 -231.15241 332.72223 8090.0000 -235.17924 -230.95337 4.22587 1.86519 -230.71454 352.24438 8095.0000 -235.19204 -231.40824 3.78381 1.85541 -230.91222 345.91608 8100.0000 -235.58365 -231.68290 3.90075 1.83268 -231.37225 324.80154 8105.0000 -235.11616 -231.09928 4.01688 1.82809 -231.46513 323.11502 8110.0000 -234.86193 -230.66718 4.19474 1.85709 -230.87838 343.97106 8115.0000 -235.59639 -231.56681 4.02958 1.86427 -230.73314 351.78026 8120.0000 -234.62506 -230.76571 3.85935 1.86184 -230.78218 347.44403 8125.0000 -234.94710 -231.28177 3.66533 1.84885 -231.04493 336.22206 8130.0000 -235.64165 -231.67263 3.96901 1.82339 -231.56019 319.28492 8135.0000 -234.93474 -230.50251 4.43223 1.86057 -230.80785 342.81109 8140.0000 -234.94046 -230.92125 4.01922 1.85086 -231.00433 343.67308 8145.0000 -235.04662 -231.42065 3.62597 1.84372 -231.14873 333.57398 8150.0000 -235.24766 -231.24839 3.99927 1.82464 -231.53476 318.97945 8155.0000 -235.29497 -230.92350 4.37147 1.84994 -231.02288 340.58529 8160.0000 -235.02903 -231.16267 3.86636 1.87778 -230.45968 363.19653 8165.0000 -235.60619 -232.01807 3.58812 1.82622 -231.50291 323.20684 8170.0000 -234.91242 -230.92178 3.99064 1.82555 -231.51650 325.82965 8175.0000 -234.94636 -231.22181 3.72455 1.84959 -231.03008 342.10212 8180.0000 -235.04086 -231.01344 4.02742 1.86274 -230.76406 352.44091 8185.0000 -233.87385 -230.07263 3.80122 1.87101 -230.59675 355.98146 8190.0000 -234.72195 -230.71657 4.00537 1.87144 -230.58806 354.12575 8195.0000 -234.47312 -230.68888 3.78424 1.87667 -230.48217 360.30723 8200.0000 -235.33720 -231.09173 4.24547 1.85179 -230.98562 343.68132 8205.0000 -234.32891 -230.70173 3.62719 1.85514 -230.91773 343.11401 8210.0000 -234.88194 -230.58704 4.29490 1.86664 -230.68516 352.83182 8215.0000 -235.50280 -230.89070 4.61211 1.87765 -230.46242 360.00114 8220.0000 -235.15743 -231.08636 4.07107 1.83744 -231.27585 333.79445 8225.0000 -235.73833 -231.67652 4.06181 1.84094 -231.20497 337.41721 8230.0000 -235.16966 -231.16325 4.00641 1.81821 -231.66502 315.26096 8235.0000 -235.12772 -231.54154 3.58618 1.84236 -231.17644 335.00693 8240.0000 -234.90792 -231.20420 3.70372 1.81761 -231.67712 314.09525 8245.0000 -235.00069 -231.21627 3.78443 1.85794 -230.86113 346.80211 8250.0000 -234.96615 -230.58162 4.38453 1.84796 -231.06301 340.34589 FREEZING PROCESS: loop number 34 T-loop= 319.00000000000000 main_MD> interactions number 34 at Temperature= 319.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -0.49005 1.33709 0.56743 force_rgl> df(natom) -0.27683 -1.19475 -0.31239 8255.0000 -234.91517 -231.38527 3.52990 1.86175 -230.78414 351.05278 8260.0000 -235.11598 -230.93413 4.18186 1.85558 -230.90894 342.46737 8265.0000 -235.04979 -231.44312 3.60668 1.82749 -231.47727 322.11689 8270.0000 -235.05181 -231.43875 3.61306 1.83349 -231.35585 328.68915 8275.0000 -235.07733 -231.04088 4.03645 1.84783 -231.06561 337.20938 8280.0000 -234.81467 -230.68309 4.13157 1.85634 -230.89349 347.05397 8285.0000 -235.21383 -230.95712 4.25671 1.88276 -230.35904 365.16373 8290.0000 -235.33984 -231.38355 3.95629 1.82309 -231.56610 320.15750 8295.0000 -235.59118 -231.55321 4.03797 1.82786 -231.46963 322.86443 8300.0000 -235.34357 -231.71051 3.63307 1.82225 -231.58316 317.92533 8305.0000 -235.88371 -232.20441 3.67931 1.82144 -231.59964 316.30195 8310.0000 -234.82242 -231.28520 3.53722 1.82177 -231.59284 318.35788 8315.0000 -235.44297 -231.48546 3.95751 1.84272 -231.16914 334.40711 8320.0000 -235.88774 -232.16838 3.71936 1.83681 -231.28868 330.82576 8325.0000 -235.21745 -231.69287 3.52458 1.82305 -231.56702 315.89128 8330.0000 -235.18669 -231.75053 3.43616 1.80982 -231.83474 309.31393 8335.0000 -235.47231 -231.69781 3.77451 1.81509 -231.72799 314.74836 8340.0000 -235.71282 -231.97072 3.74211 1.81697 -231.68999 314.28950 8345.0000 -235.72300 -232.26337 3.45963 1.81138 -231.80315 308.73496 8350.0000 -235.22647 -231.64371 3.58276 1.81403 -231.74957 312.86869 8355.0000 -235.50249 -231.84531 3.65717 1.81910 -231.64685 317.09684 8360.0000 -235.90063 -232.11826 3.78238 1.79666 -232.10100 295.62158 8365.0000 -235.09187 -231.60462 3.48724 1.80604 -231.91118 306.16625 8370.0000 -235.27325 -231.69165 3.58160 1.81596 -231.71050 313.88278 8375.0000 -235.41507 -231.22276 4.19231 1.81795 -231.67010 313.41898 8380.0000 -234.99805 -230.81330 4.18475 1.87182 -230.58025 354.25223 8385.0000 -234.23376 -229.76628 4.46748 1.88867 -230.23944 371.02763 8390.0000 -234.86492 -230.71142 4.15350 1.91805 -229.64497 395.65368 8395.0000 -235.54242 -232.09906 3.44336 1.82874 -231.45181 322.35729 8400.0000 -235.47790 -232.24443 3.23347 1.79601 -232.11414 296.68198 8405.0000 -235.14664 -231.82216 3.32449 1.83498 -231.32558 330.74865 8410.0000 -235.44235 -231.81352 3.62882 1.81970 -231.63473 317.46745 8415.0000 -235.33871 -232.04198 3.29673 1.80674 -231.89708 306.16736 8420.0000 -235.35576 -231.40712 3.94865 1.81007 -231.82964 307.14397 8425.0000 -235.75604 -232.38368 3.37237 1.81434 -231.74322 311.57346 8430.0000 -235.14133 -231.33100 3.81033 1.80301 -231.97253 303.14397 8435.0000 -235.51669 -231.56338 3.95332 1.82899 -231.44676 324.32606 8440.0000 -235.46809 -231.26705 4.20104 1.81718 -231.68584 316.03243 8445.0000 -235.36436 -232.03890 3.32546 1.82752 -231.47662 322.50379 8450.0000 -235.08526 -231.47284 3.61242 1.82379 -231.55198 321.24628 8455.0000 -234.82031 -231.06485 3.75545 1.83333 -231.35903 326.54182 8460.0000 -235.05456 -230.78138 4.27317 1.85626 -230.89517 340.00680 8465.0000 -235.19677 -231.62558 3.57119 1.85068 -231.00802 342.59564 8470.0000 -235.71480 -232.11113 3.60367 1.81183 -231.79393 311.62675 8475.0000 -235.11090 -231.52891 3.58199 1.80994 -231.83233 311.82315 8480.0000 -234.83799 -231.13300 3.70498 1.83701 -231.28457 333.07408 8485.0000 -235.10372 -231.12410 3.97962 1.83615 -231.30206 329.29713 8490.0000 -235.37542 -231.49858 3.87684 1.84407 -231.14182 335.59555 8495.0000 -234.94684 -231.18167 3.76517 1.83648 -231.29520 330.35173 8500.0000 -234.91852 -231.28542 3.63310 1.84509 -231.12107 334.64512 main_MD> EXECUTION TIME: 0 [day], 0 [hour], 15 [min], 25.7362900 [s]. main_MD> Deallocating global variables