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_71.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 = 71 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: 71 7100 main_MD> Size of nv and nvoiz: 71 7100 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 = 71 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> 2.0260592748902968E-002 -1.0154090704947700E-002 5.4456004244491818E-002 initial drift of cluster / NP1 for coalescence init> 0.28349609608203491 0.32030329123027634 0.31735670387250925 scaling for velocity /for coalescence NP1 init.f90 > facguy = 3.6409233279175871E-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) -3.17451 -0.44764 0.11016 force_rgl> df(natom) -2.41735 1.55870 3.93054 preparo> THERMALIZATION PROCESS AT 1148.6783245228141 preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA 5000 -153.36935072218998 12.583291370723483 -165.95264209291346 6.9332047289038861E-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= 1125.0000000000000 main_MD> interactions number 1 at Temperature= 1125.0000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 1.05878 -0.42314 0.20523 force_rgl> df(natom) 1.23825 -1.29477 1.65203 5.0000 -165.54681 -154.63624 10.91057 3.22501 -154.15285 1239.26130 10.0000 -167.20019 -156.84513 10.35506 3.11691 -156.00634 1212.30366 15.0000 -169.08990 -159.27889 9.81101 2.98045 -158.34618 1110.37085 20.0000 -167.04353 -157.62473 9.41880 2.96772 -158.56436 1094.60258 25.0000 -168.60000 -158.83365 9.76634 2.93613 -159.10599 1080.73759 30.0000 -168.08518 -156.20421 11.88097 3.00090 -157.99543 1133.31137 35.0000 -169.15711 -157.52883 11.62828 3.01926 -157.68062 1134.00632 40.0000 -168.15725 -157.53772 10.61953 3.01539 -157.74694 1121.00461 45.0000 -171.08320 -159.94051 11.14269 2.93222 -159.17314 1083.05482 50.0000 -169.12014 -158.34001 10.78013 2.92902 -159.22786 1084.76839 55.0000 -169.19610 -158.57342 10.62268 3.03158 -157.46947 1165.66953 60.0000 -169.47603 -160.53980 8.93623 2.93688 -159.09310 1053.12118 65.0000 -168.49856 -158.58735 9.91121 2.93104 -159.19335 1032.49743 70.0000 -167.33854 -156.82959 10.50896 3.05628 -157.04581 1153.33488 75.0000 -166.23863 -156.86421 9.37442 3.06860 -156.83471 1178.84310 80.0000 -167.70021 -156.26362 11.43659 3.03800 -157.35930 1147.15259 85.0000 -168.17138 -157.52023 10.65115 3.11266 -156.07911 1181.67101 90.0000 -169.71995 -159.92567 9.79428 2.92943 -159.22086 1057.34725 95.0000 -168.16349 -157.49229 10.67120 2.95982 -158.69985 1097.40747 100.0000 -169.94934 -159.46030 10.48904 2.93372 -159.14728 1070.22324 105.0000 -167.21969 -155.49517 11.72452 3.07427 -156.73740 1190.97328 110.0000 -169.51930 -160.54473 8.97457 2.96554 -158.60167 1104.23280 115.0000 -169.40383 -157.40931 11.99452 2.95098 -158.85145 1079.50470 120.0000 -166.49336 -155.94613 10.54723 3.09804 -156.32983 1161.33277 125.0000 -169.31849 -157.47330 11.84519 3.08671 -156.52417 1167.88796 130.0000 -167.19128 -157.06569 10.12559 3.00815 -157.87108 1141.48898 135.0000 -165.70106 -154.99879 10.70227 3.05949 -156.99092 1149.41323 140.0000 -165.20686 -155.74526 9.46160 3.17129 -155.07390 1224.46224 145.0000 -168.86936 -158.32938 10.53999 3.05429 -157.07997 1145.55211 150.0000 -169.11987 -159.33864 9.78122 2.95122 -158.84723 1079.25538 155.0000 -169.30573 -159.02420 10.28153 2.92243 -159.34098 1074.73892 160.0000 -167.69440 -159.04266 8.65174 2.90950 -159.56264 1077.24385 165.0000 -169.41412 -159.33847 10.07565 2.93635 -159.10222 1088.26223 170.0000 -168.72176 -158.32913 10.39262 2.95606 -158.76432 1089.43333 175.0000 -166.73032 -155.82080 10.90952 3.00537 -157.91884 1115.33177 180.0000 -166.05152 -154.83515 11.21636 3.20880 -154.43076 1253.31760 185.0000 -167.34069 -156.09561 11.24508 3.15503 -155.35260 1259.63922 190.0000 -169.28428 -158.54273 10.74155 2.98563 -158.25735 1084.56234 195.0000 -171.16754 -160.63218 10.53536 2.91618 -159.44805 1082.57119 200.0000 -168.45539 -157.27950 11.17588 2.94697 -158.92010 1099.04279 205.0000 -168.80433 -159.16847 9.63586 2.96202 -158.66217 1094.20416 210.0000 -170.78217 -160.25456 10.52761 2.86640 -160.30170 1044.02923 215.0000 -168.95123 -156.77235 12.17888 2.94958 -158.87534 1119.41019 220.0000 -168.24992 -158.95418 9.29575 3.00525 -157.92088 1112.19374 225.0000 -167.75265 -157.60820 10.14445 2.96729 -158.57171 1064.04158 230.0000 -168.62211 -158.25911 10.36299 3.08312 -156.58562 1155.13068 235.0000 -167.03197 -156.62445 10.40752 3.11235 -156.08442 1186.86854 240.0000 -168.47239 -158.18428 10.28812 3.03669 -157.38186 1131.40812 245.0000 -169.56518 -159.81726 9.74792 2.93402 -159.14226 1065.06637 250.0000 -168.78159 -159.14874 9.63285 2.91546 -159.46052 1083.19379 FREEZING PROCESS: loop number 2 T-loop= 1100.0000000000000 main_MD> interactions number 2 at Temperature= 1100.0000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -0.14225 1.16736 -2.82870 force_rgl> df(natom) 6.16582 -2.05137 -10.10970 255.0000 -168.30110 -159.17284 9.12826 2.90387 -159.65916 1044.46533 260.0000 -168.78686 -158.20655 10.58031 2.96050 -158.68820 1077.67232 265.0000 -168.41353 -157.36481 11.04872 2.97883 -158.37389 1105.32240 270.0000 -168.30344 -156.94669 11.35675 3.08111 -156.62022 1166.86236 275.0000 -168.10237 -157.53005 10.57232 3.00396 -157.94292 1126.02909 280.0000 -168.29729 -156.62301 11.67428 3.10393 -156.22895 1199.95249 285.0000 -169.16762 -159.26887 9.89875 2.98505 -158.26719 1068.46618 290.0000 -169.99555 -159.84159 10.15395 2.94901 -158.88521 1051.06346 295.0000 -168.67495 -160.17461 8.50033 2.86152 -160.38525 1027.08380 300.0000 -169.27686 -160.11156 9.16529 2.91515 -159.46579 1042.88729 305.0000 -170.16283 -160.52241 9.64042 2.81141 -161.24449 962.32625 310.0000 -171.26013 -161.16399 10.09614 2.85334 -160.52553 1000.33665 315.0000 -168.22386 -158.72180 9.50207 2.90219 -159.68801 1047.66261 320.0000 -168.29758 -158.56678 9.73080 2.91450 -159.47696 1043.04937 325.0000 -169.67276 -160.14410 9.52865 2.90182 -159.69438 1050.31911 330.0000 -168.64604 -158.57811 10.06793 2.88089 -160.05324 1044.66433 335.0000 -170.68469 -160.57632 10.10837 2.97305 -158.47301 1064.84410 340.0000 -171.73797 -162.51756 9.22041 2.83985 -160.75686 1022.54518 345.0000 -169.04007 -160.09061 8.94946 2.84645 -160.64373 1023.07831 350.0000 -168.04897 -158.95667 9.09230 2.92320 -159.32780 1038.86410 355.0000 -169.80874 -160.05859 9.75014 2.90074 -159.71282 1040.64976 360.0000 -168.73734 -158.62860 10.10875 2.92035 -159.37664 1066.32946 365.0000 -169.19283 -160.84537 8.34746 2.86884 -160.25984 1023.88554 370.0000 -167.67362 -158.68174 8.99188 2.94014 -159.03729 1055.28790 375.0000 -168.01593 -158.12657 9.88936 3.00072 -157.99850 1103.16692 380.0000 -168.06633 -158.50016 9.56617 2.97014 -158.52290 1072.29575 385.0000 -165.85972 -155.21611 10.64362 3.07048 -156.80238 1176.39022 390.0000 -167.39096 -158.11860 9.27236 3.06591 -156.88080 1180.60702 395.0000 -168.71972 -160.03270 8.68702 2.91342 -159.49534 1044.87101 400.0000 -168.01199 -158.23348 9.77851 2.91375 -159.48974 1020.61488 405.0000 -167.54351 -157.15539 10.38812 3.01981 -157.67121 1127.28758 410.0000 -168.07722 -157.61332 10.46389 3.00884 -157.85925 1080.03029 415.0000 -167.55497 -159.48677 8.06820 2.99039 -158.17569 1100.96358 420.0000 -167.90651 -156.67753 11.22897 2.97951 -158.36221 1117.53005 425.0000 -166.45312 -155.28102 11.17210 3.10434 -156.22183 1188.39526 430.0000 -168.52490 -158.62411 9.90079 3.09764 -156.33672 1196.21677 435.0000 -168.78734 -160.15158 8.63576 2.97227 -158.48635 1095.43236 440.0000 -168.73029 -158.83511 9.89518 2.87268 -160.19400 1039.52778 445.0000 -167.94991 -158.34187 9.60804 2.95353 -158.80760 1086.78666 450.0000 -169.32057 -159.77197 9.54860 2.98791 -158.21824 1094.36351 455.0000 -168.26091 -158.11237 10.14853 2.93655 -159.09888 1051.85461 460.0000 -167.89916 -158.23984 9.65932 2.99545 -158.08892 1107.54390 465.0000 -166.21615 -157.30083 8.91531 3.00973 -157.84400 1120.97938 470.0000 -167.35199 -157.33749 10.01450 3.03300 -157.44510 1152.24759 475.0000 -171.38227 -160.59427 10.78800 2.99645 -158.07174 1104.89683 480.0000 -169.75719 -159.24089 10.51630 2.88157 -160.04151 1020.05500 485.0000 -168.50520 -156.86983 11.63537 3.02867 -157.51924 1147.01591 490.0000 -166.98840 -156.01032 10.97808 3.14318 -155.55579 1231.08500 495.0000 -167.10259 -155.48503 11.61756 3.07865 -156.66225 1174.99492 500.0000 -165.76885 -156.17016 9.59869 3.07817 -156.67054 1176.78690 FREEZING PROCESS: loop number 3 T-loop= 1075.0000000000000 main_MD> interactions number 3 at Temperature= 1075.0000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -1.70230 1.86329 2.29498 force_rgl> df(natom) 1.83640 -3.01419 -1.69984 505.0000 -168.52568 -158.93804 9.58765 3.07936 -156.65016 1164.86170 510.0000 -169.77162 -162.09401 7.67761 2.89977 -159.72950 1031.83124 515.0000 -168.66937 -160.00571 8.66367 2.84435 -160.67964 998.11457 520.0000 -169.43305 -160.52939 8.90366 2.94484 -158.95672 1084.10395 525.0000 -168.41489 -159.35640 9.05850 2.99469 -158.10195 1124.97540 530.0000 -168.95819 -159.50532 9.45287 2.94098 -159.02292 1054.41808 535.0000 -169.57847 -159.54997 10.02850 2.95684 -158.75091 1066.60450 540.0000 -169.22067 -159.61729 9.60338 2.84676 -160.63843 1001.31333 545.0000 -167.65152 -157.77341 9.87811 2.92635 -159.27373 1054.22655 550.0000 -169.06963 -158.62485 10.44478 2.97293 -158.47498 1095.57633 555.0000 -170.00365 -159.20633 10.79732 2.94367 -158.97682 1084.40559 560.0000 -170.12111 -159.43434 10.68677 2.94488 -158.95607 1095.25570 565.0000 -168.28821 -159.08236 9.20586 2.98910 -158.19781 1112.95693 570.0000 -167.08617 -157.31492 9.77126 2.96244 -158.65486 1062.67965 575.0000 -167.39237 -157.39161 10.00075 3.00806 -157.87261 1111.49197 580.0000 -167.55362 -155.96566 11.58796 3.06404 -156.91291 1166.70134 585.0000 -169.65472 -158.85685 10.79787 3.04028 -157.32027 1147.27891 590.0000 -167.75569 -159.17322 8.58247 2.86485 -160.32823 1005.87470 595.0000 -168.48921 -158.57712 9.91209 2.93510 -159.12373 1080.82936 600.0000 -168.59517 -159.11191 9.48326 2.94554 -158.94468 1111.11662 605.0000 -172.10287 -162.22188 9.88099 2.85561 -160.48661 1024.75176 610.0000 -169.31625 -159.69394 9.62231 2.81505 -161.18203 1004.26534 615.0000 -168.68722 -158.85363 9.83359 2.93741 -159.08402 1078.69625 620.0000 -167.69914 -158.55915 9.13999 2.96429 -158.62316 1056.70390 625.0000 -168.26374 -158.91455 9.34919 3.01361 -157.77753 1093.86797 630.0000 -169.45622 -160.21853 9.23768 2.92687 -159.26482 1067.78631 635.0000 -167.73314 -158.31046 9.42268 2.89471 -159.81629 1026.69847 640.0000 -170.77480 -160.72744 10.04736 2.90966 -159.55984 1072.25586 645.0000 -170.42785 -161.21859 9.20926 2.82744 -160.96965 988.85997 650.0000 -169.16622 -160.06494 9.10128 2.86345 -160.35217 1017.06980 655.0000 -170.25673 -160.69378 9.56295 2.93440 -159.13568 1101.69928 660.0000 -166.82397 -158.96906 7.85491 2.91229 -159.51480 1051.11324 665.0000 -169.07955 -160.09395 8.98560 2.95881 -158.71716 1039.87580 670.0000 -168.81635 -159.49115 9.32519 2.90835 -159.58236 1043.08810 675.0000 -170.01052 -158.98790 11.02262 2.90683 -159.60843 1052.92732 680.0000 -168.17698 -156.50178 11.67520 3.06788 -156.84693 1137.15560 685.0000 -168.53831 -158.34606 10.19225 3.03198 -157.46262 1135.67080 690.0000 -170.48356 -161.30020 9.18336 2.91888 -159.40176 1064.67544 695.0000 -167.43025 -157.80789 9.62236 2.95211 -158.83203 1089.78972 700.0000 -165.70480 -156.14347 9.56133 3.04367 -157.26203 1135.90349 705.0000 -167.45182 -156.17039 11.28143 3.11916 -155.96772 1213.87977 710.0000 -169.36405 -159.17164 10.19240 3.03443 -157.42049 1151.73950 715.0000 -168.78261 -158.59088 10.19173 2.89166 -159.86851 1049.28324 720.0000 -167.66231 -158.06116 9.60116 2.94933 -158.87962 1057.62922 725.0000 -166.58595 -157.61091 8.97504 2.96599 -158.59409 1074.32164 730.0000 -169.99379 -159.60598 10.38780 3.00461 -157.93185 1114.55002 735.0000 -166.96786 -157.08254 9.88532 2.94758 -158.90966 1068.05764 740.0000 -168.88976 -160.86234 8.02742 2.90643 -159.61522 1076.68810 745.0000 -167.85497 -157.35826 10.49671 2.91669 -159.43941 1046.98740 750.0000 -166.09827 -156.38283 9.71544 3.03647 -157.38563 1118.54348 FREEZING PROCESS: loop number 4 T-loop= 1050.0000000000000 main_MD> interactions number 4 at Temperature= 1050.0000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 0.21600 -1.19151 0.21644 force_rgl> df(natom) -2.54572 -2.15915 -4.35805 755.0000 -169.42704 -158.36274 11.06430 3.08439 -156.56388 1153.43143 760.0000 -167.93975 -159.12610 8.81365 2.99264 -158.13702 1091.11206 765.0000 -170.81823 -161.10690 9.71133 2.93218 -159.17379 1099.10184 770.0000 -167.60495 -157.13879 10.46615 2.95214 -158.83155 1070.12817 775.0000 -170.29296 -160.79019 9.50277 2.98209 -158.31806 1107.51945 780.0000 -168.52014 -158.13155 10.38860 2.94631 -158.93147 1092.03832 785.0000 -169.89506 -160.72799 9.16707 2.92433 -159.30831 1048.44827 790.0000 -167.63350 -158.52782 9.10568 2.93097 -159.19457 1064.74068 795.0000 -166.89656 -157.02900 9.86756 3.03032 -157.49096 1122.84793 800.0000 -169.56075 -161.47428 8.08647 2.88885 -159.91675 1019.52282 805.0000 -171.09153 -160.88753 10.20399 2.80270 -161.39380 1000.58741 810.0000 -169.47545 -161.08029 8.39517 2.83880 -160.77485 991.74837 815.0000 -170.16503 -161.48684 8.67820 2.79925 -161.45304 985.93100 820.0000 -170.88777 -162.33520 8.55258 2.83378 -160.86102 995.99450 825.0000 -170.94815 -161.43968 9.50847 2.82598 -160.99476 983.23370 830.0000 -168.54613 -160.19999 8.34614 2.81939 -161.10772 981.40060 835.0000 -170.35989 -159.52734 10.83255 2.92275 -159.33545 1073.77495 840.0000 -169.73443 -158.18605 11.54838 2.95228 -158.82909 1039.67825 845.0000 -169.10762 -158.78110 10.32652 3.02890 -157.51534 1148.93259 850.0000 -169.78037 -159.78790 9.99247 2.97113 -158.50588 1099.68386 855.0000 -168.63834 -160.56015 8.07818 2.88887 -159.91641 1017.69082 860.0000 -170.64979 -161.94229 8.70750 2.77915 -161.79773 959.10136 865.0000 -166.87546 -158.08126 8.79421 2.86626 -160.30397 1025.85391 870.0000 -166.47699 -156.19892 10.27807 3.07269 -156.76453 1110.95125 875.0000 -166.77103 -155.78217 10.98885 3.16952 -155.10422 1236.17352 880.0000 -168.12361 -155.41465 12.70896 3.11899 -155.97058 1201.51883 885.0000 -165.94894 -156.16607 9.78287 3.16999 -155.09610 1230.27251 890.0000 -165.45865 -153.51925 11.93940 3.14179 -155.57971 1227.75148 895.0000 -168.57901 -159.25053 9.32848 3.14952 -155.44711 1202.91705 900.0000 -169.94631 -160.61979 9.32652 2.86006 -160.41038 1009.93894 905.0000 -170.14771 -160.74487 9.40284 2.86472 -160.33049 1014.92335 910.0000 -169.44553 -158.69678 10.74875 2.93831 -159.06865 1079.62152 915.0000 -167.99783 -157.23430 10.76353 2.94310 -158.98644 1076.96803 920.0000 -167.87126 -158.06889 9.80236 3.02428 -157.59458 1118.29651 925.0000 -167.61819 -158.07604 9.54214 3.06193 -156.94899 1157.56228 930.0000 -168.28529 -157.61655 10.66874 2.99433 -158.10815 1110.18461 935.0000 -169.79151 -161.00794 8.78357 2.88343 -160.00960 1046.74291 940.0000 -168.22648 -159.59404 8.63245 2.87216 -160.20292 1018.41458 945.0000 -168.90164 -159.47111 9.43053 2.90448 -159.64871 1026.30122 950.0000 -168.49581 -159.90993 8.58588 2.93531 -159.12011 1087.86683 955.0000 -169.46034 -159.24523 10.21510 2.95582 -158.76843 1081.99238 960.0000 -168.90213 -156.85284 12.04929 3.04362 -157.26292 1153.06294 965.0000 -168.81538 -159.75850 9.05688 3.00393 -157.94356 1118.39116 970.0000 -167.55238 -157.89933 9.65305 2.95857 -158.72119 1104.09070 975.0000 -168.63887 -159.17525 9.46362 2.94402 -158.97069 1085.90350 980.0000 -165.80830 -156.61480 9.19350 2.99778 -158.04894 1091.15583 985.0000 -166.78091 -155.27605 11.50486 3.09506 -156.38089 1206.40992 990.0000 -168.49070 -157.65321 10.83748 3.01267 -157.79365 1104.87230 995.0000 -169.65151 -159.83576 9.81575 2.98110 -158.33502 1116.93512 1000.0000 -169.43626 -160.95511 8.48115 2.89251 -159.85396 1055.09468 FREEZING PROCESS: loop number 5 T-loop= 1025.0000000000000 main_MD> interactions number 5 at Temperature= 1025.0000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -5.21257 4.87921 -2.23544 force_rgl> df(natom) -2.10855 3.15674 1.96083 1005.0000 -171.21347 -161.84998 9.36348 2.77890 -161.80202 960.16632 1010.0000 -171.12340 -161.98676 9.13664 2.73746 -162.51255 974.10385 1015.0000 -168.44007 -160.25528 8.18479 2.85631 -160.47465 1018.13946 1020.0000 -168.71923 -159.02172 9.69751 2.88409 -159.99833 1029.82633 1025.0000 -168.61344 -159.32391 9.28954 2.94303 -158.98765 1033.26790 1030.0000 -168.87199 -157.98864 10.88336 2.95999 -158.69689 1093.65279 1035.0000 -168.68025 -158.73243 9.94782 3.00688 -157.89287 1115.49151 1040.0000 -168.99150 -159.51216 9.47934 2.89047 -159.88889 1022.76884 1045.0000 -168.70006 -159.94063 8.75943 2.87331 -160.18321 1011.06243 1050.0000 -171.46352 -161.81932 9.64420 2.84364 -160.69187 1024.94561 1055.0000 -171.28804 -162.78090 8.50714 2.76166 -162.09760 933.94831 1060.0000 -171.59710 -162.45860 9.13849 2.76805 -161.98801 990.55707 1065.0000 -169.15518 -159.29394 9.86125 2.86099 -160.39432 1025.46866 1070.0000 -172.04758 -161.70371 10.34386 2.84679 -160.63791 997.04788 1075.0000 -170.98756 -162.57644 8.41112 2.70423 -163.08227 914.66878 1080.0000 -171.79796 -164.63010 7.16786 2.61259 -164.65362 875.79760 1085.0000 -172.37526 -163.55340 8.82187 2.65569 -163.91456 904.35400 1090.0000 -169.66389 -160.37555 9.28834 2.75966 -162.13188 950.56581 1095.0000 -168.04134 -157.51339 10.52795 2.94716 -158.91689 1072.96152 1100.0000 -168.18398 -157.09773 11.08624 3.01609 -157.73499 1110.30391 1105.0000 -167.99988 -158.61170 9.38818 3.04946 -157.16282 1148.99874 1110.0000 -169.54195 -158.40810 11.13384 2.94840 -158.89570 1062.52861 1115.0000 -171.01736 -160.77725 10.24010 2.93957 -159.04711 1099.96306 1120.0000 -167.55377 -158.68887 8.86491 2.89470 -159.81642 1022.57059 1125.0000 -170.07913 -160.94077 9.13836 2.88996 -159.89768 1006.78189 1130.0000 -171.49641 -163.21123 8.28518 2.74447 -162.39231 931.79070 1135.0000 -172.41809 -163.11053 9.30756 2.66324 -163.78503 900.83063 1140.0000 -170.91196 -162.65233 8.25962 2.75351 -162.23726 954.87542 1145.0000 -171.31864 -162.31566 9.00298 2.76392 -162.05883 981.63764 1150.0000 -170.26209 -160.47366 9.78843 2.80571 -161.34218 1006.38145 1155.0000 -167.37014 -157.59682 9.77332 3.00135 -157.98778 1089.20106 1160.0000 -170.16448 -162.13439 8.03009 2.86149 -160.38591 1005.51846 1165.0000 -171.38206 -162.70779 8.67427 2.73818 -162.50021 916.52844 1170.0000 -170.01682 -160.36790 9.64892 2.81821 -161.12789 987.24999 1175.0000 -167.84020 -158.11709 9.72311 2.87336 -160.18224 1021.23156 1180.0000 -167.58895 -158.67882 8.91013 2.98042 -158.34666 1107.23966 1185.0000 -169.43758 -161.15659 8.28099 2.83815 -160.78597 1004.12802 1190.0000 -169.54882 -160.13258 9.41623 2.81844 -161.12393 1027.69853 1195.0000 -167.44124 -158.12960 9.31163 3.00225 -157.97232 1097.68292 1200.0000 -169.21512 -160.02183 9.19329 2.89329 -159.84063 1034.09735 1205.0000 -171.04973 -163.11447 7.93526 2.80532 -161.34892 948.02275 1210.0000 -169.21071 -160.08738 9.12333 2.75871 -162.14820 952.47501 1215.0000 -170.55716 -160.25386 10.30330 2.86937 -160.25076 1026.96526 1220.0000 -169.56146 -160.70820 8.85326 2.80658 -161.32733 983.05132 1225.0000 -170.28957 -160.39421 9.89536 2.88395 -160.00080 1049.07211 1230.0000 -169.25150 -159.81512 9.43637 2.83636 -160.81667 1009.52645 1235.0000 -169.36728 -158.94297 10.42431 2.96388 -158.63019 1091.62045 1240.0000 -167.83594 -158.41182 9.42413 2.98692 -158.23521 1130.01006 1245.0000 -168.70215 -160.45325 8.24889 2.89314 -159.84320 1016.16232 1250.0000 -169.12159 -159.63463 9.48696 2.88537 -159.97630 1036.75431 FREEZING PROCESS: loop number 6 T-loop= 1000.0000000000000 main_MD> interactions number 6 at Temperature= 1000.0000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 1.41214 -5.49811 -1.59382 force_rgl> df(natom) 3.15451 1.42320 0.04509 1255.0000 -170.57474 -160.22910 10.34564 2.84742 -160.62701 1029.21223 1260.0000 -171.51248 -162.30174 9.21074 2.84785 -160.61967 1003.56409 1265.0000 -170.88037 -161.32554 9.55483 2.78695 -161.66394 970.28387 1270.0000 -170.11631 -161.38071 8.73560 2.72840 -162.66788 933.17522 1275.0000 -168.76713 -158.74788 10.01925 2.86232 -160.37159 993.90057 1280.0000 -169.38112 -161.09202 8.28910 2.91914 -159.39727 1056.15295 1285.0000 -171.38552 -162.81797 8.56755 2.72462 -162.73257 947.88814 1290.0000 -169.83975 -160.80758 9.03217 2.81705 -161.14776 994.00129 1295.0000 -170.21658 -161.35396 8.86262 2.81420 -161.19674 1000.77086 1300.0000 -169.34463 -160.12310 9.22153 2.82445 -161.02090 1015.54530 1305.0000 -168.53204 -159.01732 9.51472 2.90762 -159.59485 1063.61421 1310.0000 -170.44261 -161.41770 9.02490 2.90640 -159.61575 1047.45804 1315.0000 -171.94777 -161.86194 10.08583 2.80741 -161.31318 996.63090 1320.0000 -170.26751 -161.14599 9.12153 2.76331 -162.06933 951.41527 1325.0000 -171.12532 -162.23036 8.89496 2.74144 -162.44428 941.10426 1330.0000 -170.04474 -161.79560 8.24914 2.75742 -162.17022 952.73722 1335.0000 -171.90125 -163.52913 8.37211 2.72341 -162.75332 918.25013 1340.0000 -171.41023 -162.84449 8.56574 2.73423 -162.56779 914.40650 1345.0000 -171.19412 -162.97783 8.21628 2.71610 -162.87878 942.19130 1350.0000 -170.95283 -161.71023 9.24260 2.78354 -161.72239 976.69583 1355.0000 -171.34660 -162.64348 8.70312 2.75851 -162.15151 943.97028 1360.0000 -171.45743 -160.52361 10.93381 2.77492 -161.87022 975.42619 1365.0000 -168.28771 -160.09603 8.19168 2.84953 -160.59091 981.65315 1370.0000 -169.75224 -161.40593 8.34631 2.81969 -161.10262 973.96850 1375.0000 -170.68335 -161.47861 9.20474 2.79752 -161.48275 963.57987 1380.0000 -170.16657 -161.26174 8.90484 2.76355 -162.06518 965.40047 1385.0000 -170.03636 -161.19590 8.84046 2.80141 -161.41600 964.91480 1390.0000 -171.38523 -162.52321 8.86202 2.80655 -161.32781 1003.72212 1395.0000 -170.88602 -160.43034 10.45568 2.75276 -162.25008 953.81170 1400.0000 -170.10714 -160.04529 10.06185 2.80680 -161.32350 991.05825 1405.0000 -170.21594 -159.84855 10.36739 2.86625 -160.30426 1022.31652 1410.0000 -170.92097 -161.62036 9.30060 2.84186 -160.72237 1016.59486 1415.0000 -168.68693 -159.30502 9.38191 2.88472 -159.98760 1032.76367 1420.0000 -169.53454 -160.40367 9.13087 2.84223 -160.71604 1014.69423 1425.0000 -170.27491 -161.54944 8.72547 2.85793 -160.44684 1001.85104 1430.0000 -171.06136 -163.04448 8.01689 2.71407 -162.91359 928.70674 1435.0000 -170.72272 -161.85797 8.86475 2.78143 -161.75855 967.82357 1440.0000 -170.73937 -159.91066 10.82871 2.77513 -161.86662 939.02325 1445.0000 -170.37720 -161.83484 8.54236 2.85031 -160.57754 1043.98548 1450.0000 -169.59557 -160.57289 9.02268 2.84645 -160.64375 999.25572 1455.0000 -170.84830 -162.36700 8.48130 2.80461 -161.36111 990.86867 1460.0000 -171.03506 -162.39479 8.64026 2.72480 -162.72956 945.87565 1465.0000 -169.76810 -161.65024 8.11786 2.79582 -161.51187 987.16607 1470.0000 -171.25147 -163.57689 7.67457 2.72835 -162.66868 922.67313 1475.0000 -171.86440 -162.25072 9.61367 2.72993 -162.64152 907.08975 1480.0000 -170.49270 -162.79277 7.69993 2.73830 -162.49808 964.86790 1485.0000 -170.18571 -160.95069 9.23503 2.78608 -161.67884 948.62243 1490.0000 -171.52522 -163.71822 7.80700 2.74828 -162.32704 926.49994 1495.0000 -170.52427 -161.72650 8.79777 2.74912 -162.31252 950.16976 1500.0000 -172.52181 -164.35653 8.16528 2.71277 -162.93590 937.65517 FREEZING PROCESS: loop number 7 T-loop= 975.00000000000000 main_MD> interactions number 7 at Temperature= 975.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 2.22423 -0.03940 1.31859 force_rgl> df(natom) 3.05857 4.25175 0.59703 1505.0000 -170.63171 -162.15869 8.47302 2.69627 -163.21872 900.61803 1510.0000 -170.45780 -161.26480 9.19301 2.75558 -162.20187 932.72537 1515.0000 -170.05873 -161.13136 8.92737 2.85270 -160.53650 999.44194 1520.0000 -171.35152 -163.07845 8.27307 2.76597 -162.02372 962.41395 1525.0000 -168.52052 -159.72687 8.79365 2.73848 -162.49493 911.92520 1530.0000 -169.87098 -161.61098 8.26000 2.84775 -160.62134 1002.06889 1535.0000 -170.98761 -161.99689 8.99072 2.77405 -161.88509 977.49940 1540.0000 -169.61862 -160.37282 9.24580 2.85078 -160.56941 992.84008 1545.0000 -171.65469 -162.18705 9.46763 2.79116 -161.59181 996.46393 1550.0000 -170.16452 -160.10939 10.05513 2.84962 -160.58936 997.50737 1555.0000 -171.26275 -162.32050 8.94226 2.82419 -161.02539 983.29830 1560.0000 -168.70166 -160.08879 8.61288 2.79472 -161.53066 970.98251 1565.0000 -169.77094 -159.69717 10.07376 2.91572 -159.45590 1079.16367 1570.0000 -169.19306 -159.76413 9.42893 2.87236 -160.19947 1029.54721 1575.0000 -170.25764 -161.36363 8.89401 2.84428 -160.68091 1013.32673 1580.0000 -169.52104 -160.86176 8.65927 2.80441 -161.36455 972.44414 1585.0000 -170.13145 -161.16176 8.96969 2.87995 -160.06937 1027.26623 1590.0000 -170.86285 -161.61776 9.24509 2.81461 -161.18958 965.27908 1595.0000 -169.29105 -160.24284 9.04821 2.82103 -161.07950 962.21384 1600.0000 -169.73105 -159.19238 10.53867 2.92094 -159.36649 1043.80542 1605.0000 -170.95683 -160.85385 10.10299 2.85261 -160.53809 1037.19141 1610.0000 -170.60850 -159.90530 10.70320 2.84689 -160.63609 1024.15498 1615.0000 -168.27443 -160.43313 7.84130 2.87300 -160.18853 1023.57210 1620.0000 -169.20061 -160.69221 8.50840 2.81660 -161.15547 974.44366 1625.0000 -167.76978 -158.66221 9.10756 2.92325 -159.32687 1022.54199 1630.0000 -170.16166 -160.04764 10.11401 2.93928 -159.05193 1084.60160 1635.0000 -168.87646 -159.08557 9.79089 2.88494 -159.98377 1039.45648 1640.0000 -169.22255 -159.78114 9.44141 2.90267 -159.67967 1014.42272 1645.0000 -170.82469 -161.72824 9.09645 2.78881 -161.63197 971.90868 1650.0000 -170.21675 -161.57935 8.63739 2.78258 -161.73880 964.54701 1655.0000 -169.84967 -160.71359 9.13608 2.82615 -160.99175 1000.10097 1660.0000 -170.70718 -163.15976 7.54742 2.86867 -160.26278 999.49465 1665.0000 -170.06210 -160.97492 9.08719 2.70856 -163.00810 920.07651 1670.0000 -170.30773 -160.48681 9.82092 2.82684 -160.97993 1005.58471 1675.0000 -169.95575 -160.76088 9.19487 2.80118 -161.41986 999.11493 1680.0000 -168.35402 -159.22907 9.12495 2.85194 -160.54965 1039.21013 1685.0000 -168.81579 -158.61440 10.20138 2.90361 -159.66364 1027.15506 1690.0000 -170.72785 -161.28895 9.43890 2.85197 -160.54913 1023.24396 1695.0000 -170.93685 -160.70812 10.22872 2.78750 -161.65448 962.37297 1700.0000 -171.27775 -162.77641 8.50135 2.74822 -162.32801 950.19303 1705.0000 -170.04290 -162.06951 7.97339 2.79099 -161.59458 994.45915 1710.0000 -172.68897 -163.68630 9.00267 2.71763 -162.85248 924.79503 1715.0000 -169.09505 -161.17411 7.92094 2.79157 -161.58462 959.48109 1720.0000 -169.83225 -160.71871 9.11354 2.82381 -161.03183 976.43416 1725.0000 -170.93901 -162.67904 8.25998 2.83130 -160.90352 983.48536 1730.0000 -172.02412 -164.07928 7.94485 2.67759 -163.53911 893.34779 1735.0000 -170.92547 -162.99476 7.93071 2.66996 -163.66988 882.35238 1740.0000 -170.61761 -161.41280 9.20481 2.75869 -162.14852 958.51832 1745.0000 -169.69356 -159.77850 9.91505 2.85462 -160.50362 983.22682 1750.0000 -170.69643 -161.13808 9.55835 2.86086 -160.39666 988.49293 FREEZING PROCESS: loop number 8 T-loop= 950.00000000000000 main_MD> interactions number 8 at Temperature= 950.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 0.41232 0.35770 1.13511 force_rgl> df(natom) -1.77294 -4.59125 0.88623 1755.0000 -171.45921 -161.81057 9.64864 2.77714 -161.83210 951.24426 1760.0000 -170.27274 -162.26905 8.00368 2.77791 -161.81886 967.75850 1765.0000 -171.08263 -161.59375 9.48888 2.73396 -162.57257 926.69663 1770.0000 -170.21765 -162.97173 7.24592 2.74665 -162.35491 953.02407 1775.0000 -172.07226 -163.56027 8.51199 2.69703 -163.20566 911.98514 1780.0000 -172.66787 -164.48819 8.17968 2.64221 -164.14572 868.12808 1785.0000 -173.00196 -164.55570 8.44626 2.62816 -164.38651 877.98739 1790.0000 -172.82039 -162.60448 10.21591 2.73046 -162.63253 943.52073 1795.0000 -169.50110 -160.90288 8.59822 2.78671 -161.66796 993.63162 1800.0000 -170.56178 -160.59420 9.96757 2.84281 -160.70611 1014.63544 1805.0000 -169.76522 -161.02412 8.74110 2.78512 -161.69533 970.25255 1810.0000 -170.54287 -162.94448 7.59839 2.76919 -161.96846 966.76146 1815.0000 -171.07827 -162.89436 8.18391 2.72212 -162.77556 910.15535 1820.0000 -171.57331 -163.66361 7.90971 2.70647 -163.04389 914.06529 1825.0000 -169.56692 -161.12720 8.43972 2.80607 -161.33611 973.74486 1830.0000 -171.26902 -163.72060 7.54842 2.76573 -162.02780 948.13601 1835.0000 -170.93771 -162.21860 8.71910 2.73445 -162.56404 933.19247 1840.0000 -168.69845 -160.35186 8.34659 2.83887 -160.77364 1031.39287 1845.0000 -167.62434 -157.46849 10.15585 2.94652 -158.92791 1084.22142 1850.0000 -168.43967 -159.73019 8.70948 2.90047 -159.71753 1049.27762 1855.0000 -171.17975 -162.84451 8.33524 2.80151 -161.41424 956.05449 1860.0000 -170.58704 -162.95620 7.63084 2.75949 -162.13476 921.34114 1865.0000 -171.30691 -163.58725 7.71966 2.70728 -163.02999 909.06465 1870.0000 -169.12464 -160.92322 8.20142 2.72614 -162.70665 908.78636 1875.0000 -168.13184 -159.70537 8.42648 2.78871 -161.63377 949.49467 1880.0000 -171.09851 -161.84013 9.25838 2.84461 -160.67531 982.26073 1885.0000 -170.40191 -163.40230 6.99961 2.73138 -162.61667 890.70621 1890.0000 -171.23427 -163.68907 7.54520 2.68415 -163.42658 879.13157 1895.0000 -171.52303 -163.72915 7.79388 2.66480 -163.75840 893.91153 1900.0000 -169.57058 -161.10076 8.46982 2.76194 -162.09283 976.03750 1905.0000 -170.89452 -162.20050 8.69402 2.77464 -161.87503 956.09926 1910.0000 -170.94358 -162.30671 8.63687 2.77646 -161.84386 962.24053 1915.0000 -171.40379 -162.22341 9.18037 2.71495 -162.89847 948.88733 1920.0000 -172.93107 -163.13211 9.79897 2.76967 -161.96027 955.17805 1925.0000 -171.30797 -163.21752 8.09045 2.67961 -163.50438 916.36689 1930.0000 -171.76112 -163.63038 8.13074 2.65408 -163.94214 861.06073 1935.0000 -170.98508 -162.30596 8.67911 2.70083 -163.14053 935.77293 1940.0000 -171.54276 -163.43902 8.10374 2.70884 -163.00319 917.80893 1945.0000 -172.30041 -164.57562 7.72479 2.64864 -164.03551 878.39201 1950.0000 -172.24314 -164.00501 8.23813 2.63604 -164.25146 851.45666 1955.0000 -170.94010 -162.27571 8.66439 2.68246 -163.45549 901.44637 1960.0000 -171.98619 -162.85533 9.13086 2.72909 -162.65607 937.88576 1965.0000 -171.87370 -164.22358 7.65012 2.69099 -163.30931 910.07520 1970.0000 -173.21056 -164.91384 8.29672 2.61172 -164.66855 863.21809 1975.0000 -170.76179 -161.61329 9.14849 2.68975 -163.33055 880.63944 1980.0000 -172.72444 -163.62753 9.09691 2.78975 -161.61591 946.71938 1985.0000 -171.39718 -163.07520 8.32198 2.74270 -162.42268 950.47563 1990.0000 -171.24631 -163.01319 8.23312 2.65051 -164.00338 846.16289 1995.0000 -170.26366 -161.58364 8.68002 2.73762 -162.50967 926.26238 2000.0000 -168.65752 -159.86983 8.78769 2.83126 -160.90410 1029.12704 FREEZING PROCESS: loop number 9 T-loop= 925.00000000000000 main_MD> interactions number 9 at Temperature= 925.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 1.43975 -0.98314 0.96205 force_rgl> df(natom) 4.74972 -1.70762 0.85350 2005.0000 -173.24646 -164.26460 8.98186 2.80611 -161.33545 985.80503 2010.0000 -172.23275 -163.55533 8.67742 2.64974 -164.01650 864.97838 2015.0000 -171.20670 -162.35802 8.84868 2.68824 -163.35644 908.30002 2020.0000 -171.16383 -162.17325 8.99059 2.78963 -161.61790 929.81734 2025.0000 -170.27521 -162.16867 8.10655 2.74829 -162.32673 983.89971 2030.0000 -170.56261 -161.85467 8.70794 2.76538 -162.03372 945.91591 2035.0000 -169.86143 -160.21151 9.64992 2.79623 -161.50486 956.01668 2040.0000 -171.53441 -161.75431 9.78010 2.86687 -160.29361 1022.71032 2045.0000 -171.20827 -161.76265 9.44562 2.72220 -162.77408 953.71303 2050.0000 -170.67671 -162.70275 7.97396 2.77381 -161.88916 923.04953 2055.0000 -171.53047 -163.43997 8.09050 2.68488 -163.41406 886.64213 2060.0000 -171.33533 -163.35917 7.97617 2.65806 -163.87392 874.89552 2065.0000 -171.11960 -163.74554 7.37406 2.67244 -163.62728 880.12491 2070.0000 -171.63649 -161.72738 9.90911 2.73511 -162.55283 938.62004 2075.0000 -172.05424 -163.16061 8.89363 2.81374 -161.20459 983.39114 2080.0000 -171.14218 -162.33832 8.80386 2.70896 -163.00120 913.75455 2085.0000 -171.67008 -164.54024 7.12984 2.66560 -163.74458 873.24367 2090.0000 -172.31224 -163.96607 8.34616 2.65631 -163.90399 884.81832 2095.0000 -170.31093 -161.18038 9.13054 2.74015 -162.46636 931.68579 2100.0000 -168.72525 -159.72750 8.99774 2.92448 -159.30579 1073.49101 2105.0000 -172.76594 -163.72272 9.04321 2.72839 -162.66797 940.57070 2110.0000 -170.64839 -161.60209 9.04630 2.72096 -162.79534 941.12179 2115.0000 -170.57711 -162.53604 8.04108 2.77450 -161.87744 944.68520 2120.0000 -171.85783 -163.85160 8.00623 2.69886 -163.17431 915.86829 2125.0000 -172.40843 -162.65643 9.75200 2.68359 -163.43621 892.42300 2130.0000 -170.05290 -162.19886 7.85403 2.79118 -161.59145 937.23714 2135.0000 -172.43843 -163.14544 9.29299 2.71957 -162.81924 891.18644 2140.0000 -171.80008 -163.77613 8.02395 2.66927 -163.68165 883.38738 2145.0000 -173.61918 -165.42843 8.19075 2.56690 -165.43705 836.92524 2150.0000 -171.65593 -163.39648 8.25945 2.60916 -164.71242 863.33976 2155.0000 -171.30598 -162.20058 9.10540 2.70018 -163.15165 904.95078 2160.0000 -171.05225 -163.11803 7.93421 2.72746 -162.68394 946.52623 2165.0000 -172.16632 -164.83010 7.33622 2.71393 -162.91592 913.66584 2170.0000 -173.29045 -165.12053 8.16992 2.54246 -165.85601 806.75204 2175.0000 -172.45197 -165.26456 7.18741 2.60990 -164.69966 858.72789 2180.0000 -171.13608 -162.82412 8.31196 2.68157 -163.47085 904.26862 2185.0000 -170.64784 -162.74262 7.90522 2.74959 -162.30452 954.84372 2190.0000 -172.03675 -162.50631 9.53044 2.70390 -163.08800 901.69560 2195.0000 -171.52267 -164.67569 6.84697 2.68695 -163.37851 920.04820 2200.0000 -171.62420 -162.98673 8.63747 2.71075 -162.97054 937.68219 2205.0000 -169.88827 -162.74956 7.13871 2.72182 -162.78070 953.29639 2210.0000 -172.16927 -163.65427 8.51500 2.64967 -164.01783 898.16485 2215.0000 -170.22713 -161.65382 8.57331 2.70659 -163.04179 932.53603 2220.0000 -172.65536 -164.36788 8.28748 2.71125 -162.96186 929.02724 2225.0000 -172.30334 -164.19422 8.10912 2.61844 -164.55326 868.75948 2230.0000 -175.14465 -166.24968 8.89497 2.60608 -164.76510 878.50345 2235.0000 -171.68489 -162.77257 8.91232 2.62413 -164.45563 905.57235 2240.0000 -171.24099 -163.22931 8.01168 2.66892 -163.68774 903.08526 2245.0000 -170.24958 -160.87493 9.37465 2.75679 -162.18105 968.17108 2250.0000 -170.09821 -161.56409 8.53412 2.78045 -161.77538 957.74541 FREEZING PROCESS: loop number 10 T-loop= 900.00000000000000 main_MD> interactions number 10 at Temperature= 900.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -1.93244 2.66849 0.70963 force_rgl> df(natom) 0.28108 -0.97603 1.80119 2255.0000 -171.66243 -162.05961 9.60282 2.74370 -162.40544 948.76178 2260.0000 -172.98051 -163.70040 9.28012 2.77233 -161.91461 987.91099 2265.0000 -172.12305 -163.14413 8.97892 2.70460 -163.07595 907.70289 2270.0000 -171.70967 -162.87303 8.83663 2.70588 -163.05395 922.53363 2275.0000 -172.20378 -162.94260 9.26118 2.71641 -162.87344 899.69323 2280.0000 -172.23519 -165.34885 6.88634 2.62956 -164.36253 873.86892 2285.0000 -173.20354 -165.04288 8.16065 2.60081 -164.85547 853.78977 2290.0000 -173.24456 -164.74216 8.50240 2.56862 -165.40752 811.35964 2295.0000 -172.83276 -163.83162 9.00114 2.62819 -164.38601 884.30242 2300.0000 -172.34988 -162.90044 9.44944 2.71378 -162.91847 953.11254 2305.0000 -169.13074 -159.38990 9.74084 2.77152 -161.92841 955.63997 2310.0000 -172.47229 -162.14105 10.33124 2.85117 -160.56272 1004.05489 2315.0000 -170.18989 -162.89030 7.29959 2.71492 -162.89891 887.23288 2320.0000 -170.64786 -163.14990 7.49796 2.69285 -163.27745 899.67995 2325.0000 -170.11798 -162.34911 7.76886 2.77235 -161.91430 954.61688 2330.0000 -170.31112 -162.55123 7.75990 2.73184 -162.60887 953.67409 2335.0000 -171.22254 -161.88609 9.33645 2.76218 -162.08865 959.23324 2340.0000 -171.88766 -161.72531 10.16235 2.78051 -161.77439 990.22681 2345.0000 -172.48528 -165.59161 6.89366 2.68562 -163.40141 924.58437 2350.0000 -172.60850 -165.73720 6.87130 2.56551 -165.46085 841.02568 2355.0000 -175.32037 -167.03004 8.29033 2.54082 -165.88420 821.01916 2360.0000 -172.50192 -164.02292 8.47900 2.56183 -165.52383 841.07807 2365.0000 -172.22987 -162.76856 9.46131 2.70273 -163.10797 923.48912 2370.0000 -172.25076 -163.21093 9.03983 2.70310 -163.10162 924.51523 2375.0000 -170.60194 -161.80881 8.79312 2.73321 -162.58530 932.15857 2380.0000 -172.48546 -163.79392 8.69154 2.68728 -163.37294 931.64321 2385.0000 -170.85295 -161.98452 8.86843 2.75816 -162.15763 979.98407 2390.0000 -170.44782 -162.15779 8.29003 2.76885 -161.97429 956.08880 2395.0000 -170.63301 -163.29796 7.33505 2.72029 -162.80684 900.09577 2400.0000 -172.34009 -163.72859 8.61150 2.71108 -162.96485 904.65456 2405.0000 -171.67194 -162.76195 8.90999 2.64473 -164.10255 866.42460 2410.0000 -170.38648 -161.09736 9.28912 2.71940 -162.82213 947.07285 2415.0000 -171.46758 -163.21616 8.25142 2.74963 -162.30376 946.54913 2420.0000 -171.21366 -162.59654 8.61713 2.74984 -162.30019 958.59013 2425.0000 -171.88318 -163.20397 8.67921 2.74514 -162.38076 947.21272 2430.0000 -173.11253 -163.78425 9.32828 2.66460 -163.76183 876.67026 2435.0000 -172.94177 -163.49796 9.44381 2.67943 -163.50753 918.45791 2440.0000 -172.92622 -164.95770 7.96852 2.61906 -164.54268 892.06173 2445.0000 -171.59237 -163.67984 7.91253 2.71029 -162.97830 947.65918 2450.0000 -173.17346 -165.06461 8.10885 2.63834 -164.21206 874.32334 2455.0000 -172.62258 -164.78741 7.83518 2.58308 -165.15954 832.69071 2460.0000 -173.23135 -166.19063 7.04071 2.61076 -164.68495 823.06192 2465.0000 -171.67091 -164.56660 7.10432 2.58499 -165.12686 841.80862 2470.0000 -170.75176 -161.56800 9.18376 2.76590 -162.02485 956.72955 2475.0000 -169.55581 -161.97330 7.58251 2.75866 -162.14892 923.59886 2480.0000 -172.18881 -163.64480 8.54402 2.72380 -162.74677 921.27682 2485.0000 -171.93214 -163.89655 8.03559 2.66855 -163.69397 889.29623 2490.0000 -172.56651 -163.25643 9.31009 2.61635 -164.58910 861.85863 2495.0000 -172.88149 -165.32443 7.55706 2.66463 -163.76131 901.93067 2500.0000 -173.15209 -165.71283 7.43926 2.53139 -166.04578 803.18982 FREEZING PROCESS: loop number 11 T-loop= 875.00000000000000 main_MD> interactions number 11 at Temperature= 875.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 2.50503 -1.27491 0.33387 force_rgl> df(natom) 0.97464 -0.02077 -1.46106 2505.0000 -172.04584 -165.17789 6.86795 2.58214 -165.17573 840.36430 2510.0000 -172.65735 -165.19897 7.45837 2.54448 -165.82136 807.73694 2515.0000 -171.15174 -162.32752 8.82422 2.64157 -164.15659 857.33559 2520.0000 -173.23720 -164.64850 8.58870 2.68994 -163.32724 881.80728 2525.0000 -172.31413 -164.94767 7.36646 2.56434 -165.48095 832.88377 2530.0000 -172.65825 -164.54010 8.11815 2.63728 -164.23016 866.78515 2535.0000 -172.27642 -163.31360 8.96282 2.69132 -163.30370 910.05948 2540.0000 -171.58259 -164.28504 7.29755 2.65310 -163.95904 874.22714 2545.0000 -171.37897 -162.35725 9.02172 2.74874 -162.31902 945.23446 2550.0000 -172.22942 -164.69196 7.53745 2.64111 -164.16458 874.16219 2555.0000 -171.80750 -164.15831 7.64919 2.67390 -163.60231 871.60345 2560.0000 -172.32224 -162.61835 9.70389 2.71543 -162.89016 914.59081 2565.0000 -172.03682 -164.95906 7.07777 2.64492 -164.09929 854.03734 2570.0000 -173.48627 -165.29660 8.18967 2.55736 -165.60062 821.24401 2575.0000 -172.73948 -164.07736 8.66211 2.62832 -164.38393 875.71641 2580.0000 -173.78487 -165.21358 8.57129 2.61320 -164.64302 840.35647 2585.0000 -173.21732 -164.84848 8.36884 2.59249 -164.99828 840.30613 2590.0000 -172.74943 -164.07156 8.67787 2.57402 -165.31491 832.27913 2595.0000 -171.67422 -164.26951 7.40470 2.62287 -164.47731 856.90506 2600.0000 -171.82171 -164.10243 7.71928 2.66469 -163.76018 872.93480 2605.0000 -172.18555 -165.08762 7.09793 2.62405 -164.45699 888.30054 2610.0000 -172.16156 -163.57461 8.58695 2.62887 -164.37433 868.00837 2615.0000 -171.88416 -164.19450 7.68966 2.65636 -163.90313 887.95939 2620.0000 -173.08850 -164.81519 8.27331 2.65531 -163.92110 899.30251 2625.0000 -171.52463 -163.50979 8.01483 2.62437 -164.45155 855.66426 2630.0000 -173.12506 -165.64061 7.48445 2.61410 -164.62771 841.68466 2635.0000 -174.07021 -165.46463 8.60557 2.50896 -166.43052 787.76350 2640.0000 -173.12640 -164.86274 8.26366 2.54806 -165.76007 816.40179 2645.0000 -171.12690 -163.64652 7.48037 2.65248 -163.96963 866.82817 2650.0000 -172.48515 -165.17376 7.31138 2.67212 -163.63290 882.31594 2655.0000 -173.41630 -165.40936 8.00694 2.61189 -164.66551 872.82296 2660.0000 -173.52307 -166.90447 6.61859 2.59207 -165.00549 845.37255 2665.0000 -172.06529 -163.71083 8.35447 2.56077 -165.54200 810.76088 2670.0000 -172.57695 -165.40585 7.17111 2.59427 -164.96764 821.63041 2675.0000 -172.81113 -165.63232 7.17882 2.59628 -164.93319 856.34331 2680.0000 -173.00703 -163.57013 9.43690 2.64788 -164.04852 883.39482 2685.0000 -171.38040 -163.14064 8.23976 2.66362 -163.77851 878.76879 2690.0000 -171.29710 -161.25209 10.04500 2.76106 -162.10776 944.25252 2695.0000 -171.82093 -163.18360 8.63734 2.72581 -162.71228 947.88905 2700.0000 -170.09450 -163.28852 6.80598 2.71443 -162.90742 923.27281 2705.0000 -171.41618 -163.95695 7.45923 2.68953 -163.33428 918.81982 2710.0000 -170.92206 -163.75426 7.16780 2.66942 -163.67920 910.17375 2715.0000 -173.97652 -166.84911 7.12740 2.58459 -165.13374 830.56701 2720.0000 -170.72230 -163.69196 7.03034 2.62057 -164.51679 872.81008 2725.0000 -172.71491 -163.83517 8.87974 2.69498 -163.24085 910.41102 2730.0000 -172.87748 -165.65206 7.22542 2.58791 -165.07671 864.74675 2735.0000 -173.37126 -163.83851 9.53275 2.59683 -164.92381 858.21867 2740.0000 -172.80019 -164.32276 8.47743 2.66820 -163.70011 897.86452 2745.0000 -171.15044 -163.09183 8.05862 2.65793 -163.87620 889.49065 2750.0000 -173.48432 -164.80132 8.68300 2.64583 -164.08360 873.94115 FREEZING PROCESS: loop number 12 T-loop= 850.00000000000000 main_MD> interactions number 12 at Temperature= 850.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -2.63381 -0.30510 -0.17311 force_rgl> df(natom) -0.70634 -1.30102 -1.69510 2755.0000 -171.91177 -164.52818 7.38360 2.62414 -164.45545 864.44858 2760.0000 -171.25720 -164.66557 6.59163 2.63141 -164.33081 852.66202 2765.0000 -172.56831 -162.79838 9.76993 2.68999 -163.32649 870.65110 2770.0000 -170.54276 -162.59729 7.94547 2.79160 -161.58412 959.90995 2775.0000 -171.81440 -164.68129 7.13311 2.63633 -164.24654 877.39846 2780.0000 -172.63798 -164.95823 7.67975 2.59982 -164.87248 840.15215 2785.0000 -173.24449 -164.68242 8.56207 2.61222 -164.65996 880.41796 2790.0000 -172.39222 -164.80722 7.58500 2.58797 -165.07562 854.99875 2795.0000 -172.91808 -165.47478 7.44330 2.55273 -165.67993 792.85685 2800.0000 -172.38387 -165.52848 6.85539 2.58489 -165.12858 846.02066 2805.0000 -172.35943 -165.21568 7.14375 2.56139 -165.53145 809.22062 2810.0000 -173.59893 -166.11695 7.48198 2.60222 -164.83141 865.54624 2815.0000 -170.78373 -163.47315 7.31058 2.60137 -164.84593 877.26874 2820.0000 -173.28846 -165.61305 7.67541 2.66525 -163.75071 888.63438 2825.0000 -170.81069 -163.54467 7.26602 2.65717 -163.88914 908.24540 2830.0000 -172.44660 -164.87454 7.57206 2.63371 -164.29146 872.54627 2835.0000 -172.27762 -164.75843 7.51919 2.59597 -164.93848 815.06029 2840.0000 -174.37357 -165.45463 8.91894 2.59958 -164.87657 834.50858 2845.0000 -174.03934 -167.41993 6.61941 2.51529 -166.32194 799.24851 2850.0000 -173.99025 -167.95221 6.03804 2.41086 -168.11250 745.56055 2855.0000 -172.89590 -165.39285 7.50305 2.46877 -167.11951 740.91660 2860.0000 -172.98434 -165.27330 7.71103 2.57706 -165.26280 802.73078 2865.0000 -173.08549 -165.09185 7.99365 2.57164 -165.35567 788.38800 2870.0000 -170.51767 -163.00948 7.50820 2.61975 -164.53080 875.62623 2875.0000 -173.54267 -166.43615 7.10653 2.61704 -164.57722 855.18880 2880.0000 -171.89373 -165.05300 6.84073 2.52588 -166.14027 814.00487 2885.0000 -173.35982 -165.23685 8.12298 2.60377 -164.80484 851.50293 2890.0000 -172.93776 -165.27944 7.65832 2.59525 -164.95095 852.83589 2895.0000 -173.37200 -165.84647 7.52554 2.59920 -164.88308 864.51930 2900.0000 -173.05272 -165.70363 7.34909 2.51191 -166.37986 744.54928 2905.0000 -172.28402 -164.38666 7.89736 2.60753 -164.74030 838.07881 2910.0000 -171.15093 -163.99397 7.15696 2.64745 -164.05582 846.53089 2915.0000 -170.66280 -161.72739 8.93541 2.73015 -162.63790 924.41220 2920.0000 -171.50765 -163.74349 7.76416 2.71370 -162.91993 916.83143 2925.0000 -173.40356 -165.52459 7.87897 2.56263 -165.51022 809.02791 2930.0000 -174.07111 -166.00451 8.06661 2.55609 -165.62228 839.13541 2935.0000 -171.56376 -164.88678 6.67698 2.58540 -165.11969 875.66210 2940.0000 -172.97854 -165.07110 7.90744 2.60511 -164.78184 855.79662 2945.0000 -174.15579 -166.42403 7.73176 2.52095 -166.22493 772.59448 2950.0000 -172.03657 -164.09050 7.94606 2.59139 -165.01708 828.33035 2955.0000 -171.86803 -164.93394 6.93409 2.63866 -164.20650 838.47306 2960.0000 -172.27903 -163.91938 8.35965 2.65544 -163.91885 885.37946 2965.0000 -171.62278 -162.80083 8.82195 2.69370 -163.26287 899.16840 2970.0000 -171.69226 -163.52132 8.17094 2.67461 -163.59006 906.85490 2975.0000 -173.48008 -166.02840 7.45168 2.61875 -164.54799 872.08873 2980.0000 -174.34684 -166.93935 7.40749 2.53702 -165.94926 844.09338 2985.0000 -172.53028 -165.19465 7.33563 2.53550 -165.97530 807.89129 2990.0000 -173.28974 -165.58182 7.70792 2.54836 -165.75491 830.04352 2995.0000 -172.60776 -165.71045 6.89731 2.53909 -165.91374 812.86627 3000.0000 -171.91142 -162.25943 9.65199 2.60691 -164.75087 859.59014 FREEZING PROCESS: loop number 13 T-loop= 825.00000000000000 main_MD> interactions number 13 at Temperature= 825.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -2.84413 -0.61112 -4.08671 force_rgl> df(natom) -1.51487 -1.15796 -1.48686 3005.0000 -172.95281 -165.09945 7.85336 2.66779 -163.70707 896.19599 3010.0000 -174.41396 -165.06178 9.35217 2.60050 -164.86092 855.32938 3015.0000 -171.98834 -163.79836 8.18997 2.60386 -164.80327 861.94893 3020.0000 -171.65277 -165.09326 6.55951 2.61338 -164.64008 818.46702 3025.0000 -173.06498 -164.62589 8.43909 2.55953 -165.56335 810.78760 3030.0000 -171.82892 -163.66730 8.16162 2.61815 -164.55819 872.16790 3035.0000 -173.35999 -165.60553 7.75447 2.62941 -164.36523 889.64656 3040.0000 -173.61161 -165.47596 8.13566 2.58793 -165.07646 830.30026 3045.0000 -172.52106 -165.53205 6.98901 2.55708 -165.60532 812.21149 3050.0000 -171.47622 -163.39833 8.07789 2.60026 -164.86498 824.44422 3055.0000 -171.96086 -164.25836 7.70250 2.63295 -164.30451 830.63297 3060.0000 -172.92144 -164.86110 8.06034 2.64826 -164.04188 861.83309 3065.0000 -173.28864 -164.49633 8.79231 2.61633 -164.58945 861.38814 3070.0000 -172.31108 -165.04585 7.26523 2.59443 -164.96491 876.14959 3075.0000 -174.73413 -167.32209 7.41204 2.54879 -165.74742 790.14786 3080.0000 -171.80980 -164.68694 7.12286 2.48882 -166.77576 782.15288 3085.0000 -173.37308 -164.90633 8.46676 2.57666 -165.26967 831.65475 3090.0000 -172.90451 -165.46833 7.43618 2.57036 -165.37763 810.50001 3095.0000 -173.11075 -166.35199 6.75876 2.55921 -165.56891 801.68593 3100.0000 -173.30330 -165.76572 7.53758 2.53289 -166.02008 798.41054 3105.0000 -172.84954 -165.47593 7.37360 2.57696 -165.26445 813.49809 3110.0000 -174.02230 -166.82614 7.19616 2.51661 -166.29923 802.08670 3115.0000 -172.72460 -165.61071 7.11389 2.55669 -165.61201 815.94423 3120.0000 -172.68009 -164.53411 8.14597 2.58855 -165.06584 799.41228 3125.0000 -173.62253 -164.96459 8.65794 2.63398 -164.28685 847.74281 3130.0000 -174.06572 -167.27761 6.78811 2.49625 -166.64840 770.43434 3135.0000 -171.22661 -163.74168 7.48493 2.55506 -165.63991 819.57205 3140.0000 -171.79885 -164.60581 7.19305 2.66099 -163.82363 882.87423 3145.0000 -170.49124 -162.30473 8.18651 2.70189 -163.12241 892.56284 3150.0000 -170.89299 -163.75165 7.14134 2.70431 -163.08088 913.94377 3155.0000 -174.52001 -167.27630 7.24371 2.60038 -164.86299 890.15584 3160.0000 -174.34627 -167.24156 7.10472 2.45175 -167.41132 753.20938 3165.0000 -174.03290 -166.22713 7.80576 2.49198 -166.72163 785.19786 3170.0000 -173.38037 -165.08575 8.29462 2.55651 -165.61521 835.26134 3175.0000 -171.61894 -163.82966 7.78928 2.62539 -164.43417 869.55873 3180.0000 -175.08250 -168.93071 6.15179 2.50637 -166.47477 791.80377 3185.0000 -172.26478 -164.42670 7.83808 2.47338 -167.04046 768.41209 3190.0000 -172.01264 -165.75923 6.25341 2.57926 -165.22498 840.52296 3195.0000 -173.23216 -167.02358 6.20859 2.47996 -166.92776 748.35851 3200.0000 -172.97949 -165.71827 7.26122 2.49578 -166.65636 786.48509 3205.0000 -173.30066 -165.27712 8.02355 2.59236 -165.00035 857.70879 3210.0000 -172.20637 -165.08321 7.12316 2.63263 -164.30990 865.18432 3215.0000 -171.98389 -164.57625 7.40764 2.59759 -164.91083 841.13960 3220.0000 -172.76672 -165.14040 7.62631 2.59188 -165.00873 824.50537 3225.0000 -172.73861 -164.61079 8.12782 2.60875 -164.71944 842.31263 3230.0000 -172.23770 -165.15144 7.08625 2.58624 -165.10541 829.59451 3235.0000 -173.31370 -164.93620 8.37750 2.57284 -165.33514 826.62146 3240.0000 -172.39652 -164.17005 8.22647 2.62520 -164.43727 862.94827 3245.0000 -171.89294 -164.53231 7.36063 2.58368 -165.14933 827.84673 3250.0000 -170.55448 -163.43511 7.11937 2.65775 -163.87929 906.58662 FREEZING PROCESS: loop number 14 T-loop= 800.00000000000000 main_MD> interactions number 14 at Temperature= 800.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 0.99856 -0.52940 -0.85751 force_rgl> df(natom) -1.56547 1.00581 -1.27067 3255.0000 -172.20740 -164.12894 8.07846 2.62812 -164.38723 882.09084 3260.0000 -172.45983 -165.30475 7.15508 2.57811 -165.24474 858.30413 3265.0000 -173.05988 -165.59584 7.46404 2.53676 -165.95385 791.05324 3270.0000 -172.01232 -165.03763 6.97469 2.57011 -165.38199 794.40233 3275.0000 -171.71799 -164.32584 7.39215 2.56884 -165.40368 822.73646 3280.0000 -172.59322 -165.03081 7.56242 2.60552 -164.77479 837.53907 3285.0000 -171.63349 -164.71843 6.91506 2.58740 -165.08541 810.63577 3290.0000 -172.63620 -165.25924 7.37696 2.58347 -165.15281 841.16745 3295.0000 -174.00410 -166.89960 7.10450 2.53103 -166.05209 822.29441 3300.0000 -173.63422 -166.10723 7.52699 2.52181 -166.21010 794.43019 3305.0000 -173.91624 -167.77266 6.14358 2.50081 -166.57021 802.50292 3310.0000 -172.78405 -166.50015 6.28390 2.52110 -166.22224 782.75176 3315.0000 -171.77099 -164.54655 7.22444 2.57821 -165.24300 830.64374 3320.0000 -174.29591 -166.17624 8.11967 2.53242 -166.02814 811.88120 3325.0000 -174.71471 -167.89167 6.82304 2.46865 -167.12158 788.96286 3330.0000 -174.05706 -166.60927 7.44780 2.45157 -167.41452 745.20901 3335.0000 -173.51276 -166.83744 6.67532 2.51029 -166.40765 787.26950 3340.0000 -174.59180 -166.97693 7.61487 2.44487 -167.52928 733.29366 3345.0000 -175.09192 -168.33460 6.75732 2.41235 -168.08692 739.52137 3350.0000 -174.85797 -166.22379 8.63418 2.45729 -167.31644 763.43580 3355.0000 -173.38985 -166.38271 7.00714 2.47998 -166.92730 741.22493 3360.0000 -174.12234 -165.10224 9.02010 2.55216 -165.68966 831.97930 3365.0000 -174.38146 -167.76596 6.61550 2.51635 -166.30381 802.23930 3370.0000 -173.54940 -167.03369 6.51572 2.46105 -167.25197 725.06029 3375.0000 -174.11993 -168.07161 6.04832 2.46015 -167.26733 749.27932 3380.0000 -172.69538 -166.14238 6.55300 2.45479 -167.35918 726.24074 3385.0000 -172.83039 -165.42360 7.40679 2.55946 -165.56456 809.57711 3390.0000 -173.92071 -165.75260 8.16811 2.57986 -165.21481 811.46301 3395.0000 -174.02492 -166.77052 7.25441 2.51124 -166.39141 796.81737 3400.0000 -172.55458 -165.22727 7.32731 2.55769 -165.59483 801.65915 3405.0000 -172.99040 -165.25254 7.73786 2.62673 -164.41115 895.56680 3410.0000 -172.96244 -165.97118 6.99127 2.62252 -164.48337 862.30081 3415.0000 -174.06036 -166.52333 7.53703 2.53506 -165.98291 804.12352 3420.0000 -173.68469 -166.44820 7.23649 2.50424 -166.51130 816.31140 3425.0000 -172.87069 -165.61684 7.25385 2.55653 -165.61471 829.74188 3430.0000 -173.93512 -167.28903 6.64609 2.56194 -165.52197 818.67653 3435.0000 -174.52843 -167.66877 6.85966 2.47966 -166.93290 780.48951 3440.0000 -172.89643 -166.23914 6.65729 2.46225 -167.23142 761.36509 3445.0000 -174.32153 -167.03520 7.28633 2.48611 -166.82227 779.22898 3450.0000 -174.03076 -166.51935 7.51141 2.46735 -167.14392 755.84429 3455.0000 -172.78513 -164.56118 8.22394 2.55690 -165.60840 817.88362 3460.0000 -173.44956 -167.09004 6.35951 2.56866 -165.40675 809.52954 3465.0000 -173.71334 -167.45239 6.26095 2.45596 -167.33913 758.38919 3470.0000 -173.23181 -165.43042 7.80139 2.53561 -165.97347 786.84501 3475.0000 -173.55756 -165.25751 8.30005 2.56280 -165.50721 836.89201 3480.0000 -174.29790 -167.07050 7.22740 2.52824 -166.09981 819.89228 3485.0000 -173.18228 -166.66219 6.52009 2.46940 -167.10880 761.50214 3490.0000 -172.38958 -164.00277 8.38681 2.51548 -166.31856 786.42200 3495.0000 -172.54928 -165.33520 7.21407 2.61251 -164.65496 856.39616 3500.0000 -171.80403 -165.00936 6.79467 2.63881 -164.20405 871.30679 FREEZING PROCESS: loop number 15 T-loop= 775.00000000000000 main_MD> interactions number 15 at Temperature= 775.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -0.88820 -0.09722 -1.59008 force_rgl> df(natom) 0.78530 0.82868 -0.53995 3505.0000 -173.11191 -164.84587 8.26604 2.62751 -164.39772 873.70858 3510.0000 -172.17039 -164.91031 7.26008 2.61652 -164.58625 809.26901 3515.0000 -172.75875 -165.60032 7.15844 2.61860 -164.55046 796.83587 3520.0000 -174.15222 -166.65477 7.49745 2.52520 -166.15198 783.81413 3525.0000 -172.38951 -164.70225 7.68726 2.53928 -165.91058 797.42442 3530.0000 -173.54236 -166.45597 7.08639 2.54422 -165.82591 826.02114 3535.0000 -174.55750 -166.80147 7.75603 2.50023 -166.58017 805.89029 3540.0000 -172.94199 -165.71861 7.22338 2.49802 -166.61795 784.68761 3545.0000 -172.93947 -165.06110 7.87838 2.61714 -164.57558 849.17364 3550.0000 -173.32708 -165.26958 8.05750 2.53311 -166.01641 793.04914 3555.0000 -173.87882 -165.86655 8.01227 2.54797 -165.76164 814.01141 3560.0000 -174.22421 -167.55077 6.67344 2.44584 -167.51279 755.78121 3565.0000 -175.43653 -167.85696 7.57957 2.44824 -167.47163 771.43676 3570.0000 -175.69562 -168.97278 6.72284 2.44008 -167.61145 760.70112 3575.0000 -175.80822 -168.54181 7.26640 2.37649 -168.70180 727.83418 3580.0000 -173.44110 -165.64937 7.79173 2.48126 -166.90547 776.82228 3585.0000 -174.31512 -167.32567 6.98945 2.45832 -167.29880 745.67401 3590.0000 -173.74870 -166.80630 6.94240 2.48676 -166.81105 763.84826 3595.0000 -174.61097 -166.99410 7.61687 2.46643 -167.15971 752.62782 3600.0000 -174.09293 -166.56717 7.52576 2.51135 -166.38941 773.67028 3605.0000 -174.97697 -168.23062 6.74635 2.43758 -167.65440 738.60779 3610.0000 -173.63088 -166.87204 6.75884 2.45998 -167.27024 753.98768 3615.0000 -175.16059 -168.38764 6.77295 2.42369 -167.89251 736.51085 3620.0000 -173.92122 -166.67347 7.24775 2.46755 -167.14039 793.85035 3625.0000 -173.70892 -167.52383 6.18508 2.49859 -166.60822 806.09408 3630.0000 -174.63128 -167.96359 6.66769 2.44006 -167.61174 750.23977 3635.0000 -174.60332 -167.84073 6.76259 2.40578 -168.19968 743.12981 3640.0000 -175.33736 -168.28666 7.05070 2.45351 -167.38121 755.58640 3645.0000 -173.47638 -166.27950 7.19689 2.43782 -167.65030 733.77286 3650.0000 -173.18826 -166.48699 6.70128 2.54785 -165.76366 815.07555 3655.0000 -173.06820 -165.67290 7.39530 2.56693 -165.43639 808.45927 3660.0000 -173.13072 -166.90514 6.22558 2.54833 -165.75547 810.75387 3665.0000 -171.56344 -165.78245 5.78099 2.55696 -165.60744 797.85991 3670.0000 -173.33704 -166.07861 7.25843 2.52031 -166.23576 774.57342 3675.0000 -173.80827 -165.92789 7.88038 2.52067 -166.22973 774.61033 3680.0000 -174.97012 -168.17815 6.79197 2.46782 -167.13588 778.58632 3685.0000 -175.29191 -168.58885 6.70306 2.42344 -167.89677 750.50008 3690.0000 -174.93812 -168.41369 6.52443 2.41704 -168.00662 710.75566 3695.0000 -173.21599 -166.53934 6.67664 2.46134 -167.24688 763.20088 3700.0000 -174.13491 -166.62648 7.50843 2.51486 -166.32921 806.63247 3705.0000 -174.25475 -166.51541 7.73934 2.51176 -166.38244 785.03778 3710.0000 -173.71669 -167.18081 6.53588 2.48379 -166.86193 777.79792 3715.0000 -174.79635 -168.11036 6.68599 2.41353 -168.06672 704.21477 3720.0000 -173.97240 -166.68927 7.28313 2.47827 -166.95661 767.72917 3725.0000 -173.39619 -166.61529 6.78090 2.52317 -166.18684 794.30565 3730.0000 -174.90579 -168.45036 6.45543 2.41725 -168.00291 721.23922 3735.0000 -175.50955 -168.55214 6.95740 2.38384 -168.57571 694.03705 3740.0000 -175.91488 -170.38544 5.52944 2.34847 -169.18223 671.32862 3745.0000 -175.23039 -168.58798 6.64241 2.33862 -169.35116 685.23776 3750.0000 -174.01825 -166.87549 7.14276 2.46072 -167.25758 759.77624 FREEZING PROCESS: loop number 16 T-loop= 750.00000000000000 main_MD> interactions number 16 at Temperature= 750.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -0.49256 4.60120 0.32819 force_rgl> df(natom) 0.09595 1.55715 1.13373 3755.0000 -172.85258 -166.29347 6.55911 2.52741 -166.11402 820.63101 3760.0000 -173.46002 -166.27766 7.18235 2.52979 -166.07324 786.83513 3765.0000 -175.10512 -166.99966 8.10546 2.52046 -166.23318 799.83181 3770.0000 -173.80917 -167.15189 6.65728 2.46320 -167.21511 772.82398 3775.0000 -173.02777 -166.49412 6.53365 2.52503 -166.15486 802.02140 3780.0000 -173.93239 -167.79502 6.13737 2.46387 -167.20351 754.89296 3785.0000 -173.64503 -166.50689 7.13814 2.44967 -167.44697 749.06934 3790.0000 -174.28863 -166.85195 7.43668 2.51044 -166.40509 778.89597 3795.0000 -174.15120 -168.26301 5.88819 2.41539 -168.03479 732.58696 3800.0000 -174.03848 -166.71079 7.32769 2.46866 -167.12136 759.01588 3805.0000 -174.33812 -167.12819 7.20993 2.50432 -166.50998 787.29035 3810.0000 -174.30130 -167.74928 6.55202 2.44456 -167.53460 742.85106 3815.0000 -174.36287 -167.11628 7.24659 2.44786 -167.47816 741.27702 3820.0000 -173.47020 -166.07087 7.39933 2.46353 -167.20935 762.95909 3825.0000 -173.84253 -167.21468 6.62784 2.47379 -167.03352 769.74869 3830.0000 -174.65972 -167.61874 7.04098 2.42844 -167.81109 721.62517 3835.0000 -173.79430 -166.63241 7.16189 2.44590 -167.51177 748.51273 3840.0000 -174.70620 -167.81973 6.88647 2.47306 -167.04600 767.30236 3845.0000 -174.55154 -168.69285 5.85868 2.40087 -168.28374 713.79601 3850.0000 -175.44208 -168.94678 6.49530 2.37109 -168.79444 733.33000 3855.0000 -175.09171 -168.58107 6.51064 2.40706 -168.17757 745.27541 3860.0000 -174.80643 -168.81858 5.98785 2.38535 -168.54994 712.24562 3865.0000 -173.88014 -167.39436 6.48578 2.42640 -167.84604 719.11160 3870.0000 -173.10586 -166.36235 6.74351 2.51064 -166.40168 782.41540 3875.0000 -174.01950 -167.22995 6.78955 2.51128 -166.39063 759.29788 3880.0000 -173.89003 -166.96676 6.92327 2.48761 -166.79659 750.14370 3885.0000 -173.27828 -165.99812 7.28017 2.51384 -166.34668 770.62916 3890.0000 -173.00027 -167.03814 5.96213 2.49317 -166.70120 778.30651 3895.0000 -174.46376 -168.53372 5.93004 2.41394 -168.05962 716.70832 3900.0000 -173.24201 -165.20247 8.03954 2.47408 -167.02849 753.60937 3905.0000 -173.99628 -166.22183 7.77445 2.52147 -166.21597 784.11855 3910.0000 -175.00231 -167.35831 7.64400 2.50657 -166.47135 783.79527 3915.0000 -173.98149 -167.70528 6.27621 2.41386 -168.06107 722.72075 3920.0000 -174.80862 -167.77290 7.03572 2.40751 -168.17000 733.04444 3925.0000 -173.64158 -166.33332 7.30826 2.48377 -166.86237 779.03240 3930.0000 -174.86930 -168.84279 6.02650 2.42270 -167.90950 733.62591 3935.0000 -174.27183 -167.09920 7.17263 2.43082 -167.77018 715.62282 3940.0000 -174.70926 -169.00390 5.70536 2.36037 -168.97824 684.54069 3945.0000 -174.73851 -168.08238 6.65613 2.41951 -167.96423 715.73014 3950.0000 -172.67305 -165.39353 7.27952 2.47787 -166.96357 762.12200 3955.0000 -173.96638 -166.42989 7.53649 2.51905 -166.25747 809.95376 3960.0000 -172.94567 -165.60558 7.34009 2.50239 -166.54314 799.75356 3965.0000 -173.47923 -167.20955 6.26968 2.53014 -166.06723 795.75037 3970.0000 -175.00111 -168.47806 6.52305 2.40387 -168.23237 703.37638 3975.0000 -174.99755 -168.12115 6.87640 2.37557 -168.71767 715.16963 3980.0000 -173.62239 -167.27899 6.34340 2.45467 -167.36128 748.49403 3985.0000 -174.20380 -167.94426 6.25955 2.45463 -167.36200 766.13108 3990.0000 -173.73875 -166.91923 6.81951 2.44078 -167.59953 751.77024 3995.0000 -174.21793 -166.83344 7.38449 2.46847 -167.12462 733.03471 4000.0000 -173.53297 -164.22177 9.31120 2.59015 -165.03834 848.38048 FREEZING PROCESS: loop number 17 T-loop= 725.00000000000000 main_MD> interactions number 17 at Temperature= 725.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -1.98685 -1.35164 -0.08798 force_rgl> df(natom) -2.65008 -1.30622 0.91956 4005.0000 -174.50610 -166.02735 8.47874 2.54666 -165.78402 800.78320 4010.0000 -175.09312 -168.31566 6.77745 2.46496 -167.18483 780.05953 4015.0000 -174.75222 -166.90072 7.85150 2.44375 -167.54856 737.99299 4020.0000 -174.75021 -168.57222 6.17799 2.46438 -167.19481 752.00433 4025.0000 -176.55927 -170.73497 5.82430 2.35140 -169.13195 674.98692 4030.0000 -174.42825 -168.30660 6.12164 2.34256 -169.28353 658.49999 4035.0000 -174.99262 -168.28236 6.71027 2.37594 -168.71117 702.05560 4040.0000 -173.85503 -167.90698 5.94804 2.40418 -168.22697 708.41363 4045.0000 -173.86868 -166.14209 7.72659 2.47515 -167.01013 742.52421 4050.0000 -174.92088 -167.31774 7.60314 2.47505 -167.01194 763.70422 4055.0000 -174.78639 -168.27790 6.50849 2.41267 -168.08154 719.71105 4060.0000 -175.34514 -167.99106 7.35408 2.39586 -168.36977 716.67739 4065.0000 -174.62235 -168.59532 6.02702 2.42092 -167.93995 703.54967 4070.0000 -176.47083 -169.30967 7.16116 2.36902 -168.82995 698.09530 4075.0000 -175.98479 -168.80915 7.17564 2.36823 -168.84338 693.64420 4080.0000 -174.57256 -167.56403 7.00853 2.39470 -168.38963 691.91312 4085.0000 -173.75751 -167.52292 6.23459 2.46383 -167.20419 792.62697 4090.0000 -173.60331 -166.69680 6.90650 2.46963 -167.10488 751.91589 4095.0000 -173.20298 -167.16341 6.03957 2.51215 -166.37572 795.07984 4100.0000 -174.22876 -166.37093 7.85784 2.47813 -166.95912 745.39046 4105.0000 -173.10899 -166.19020 6.91879 2.52574 -166.14266 799.56232 4110.0000 -174.83399 -167.78155 7.05245 2.46087 -167.25505 751.52241 4115.0000 -175.15846 -167.89522 7.26324 2.41217 -168.09010 735.32675 4120.0000 -175.58497 -167.70166 7.88331 2.43706 -167.66332 739.68201 4125.0000 -174.43540 -167.35123 7.08417 2.45129 -167.41923 751.66088 4130.0000 -174.86675 -168.09078 6.77598 2.41090 -168.11174 726.41817 4135.0000 -173.92227 -168.14790 5.77437 2.42365 -167.89321 709.92387 4140.0000 -172.52096 -165.05202 7.46894 2.48737 -166.80060 769.37728 4145.0000 -173.43775 -166.96963 6.46812 2.49893 -166.60248 760.71424 4150.0000 -172.96316 -167.55018 5.41298 2.47414 -167.02752 752.63040 4155.0000 -174.22751 -166.63655 7.59096 2.45903 -167.28657 746.50711 4160.0000 -174.24522 -168.04656 6.19866 2.46315 -167.21586 742.75981 4165.0000 -174.18572 -167.27066 6.91506 2.41914 -167.97050 713.58013 4170.0000 -174.89786 -166.87268 8.02518 2.46891 -167.11708 768.14402 4175.0000 -174.38069 -168.15430 6.22639 2.44117 -167.59287 758.50574 4180.0000 -174.58746 -168.82967 5.75778 2.36104 -168.96667 688.98810 4185.0000 -174.76498 -168.58894 6.17604 2.38755 -168.51210 717.59225 4190.0000 -175.87421 -169.40715 6.46706 2.36668 -168.87000 702.33913 4195.0000 -175.60196 -169.45764 6.14432 2.38138 -168.61791 702.50144 4200.0000 -175.61005 -168.68147 6.92858 2.37199 -168.77903 698.78917 4205.0000 -174.68831 -168.60192 6.08639 2.37197 -168.77925 687.67545 4210.0000 -174.09099 -167.33820 6.75279 2.46010 -167.26818 747.12881 4215.0000 -174.85964 -167.32383 7.53581 2.42972 -167.78910 733.73000 4220.0000 -174.64330 -168.54822 6.09508 2.41145 -168.10237 720.23914 4225.0000 -174.98687 -168.02711 6.95976 2.41784 -167.99289 721.60912 4230.0000 -175.45092 -168.03339 7.41753 2.38932 -168.48178 735.91978 4235.0000 -175.50756 -168.39396 7.11359 2.40011 -168.29682 731.15515 4240.0000 -173.96624 -166.85929 7.10696 2.44459 -167.53410 748.64871 4245.0000 -173.21595 -166.96600 6.24996 2.50833 -166.44122 769.50614 4250.0000 -174.58841 -168.45414 6.13428 2.44670 -167.49799 721.36966 FREEZING PROCESS: loop number 18 T-loop= 700.00000000000000 main_MD> interactions number 18 at Temperature= 700.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -2.05538 -2.70848 3.37227 force_rgl> df(natom) 1.11229 1.25287 0.30354 4255.0000 -175.74947 -168.48321 7.26625 2.37138 -168.78945 703.79759 4260.0000 -174.57592 -167.97515 6.60077 2.41367 -168.06429 714.40396 4265.0000 -175.66020 -169.40754 6.25266 2.39705 -168.34931 719.56399 4270.0000 -175.30027 -168.83872 6.46155 2.35602 -169.05289 675.26841 4275.0000 -173.86101 -168.03838 5.82263 2.38684 -168.52430 691.29904 4280.0000 -175.51255 -168.13376 7.37879 2.41249 -168.08453 739.98025 4285.0000 -174.11915 -167.67484 6.44431 2.44044 -167.60523 758.85610 4290.0000 -174.04704 -167.54783 6.49921 2.43538 -167.69202 751.00295 4295.0000 -174.61588 -168.29518 6.32070 2.43405 -167.71493 714.66169 4300.0000 -176.28026 -168.76328 7.51698 2.36694 -168.86560 716.00233 4305.0000 -176.79093 -170.94487 5.84606 2.29464 -170.10528 681.17908 4310.0000 -176.10154 -170.42782 5.67372 2.26589 -170.59815 631.64219 4315.0000 -175.17964 -169.46563 5.71400 2.27016 -170.52502 631.14582 4320.0000 -174.42071 -167.71616 6.70455 2.37660 -168.69988 731.18665 4325.0000 -174.85924 -168.73459 6.12466 2.38531 -168.55060 727.38303 4330.0000 -176.21867 -169.67059 6.54809 2.33454 -169.42107 688.24149 4335.0000 -175.47342 -168.79921 6.67422 2.33177 -169.46855 673.65256 4340.0000 -175.45645 -169.32111 6.13534 2.36415 -168.91348 706.82685 4345.0000 -176.15125 -170.30011 5.85114 2.28579 -170.25708 635.36095 4350.0000 -175.82896 -170.04328 5.78568 2.31762 -169.71119 639.24276 4355.0000 -175.32189 -169.02068 6.30121 2.33679 -169.38252 676.92523 4360.0000 -174.59596 -168.97898 5.61698 2.40482 -168.21600 709.93734 4365.0000 -175.78553 -168.83516 6.95037 2.38689 -168.52353 700.40817 4370.0000 -175.20398 -169.02926 6.17472 2.40267 -168.25299 721.01360 4375.0000 -175.13813 -168.93746 6.20067 2.36299 -168.93333 679.76383 4380.0000 -174.28140 -169.22301 5.05839 2.30654 -169.90123 638.48914 4385.0000 -174.76664 -168.25062 6.51602 2.36219 -168.94697 636.32402 4390.0000 -174.25418 -168.62015 5.63403 2.40814 -168.15918 704.85085 4395.0000 -173.32049 -167.48412 5.83637 2.41618 -168.02129 726.64832 4400.0000 -174.78156 -169.09685 5.68470 2.40613 -168.19353 722.06579 4405.0000 -176.15745 -168.20962 7.94783 2.36388 -168.91799 706.57527 4410.0000 -173.78779 -167.59729 6.19050 2.39518 -168.38143 745.50074 4415.0000 -174.03917 -167.56081 6.47836 2.49169 -166.72655 791.09239 4420.0000 -174.63132 -168.50176 6.12956 2.39475 -168.38867 738.41861 4425.0000 -175.22604 -169.01028 6.21576 2.38899 -168.48744 687.08369 4430.0000 -173.94617 -167.57130 6.37487 2.38506 -168.55482 680.82581 4435.0000 -174.70195 -167.85523 6.84672 2.46831 -167.12748 763.57972 4440.0000 -173.83081 -168.04229 5.78852 2.43232 -167.74460 747.79590 4445.0000 -174.94011 -169.65542 5.28469 2.37515 -168.72483 712.62668 4450.0000 -176.10045 -169.59355 6.50690 2.30634 -169.90463 657.18906 4455.0000 -176.53634 -169.73127 6.80506 2.36863 -168.83664 706.03528 4460.0000 -175.78747 -168.67389 7.11358 2.34950 -169.16463 690.82753 4465.0000 -173.38334 -167.02801 6.35534 2.42641 -167.84594 706.90288 4470.0000 -174.24911 -166.82885 7.42025 2.47533 -167.00716 765.34942 4475.0000 -174.75000 -167.97887 6.77113 2.45847 -167.29609 756.33452 4480.0000 -174.70359 -167.83144 6.87215 2.41011 -168.12536 722.49276 4485.0000 -174.42218 -169.04348 5.37869 2.40818 -168.15846 723.24764 4490.0000 -174.41600 -167.75774 6.65826 2.39944 -168.30839 712.52386 4495.0000 -174.45702 -168.03085 6.42618 2.41559 -168.03144 715.68084 4500.0000 -174.22793 -168.37615 5.85178 2.39388 -168.40365 686.37321 FREEZING PROCESS: loop number 19 T-loop= 675.00000000000000 main_MD> interactions number 19 at Temperature= 675.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -2.39954 -2.05953 -1.38684 force_rgl> df(natom) 4.28532 -2.35718 1.47925 4505.0000 -175.71854 -169.29996 6.41857 2.37010 -168.81131 688.73229 4510.0000 -175.65193 -169.36089 6.29103 2.35207 -169.12053 669.43689 4515.0000 -175.72078 -170.36003 5.36075 2.32350 -169.61048 646.21385 4520.0000 -176.90613 -171.32976 5.57637 2.24877 -170.89167 613.05169 4525.0000 -175.42404 -169.96735 5.45668 2.26667 -170.58482 640.91423 4530.0000 -175.22652 -169.52139 5.70513 2.31218 -169.80442 666.10860 4535.0000 -176.99044 -170.12557 6.86487 2.31727 -169.71717 668.74604 4540.0000 -175.57469 -169.44471 6.12998 2.35247 -169.11375 661.93015 4545.0000 -175.39913 -168.61603 6.78310 2.37784 -168.67875 724.30716 4550.0000 -174.92513 -167.79016 7.13497 2.39218 -168.43281 726.04922 4555.0000 -174.13770 -168.13227 6.00544 2.38824 -168.50028 699.55290 4560.0000 -175.70726 -169.20904 6.49823 2.35149 -169.13054 679.05887 4565.0000 -176.26494 -169.98028 6.28466 2.36111 -168.96559 694.65549 4570.0000 -175.21668 -168.80952 6.40716 2.30326 -169.95738 661.14532 4575.0000 -175.49396 -169.77768 5.71628 2.33492 -169.41459 669.38934 4580.0000 -176.39083 -169.75894 6.63189 2.31360 -169.78008 637.51281 4585.0000 -175.18908 -169.14721 6.04187 2.33796 -169.36253 682.94523 4590.0000 -175.47299 -169.02683 6.44615 2.33941 -169.33768 661.56017 4595.0000 -174.23084 -168.54255 5.68828 2.36796 -168.84815 698.19675 4600.0000 -175.31326 -168.85177 6.46150 2.37236 -168.77266 672.78811 4605.0000 -174.93497 -166.79205 8.14292 2.41180 -168.09639 730.12280 4610.0000 -175.97235 -168.50741 7.46495 2.41532 -168.03609 755.68057 4615.0000 -177.22185 -170.17577 7.04608 2.32139 -169.64664 717.79513 4620.0000 -176.40024 -170.32997 6.07027 2.27528 -170.43713 666.95690 4625.0000 -174.66019 -169.30457 5.35562 2.34011 -169.32565 680.50556 4630.0000 -176.37875 -170.71129 5.66746 2.30731 -169.88804 649.77641 4635.0000 -175.61044 -170.00331 5.60713 2.29746 -170.05693 663.89061 4640.0000 -176.32649 -169.34394 6.98255 2.35229 -169.11681 707.65231 4645.0000 -176.47633 -169.92308 6.55325 2.30755 -169.88381 662.12173 4650.0000 -175.87751 -169.59179 6.28572 2.32047 -169.66237 649.49020 4655.0000 -175.13068 -169.92125 5.20943 2.31810 -169.70300 642.69793 4660.0000 -176.94694 -170.21749 6.72945 2.31584 -169.74169 627.73751 4665.0000 -176.22414 -170.13395 6.09019 2.27773 -170.39515 640.18098 4670.0000 -176.33089 -168.82795 7.50293 2.30396 -169.94551 674.18489 4675.0000 -174.91401 -168.14733 6.76669 2.38864 -168.49354 707.04122 4680.0000 -175.30651 -169.01346 6.29304 2.38315 -168.58757 689.92079 4685.0000 -176.13767 -169.93938 6.19829 2.35140 -169.13208 699.27362 4690.0000 -175.97830 -169.24855 6.72975 2.29583 -170.08479 654.55982 4695.0000 -174.30346 -169.08192 5.22154 2.32126 -169.64877 665.68110 4700.0000 -176.08061 -170.30319 5.77742 2.30218 -169.97596 648.27114 4705.0000 -174.93581 -169.14943 5.78639 2.28084 -170.34180 597.97838 4710.0000 -175.84517 -169.66249 6.18268 2.34717 -169.20457 674.43841 4715.0000 -176.03681 -170.08511 5.95171 2.33389 -169.43221 673.59861 4720.0000 -176.07832 -169.04088 7.03745 2.30605 -169.90963 666.19936 4725.0000 -176.06305 -170.43105 5.63200 2.30952 -169.85010 658.47049 4730.0000 -175.32345 -169.70094 5.62251 2.27232 -170.48792 637.34633 4735.0000 -175.22709 -170.41770 4.80939 2.33310 -169.44587 653.91288 4740.0000 -174.89088 -169.13040 5.76047 2.31913 -169.68530 660.17944 4745.0000 -176.52593 -170.53032 5.99561 2.32269 -169.62431 659.47414 4750.0000 -177.81940 -172.48506 5.33434 2.19096 -171.88295 583.00752 FREEZING PROCESS: loop number 20 T-loop= 650.00000000000000 main_MD> interactions number 20 at Temperature= 650.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -0.42544 -1.89814 2.39558 force_rgl> df(natom) 0.71261 0.42833 -0.78343 4755.0000 -175.76245 -169.69043 6.07202 2.27598 -170.42517 632.21701 4760.0000 -175.01538 -168.87361 6.14177 2.32921 -169.51245 678.07563 4765.0000 -176.51569 -170.39410 6.12160 2.31037 -169.83549 642.62592 4770.0000 -175.05816 -169.50991 5.54825 2.31658 -169.72912 639.08311 4775.0000 -176.06056 -168.97705 7.08350 2.32178 -169.63982 675.41478 4780.0000 -176.00179 -169.77991 6.22189 2.35161 -169.12839 689.00196 4785.0000 -176.08670 -169.81367 6.27303 2.27910 -170.37167 631.60813 4790.0000 -176.53266 -170.08795 6.44471 2.28655 -170.24405 662.93628 4795.0000 -177.12397 -170.45717 6.66679 2.26218 -170.66174 634.24485 4800.0000 -174.99493 -169.34803 5.64690 2.30238 -169.97256 650.90452 4805.0000 -176.38308 -169.42822 6.95486 2.33109 -169.48035 666.34740 4810.0000 -176.44636 -170.56827 5.87809 2.33160 -169.47148 689.08952 4815.0000 -176.30381 -170.17787 6.12594 2.30421 -169.94122 675.17370 4820.0000 -175.67214 -170.24194 5.43019 2.31264 -169.79662 658.86094 4825.0000 -175.34253 -169.82500 5.51753 2.27974 -170.36068 619.99899 4830.0000 -174.64618 -167.80844 6.83774 2.39987 -168.30100 712.89350 4835.0000 -175.62709 -169.17467 6.45242 2.36463 -168.90513 663.77224 4840.0000 -175.55853 -169.23050 6.32804 2.32836 -169.52711 637.40427 4845.0000 -176.05403 -168.93332 7.12071 2.36184 -168.95303 705.04223 4850.0000 -175.29509 -168.70342 6.59168 2.34745 -169.19978 697.34272 4855.0000 -176.03434 -169.58735 6.44699 2.35536 -169.06412 697.38108 4860.0000 -173.74211 -167.09472 6.64739 2.40519 -168.20964 698.11528 4865.0000 -175.03736 -168.34054 6.69683 2.43381 -167.71898 728.26171 4870.0000 -175.65652 -169.76003 5.89649 2.36354 -168.92392 668.12859 4875.0000 -175.03929 -169.27601 5.76328 2.31109 -169.82315 645.60170 4880.0000 -175.21723 -168.42532 6.79191 2.35383 -169.09035 656.48636 4885.0000 -176.10135 -169.46497 6.63638 2.34389 -169.26080 675.04366 4890.0000 -177.10398 -171.01357 6.09041 2.25686 -170.75301 626.97298 4895.0000 -176.41984 -171.38332 5.03652 2.22310 -171.33188 631.01900 4900.0000 -176.74125 -170.24509 6.49616 2.25283 -170.82221 645.00386 4905.0000 -176.92842 -170.21393 6.71449 2.30202 -169.97870 649.10898 4910.0000 -175.95306 -170.14744 5.80562 2.30253 -169.96998 647.50020 4915.0000 -176.51578 -170.07698 6.43880 2.29667 -170.07048 643.61742 4920.0000 -177.23097 -171.73025 5.50072 2.25270 -170.82432 630.36693 4925.0000 -177.34915 -172.39760 4.95155 2.17230 -172.20301 568.85346 4930.0000 -177.30666 -171.38226 5.92440 2.20638 -171.61855 601.04294 4935.0000 -176.91969 -171.77444 5.14525 2.19941 -171.73806 608.13645 4940.0000 -176.71747 -170.80987 5.90759 2.21800 -171.41932 620.27881 4945.0000 -177.42896 -171.19077 6.23819 2.27221 -170.48983 656.71159 4950.0000 -176.59238 -171.50464 5.08774 2.22621 -171.27856 593.80473 4955.0000 -175.01064 -167.75053 7.26010 2.32849 -169.52477 676.94467 4960.0000 -175.53715 -170.08861 5.44854 2.34221 -169.28955 673.97383 4965.0000 -175.75866 -168.73202 7.02664 2.33945 -169.33700 652.95476 4970.0000 -177.10414 -170.56407 6.54007 2.33145 -169.47414 681.33204 4975.0000 -176.59782 -171.22702 5.37081 2.25361 -170.80875 627.01338 4980.0000 -176.53355 -171.08341 5.45014 2.24111 -171.02305 611.26432 4985.0000 -177.70588 -171.48086 6.22502 2.24408 -170.97215 644.40856 4990.0000 -176.32231 -170.67045 5.65186 2.19720 -171.77592 603.37817 4995.0000 -176.38287 -171.11242 5.27045 2.24590 -170.94098 614.05165 5000.0000 -176.88204 -171.71068 5.17136 2.21746 -171.42856 607.69900 FREEZING PROCESS: loop number 21 T-loop= 625.00000000000000 main_MD> interactions number 21 at Temperature= 625.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 2.26148 2.71749 0.11282 force_rgl> df(natom) 2.69731 -1.53972 0.35959 5005.0000 -176.50599 -171.63863 4.86736 2.21678 -171.44023 598.94425 5010.0000 -175.55829 -170.60445 4.95384 2.21310 -171.50341 559.01506 5015.0000 -176.33891 -170.08660 6.25231 2.27920 -170.37003 639.80888 5020.0000 -175.93407 -170.50311 5.43096 2.26887 -170.54703 653.50623 5025.0000 -177.03024 -171.61009 5.42015 2.24347 -170.98262 623.65448 5030.0000 -175.80745 -170.68109 5.12636 2.24388 -170.97556 601.47133 5035.0000 -177.16071 -171.66432 5.49638 2.23073 -171.20114 588.93682 5040.0000 -176.91738 -170.93667 5.98071 2.23098 -171.19673 629.07343 5045.0000 -176.21917 -170.45191 5.76726 2.27595 -170.42565 651.70990 5050.0000 -176.86989 -170.54905 6.32084 2.29197 -170.15097 658.38691 5055.0000 -176.16612 -170.24360 5.92252 2.29270 -170.13853 676.16458 5060.0000 -176.16083 -170.78327 5.37756 2.26906 -170.54381 633.85654 5065.0000 -176.27633 -170.31944 5.95689 2.27091 -170.51214 638.52450 5070.0000 -175.57225 -170.48576 5.08649 2.27658 -170.41495 665.77739 5075.0000 -176.56700 -170.91379 5.65321 2.24050 -171.03360 624.31366 5080.0000 -175.83409 -169.77195 6.06214 2.26528 -170.60873 627.85608 5085.0000 -177.00665 -171.45571 5.55093 2.26655 -170.58691 642.03893 5090.0000 -177.49027 -171.55220 5.93806 2.20637 -171.61870 600.76941 5095.0000 -177.13292 -170.55487 6.57805 2.23417 -171.14212 618.88216 5100.0000 -175.13379 -169.34205 5.79174 2.31730 -169.71678 691.47933 5105.0000 -175.42768 -169.37116 6.05652 2.33910 -169.34296 688.44977 5110.0000 -176.26177 -170.65132 5.61045 2.34168 -169.29872 670.25578 5115.0000 -176.38464 -169.55078 6.83386 2.28422 -170.28400 631.65437 5120.0000 -176.55126 -170.14234 6.40892 2.31310 -169.78876 666.49618 5125.0000 -176.53774 -170.37307 6.16468 2.27832 -170.38513 618.82660 5130.0000 -175.99445 -169.36804 6.62641 2.30855 -169.86676 641.83848 5135.0000 -175.70095 -170.02615 5.67480 2.30546 -169.91976 646.99415 5140.0000 -176.79779 -170.59478 6.20301 2.30509 -169.92615 654.55150 5145.0000 -175.67466 -169.13968 6.53498 2.33398 -169.43065 643.01424 5150.0000 -176.13063 -169.74568 6.38495 2.32751 -169.54161 652.57049 5155.0000 -175.91837 -170.66098 5.25739 2.31432 -169.76788 631.94460 5160.0000 -176.78678 -171.03410 5.75269 2.26410 -170.62891 607.81211 5165.0000 -175.82048 -170.22897 5.59151 2.24728 -170.91735 605.59005 5170.0000 -176.60535 -169.83323 6.77212 2.28381 -170.29099 638.30987 5175.0000 -174.39714 -168.82733 5.56981 2.29232 -170.14502 635.60203 5180.0000 -175.13445 -170.35164 4.78281 2.34804 -169.18962 688.33443 5185.0000 -178.01452 -171.82800 6.18652 2.22428 -171.31172 607.31267 5190.0000 -177.35813 -172.02811 5.33002 2.18648 -171.95980 555.80622 5195.0000 -177.22002 -171.79706 5.42296 2.18028 -172.06605 568.42012 5200.0000 -175.55414 -170.35225 5.20189 2.23985 -171.04470 613.57789 5205.0000 -175.74946 -170.13253 5.61693 2.29985 -170.01600 649.12367 5210.0000 -175.71723 -170.10731 5.60992 2.28539 -170.26383 657.71774 5215.0000 -176.90536 -170.32345 6.58190 2.28541 -170.26353 679.18002 5220.0000 -175.27846 -169.61525 5.66321 2.29623 -170.07802 692.73078 5225.0000 -176.24752 -170.62298 5.62454 2.27909 -170.37193 622.48208 5230.0000 -176.09695 -170.72479 5.37216 2.27608 -170.42343 592.48988 5235.0000 -176.33208 -169.76127 6.57081 2.27266 -170.48219 637.29871 5240.0000 -174.80285 -170.12621 4.67664 2.27154 -170.50130 622.78620 5245.0000 -176.71177 -171.08653 5.62524 2.23791 -171.07802 604.47568 5250.0000 -177.06245 -171.41129 5.65116 2.23878 -171.06302 627.53328 FREEZING PROCESS: loop number 22 T-loop= 600.00000000000000 main_MD> interactions number 22 at Temperature= 600.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -1.37843 1.36753 -1.66682 force_rgl> df(natom) 0.42176 5.17041 2.22095 5255.0000 -178.57607 -173.37538 5.20069 2.16930 -172.25444 563.79775 5260.0000 -177.00191 -172.04867 4.95323 2.14341 -172.69829 527.70995 5265.0000 -176.25358 -170.12984 6.12374 2.21575 -171.45788 582.34524 5270.0000 -176.94348 -171.26916 5.67432 2.25002 -170.87027 627.56284 5275.0000 -175.80713 -170.51775 5.28938 2.22856 -171.23834 612.11628 5280.0000 -176.53103 -170.96753 5.56350 2.23596 -171.11140 614.71136 5285.0000 -175.94087 -170.13172 5.80914 2.22860 -171.23752 610.02973 5290.0000 -176.24802 -170.96198 5.28604 2.29597 -170.08245 640.15430 5295.0000 -176.88408 -171.73081 5.15327 2.22331 -171.32838 589.62212 5300.0000 -177.20010 -172.30734 4.89276 2.19175 -171.86937 609.11377 5305.0000 -178.18711 -172.72857 5.45854 2.14957 -172.59261 543.24358 5310.0000 -176.87071 -172.49410 4.37662 2.18481 -171.98837 577.16366 5315.0000 -177.43551 -172.05561 5.37991 2.18068 -172.05917 574.25427 5320.0000 -176.54793 -171.53542 5.01251 2.18205 -172.03579 578.24070 5325.0000 -177.14655 -173.00824 4.13831 2.15933 -172.42539 552.48274 5330.0000 -176.16369 -170.77548 5.38821 2.21643 -171.44620 591.67541 5335.0000 -175.53024 -169.46644 6.06380 2.27698 -170.40801 629.36445 5340.0000 -175.83066 -169.98199 5.84868 2.31346 -169.78258 633.70880 5345.0000 -176.06273 -170.21873 5.84400 2.30511 -169.92572 652.33300 5350.0000 -176.89927 -171.57651 5.32276 2.25547 -170.77683 613.53130 5355.0000 -176.49214 -171.61309 4.87905 2.22620 -171.27872 593.13742 5360.0000 -176.58898 -171.13856 5.45043 2.23113 -171.19420 596.17633 5365.0000 -177.47282 -172.15399 5.31883 2.22118 -171.36488 596.88402 5370.0000 -178.65742 -172.70212 5.95530 2.19101 -171.88206 593.90332 5375.0000 -176.44561 -170.88256 5.56305 2.17413 -172.17151 563.47926 5380.0000 -175.99224 -170.14328 5.84896 2.28044 -170.34878 629.53288 5385.0000 -177.03254 -171.72761 5.30493 2.25536 -170.77871 639.20425 5390.0000 -177.24454 -171.70232 5.54222 2.19208 -171.86381 581.80962 5395.0000 -176.70282 -171.45944 5.24338 2.21779 -171.42289 616.52379 5400.0000 -177.65369 -171.85129 5.80240 2.23682 -171.09663 595.20189 5405.0000 -176.57675 -170.71841 5.85835 2.22149 -171.35957 614.97434 5410.0000 -177.29158 -171.58685 5.70473 2.23235 -171.17332 625.34904 5415.0000 -177.82603 -172.54310 5.28293 2.16427 -172.34068 577.53137 5420.0000 -176.47741 -170.92029 5.55712 2.18649 -171.95957 582.46522 5425.0000 -177.09461 -171.58960 5.50501 2.26663 -170.58555 664.15223 5430.0000 -177.97779 -171.45255 6.52523 2.20649 -171.61665 636.25373 5435.0000 -177.17649 -172.34598 4.83051 2.15936 -172.42488 569.84754 5440.0000 -177.83509 -173.43822 4.39687 2.13430 -172.85445 554.99595 5445.0000 -178.92896 -172.91803 6.01092 2.12929 -172.94041 555.47904 5450.0000 -176.53907 -171.38894 5.15013 2.17278 -172.19478 552.71725 5455.0000 -176.58633 -171.11275 5.47358 2.25714 -170.74819 657.15169 5460.0000 -177.39340 -172.50940 4.88400 2.18459 -171.99214 610.64736 5465.0000 -176.75408 -171.18579 5.56829 2.20656 -171.61547 594.98929 5470.0000 -177.25301 -172.62481 4.62820 2.20784 -171.59357 589.97675 5475.0000 -177.47232 -171.70896 5.76336 2.17813 -172.10294 583.89997 5480.0000 -177.37453 -171.95433 5.42020 2.22250 -171.34218 592.03310 5485.0000 -178.11346 -172.22368 5.88978 2.18332 -172.01402 578.45353 5490.0000 -178.07096 -172.69900 5.37196 2.14667 -172.64245 568.80574 5495.0000 -177.65268 -171.97871 5.67397 2.18131 -172.04839 584.99373 5500.0000 -177.63176 -172.68951 4.94225 2.15296 -172.53459 558.92495 FREEZING PROCESS: loop number 23 T-loop= 575.00000000000000 main_MD> interactions number 23 at Temperature= 575.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 0.49114 -0.47987 -0.48921 force_rgl> df(natom) 0.35820 -1.73023 -1.20237 5505.0000 -176.82671 -172.35942 4.46729 2.15487 -172.50182 539.07803 5510.0000 -177.57888 -172.40883 5.17005 2.13056 -172.91862 515.61640 5515.0000 -178.69238 -173.66756 5.02482 2.12960 -172.93509 545.08939 5520.0000 -179.23026 -173.34058 5.88968 2.10496 -173.35760 546.81049 5525.0000 -177.98935 -172.72973 5.25963 2.14125 -172.73538 568.47264 5530.0000 -177.34250 -172.37303 4.96948 2.15815 -172.44551 595.56069 5535.0000 -177.92993 -172.45697 5.47296 2.15530 -172.49435 569.80138 5540.0000 -178.18526 -173.22529 4.95997 2.12756 -172.97004 549.39906 5545.0000 -177.40021 -171.65399 5.74622 2.16410 -172.34357 564.90254 5550.0000 -177.54446 -171.87606 5.66840 2.18565 -171.97402 565.31158 5555.0000 -177.17903 -172.51026 4.66877 2.16315 -172.35985 574.40577 5560.0000 -177.67061 -172.70758 4.96304 2.18498 -171.98554 578.11574 5565.0000 -176.78110 -171.82848 4.95263 2.19031 -171.89412 579.71558 5570.0000 -178.44542 -173.00975 5.43568 2.14942 -172.59530 552.15922 5575.0000 -179.18648 -173.54214 5.64434 2.11107 -173.25281 559.11742 5580.0000 -178.15156 -172.77180 5.37976 2.12121 -173.07896 577.49024 5585.0000 -177.35914 -172.31085 5.04829 2.13396 -172.86039 563.97876 5590.0000 -177.80601 -173.18496 4.62105 2.17721 -172.11870 592.30017 5595.0000 -177.07216 -172.47381 4.59835 2.13534 -172.83671 545.94848 5600.0000 -176.74823 -171.53692 5.21131 2.20771 -171.59573 584.19190 5605.0000 -176.61159 -171.75395 4.85764 2.19028 -171.89465 565.18692 5610.0000 -177.06051 -170.86829 6.19221 2.23361 -171.15164 590.16168 5615.0000 -176.80969 -171.27789 5.53180 2.19511 -171.81180 562.75465 5620.0000 -176.90046 -170.91037 5.99009 2.22230 -171.34554 589.96098 5625.0000 -176.68124 -172.07556 4.60568 2.18320 -172.01607 583.40254 5630.0000 -177.07031 -172.13770 4.93261 2.16481 -172.33142 562.62796 5635.0000 -176.98848 -172.35694 4.63154 2.18999 -171.89960 557.76744 5640.0000 -177.64951 -172.52327 5.12624 2.18313 -172.01731 563.52776 5645.0000 -177.68162 -172.25342 5.42820 2.13670 -172.81332 531.60602 5650.0000 -176.53939 -171.41848 5.12091 2.19179 -171.86884 552.74400 5655.0000 -176.48727 -171.67149 4.81577 2.22945 -171.22295 593.97070 5660.0000 -177.13198 -172.34001 4.79197 2.17470 -172.16187 549.25985 5665.0000 -176.49501 -171.85505 4.63996 2.15476 -172.50372 540.05435 5670.0000 -177.26139 -172.15013 5.11125 2.20108 -171.70944 591.07089 5675.0000 -176.45412 -170.36535 6.08877 2.24077 -171.02893 623.57839 5680.0000 -176.57940 -170.64223 5.93717 2.27434 -170.45332 629.64392 5685.0000 -176.69613 -171.86646 4.82967 2.20785 -171.59331 571.37810 5690.0000 -176.65312 -171.24042 5.41270 2.22928 -171.22585 593.95128 5695.0000 -175.96093 -171.36142 4.59951 2.22637 -171.27580 575.00928 5700.0000 -176.54497 -171.64525 4.89973 2.19990 -171.72973 558.04796 5705.0000 -176.41816 -171.02162 5.39654 2.23930 -171.05414 600.43330 5710.0000 -177.29522 -172.40769 4.88753 2.20752 -171.59898 582.48441 5715.0000 -177.23127 -172.08744 5.14383 2.16793 -172.27790 553.42723 5720.0000 -177.63246 -172.92539 4.70707 2.15572 -172.48718 556.31679 5725.0000 -176.40075 -171.04729 5.35346 2.19751 -171.77066 589.53138 5730.0000 -176.64288 -171.17613 5.46674 2.21240 -171.51533 573.36095 5735.0000 -176.00786 -170.95694 5.05092 2.24978 -170.87438 590.08971 5740.0000 -176.91343 -171.53758 5.37584 2.25464 -170.79115 622.57245 5745.0000 -176.52640 -170.65653 5.86987 2.23561 -171.11746 601.99604 5750.0000 -176.75761 -170.50024 6.25737 2.24038 -171.03559 596.88257 FREEZING PROCESS: loop number 24 T-loop= 550.00000000000000 main_MD> interactions number 24 at Temperature= 550.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -0.17932 -0.79750 1.14692 force_rgl> df(natom) 0.42719 -0.10046 -0.44790 5755.0000 -177.03685 -171.47569 5.56116 2.20226 -171.68925 570.31557 5760.0000 -177.42592 -172.60563 4.82029 2.19600 -171.79664 584.64294 5765.0000 -176.42883 -171.80517 4.62366 2.15189 -172.55295 568.32417 5770.0000 -177.81943 -172.83008 4.98934 2.16132 -172.39116 567.65767 5775.0000 -177.80003 -172.35984 5.44019 2.11919 -173.11363 536.68749 5780.0000 -177.64905 -172.72670 4.92234 2.14397 -172.68865 588.35367 5785.0000 -178.07150 -172.64344 5.42805 2.15050 -172.57670 575.99315 5790.0000 -178.28307 -172.87027 5.41280 2.14616 -172.65119 589.08704 5795.0000 -177.88016 -171.91691 5.96325 2.13778 -172.79487 555.57921 5800.0000 -176.93480 -171.57614 5.35866 2.18160 -172.04346 580.83314 5805.0000 -178.00666 -172.68605 5.32062 2.17680 -172.12581 565.64094 5810.0000 -177.11480 -171.57848 5.53632 2.14378 -172.69192 550.88868 5815.0000 -177.68406 -172.58307 5.10099 2.18116 -172.05105 586.31581 5820.0000 -177.36382 -171.98428 5.37953 2.15613 -172.48026 596.62165 5825.0000 -177.16600 -172.82030 4.34570 2.13395 -172.86058 578.28670 5830.0000 -179.41707 -172.41718 6.99989 2.12175 -173.06967 571.61578 5835.0000 -178.91238 -173.82291 5.08947 2.09079 -173.60061 544.66515 5840.0000 -179.83729 -174.83920 4.99809 2.04002 -174.47102 515.48659 5845.0000 -177.70648 -173.31987 4.38661 2.07685 -173.83959 556.31186 5850.0000 -177.97319 -173.21148 4.76171 2.13372 -172.86450 576.81584 5855.0000 -179.41419 -173.95532 5.45887 2.11652 -173.15931 564.01713 5860.0000 -179.09970 -173.94759 5.15210 2.07850 -173.81130 544.42253 5865.0000 -179.84186 -174.34583 5.49602 2.06723 -174.00457 542.82976 5870.0000 -179.38221 -174.65822 4.72399 2.03283 -174.59428 508.08108 5875.0000 -179.71681 -174.98986 4.72695 2.01208 -174.95005 494.65189 5880.0000 -179.29544 -173.78992 5.50552 2.02583 -174.71442 520.09558 5885.0000 -179.94684 -174.82324 5.12360 2.06899 -173.97427 532.17515 5890.0000 -178.99910 -173.45497 5.54413 2.08449 -173.70863 537.16745 5895.0000 -179.58697 -173.89697 5.69000 2.09542 -173.52116 544.08530 5900.0000 -178.63522 -173.70414 4.93107 2.10629 -173.33470 552.42698 5905.0000 -177.67336 -172.90431 4.76905 2.09477 -173.53233 532.09184 5910.0000 -178.03188 -173.18252 4.84936 2.09979 -173.44618 539.32173 5915.0000 -178.84087 -173.74014 5.10073 2.07965 -173.79147 520.37173 5920.0000 -178.15867 -173.57184 4.58683 2.09759 -173.48397 536.61971 5925.0000 -177.93750 -173.12628 4.81122 2.13397 -172.86022 545.58269 5930.0000 -177.50956 -171.98483 5.52473 2.16098 -172.39699 552.33654 5935.0000 -177.22784 -172.14279 5.08505 2.18485 -171.98777 581.66273 5940.0000 -178.14166 -173.51525 4.62640 2.12607 -172.99564 516.60417 5945.0000 -177.47596 -173.06329 4.41267 2.12123 -173.07867 523.37690 5950.0000 -177.43245 -173.12898 4.30347 2.12777 -172.96646 526.39850 5955.0000 -176.99268 -172.21877 4.77392 2.14922 -172.59868 539.80107 5960.0000 -178.29310 -172.38395 5.90916 2.18030 -172.06569 570.28503 5965.0000 -177.93166 -172.22852 5.70314 2.13705 -172.80740 567.61424 5970.0000 -177.33641 -172.18939 5.14702 2.16676 -172.29800 559.62147 5975.0000 -177.67081 -172.64519 5.02563 2.15715 -172.46277 567.37973 5980.0000 -178.39912 -173.03329 5.36584 2.13556 -172.83284 565.03429 5985.0000 -178.47170 -172.73733 5.73437 2.11998 -173.10001 574.14028 5990.0000 -176.50549 -170.90233 5.60316 2.18314 -172.01705 612.70343 5995.0000 -177.37650 -172.71354 4.66296 2.16606 -172.30992 590.22499 6000.0000 -177.34081 -172.37271 4.96810 2.13858 -172.78111 560.49508 FREEZING PROCESS: loop number 25 T-loop= 525.00000000000000 main_MD> interactions number 25 at Temperature= 525.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 0.54606 1.02509 -3.36138 force_rgl> df(natom) 2.54308 -0.88025 0.44166 6005.0000 -177.34910 -172.27417 5.07492 2.14078 -172.74335 556.69124 6010.0000 -178.20325 -173.14145 5.06180 2.13516 -172.83981 548.98842 6015.0000 -177.78212 -173.04178 4.74034 2.11501 -173.18530 518.20647 6020.0000 -177.69518 -173.04329 4.65188 2.11587 -173.17049 521.64204 6025.0000 -177.67719 -172.64498 5.03221 2.13054 -172.91905 538.55118 6030.0000 -178.39434 -172.98699 5.40735 2.16652 -172.30202 575.19873 6035.0000 -178.72231 -173.07071 5.65160 2.11528 -173.18066 535.55832 6040.0000 -178.04185 -173.78691 4.25494 2.11136 -173.24782 517.77727 6045.0000 -177.45560 -173.17179 4.28381 2.09645 -173.50344 491.37446 6050.0000 -178.64023 -174.29139 4.34884 2.06664 -174.01470 498.15402 6055.0000 -179.36618 -174.93488 4.43131 2.04367 -174.40853 513.02431 6060.0000 -178.25746 -173.26291 4.99455 2.08015 -173.78303 546.72655 6065.0000 -177.62318 -172.56720 5.05598 2.12642 -172.98964 563.34885 6070.0000 -179.42945 -174.44457 4.98488 2.09886 -173.46212 502.76485 6075.0000 -178.09663 -173.70418 4.39245 2.07486 -173.87376 505.38496 6080.0000 -177.01124 -172.56227 4.44897 2.11513 -173.18314 520.38691 6085.0000 -178.43438 -173.23759 5.19679 2.12606 -172.99583 532.87800 6090.0000 -178.84163 -173.78136 5.06027 2.09272 -173.56738 518.40509 6095.0000 -178.03887 -173.16233 4.87653 2.07665 -173.84294 530.49121 6100.0000 -178.70086 -173.79400 4.90686 2.10104 -173.42472 541.54153 6105.0000 -178.19031 -173.16107 5.02924 2.08546 -173.69192 541.15351 6110.0000 -178.00895 -173.18358 4.82538 2.10676 -173.32677 553.24460 6115.0000 -178.38735 -173.27524 5.11212 2.11613 -173.16603 552.96672 6120.0000 -178.41882 -173.38480 5.03402 2.11040 -173.26425 543.08680 6125.0000 -179.23786 -174.26126 4.97660 2.08577 -173.68656 506.62053 6130.0000 -179.26096 -174.79849 4.46248 2.02430 -174.74060 481.65962 6135.0000 -179.07782 -174.61058 4.46724 2.02820 -174.67372 471.11788 6140.0000 -179.28434 -174.49455 4.78980 2.02585 -174.71408 490.86488 6145.0000 -179.31475 -174.24200 5.07276 2.04929 -174.31214 509.76414 6150.0000 -178.42360 -173.74354 4.68006 2.06761 -173.99801 520.95975 6155.0000 -178.16023 -173.66912 4.49111 2.08019 -173.78229 509.76381 6160.0000 -178.49430 -173.37583 5.11848 2.07355 -173.89616 496.60235 6165.0000 -178.93800 -173.94275 4.99525 2.10143 -173.41815 524.86597 6170.0000 -177.61358 -172.51996 5.09361 2.13373 -172.86429 553.15303 6175.0000 -177.92138 -173.35365 4.56774 2.11857 -173.12418 553.67950 6180.0000 -178.89209 -174.17350 4.71860 2.06026 -174.12404 513.28826 6185.0000 -178.68531 -173.73142 4.95389 2.07212 -173.92069 528.00815 6190.0000 -177.89769 -172.69580 5.20189 2.13760 -172.79798 563.61024 6195.0000 -177.38450 -172.75765 4.62684 2.17509 -172.15518 556.58004 6200.0000 -178.24570 -173.99360 4.25210 2.09372 -173.55027 514.49139 6205.0000 -178.33265 -172.76352 5.56913 2.10101 -173.42536 546.59348 6210.0000 -178.18854 -173.77844 4.41011 2.10320 -173.38781 540.06353 6215.0000 -177.94835 -172.75026 5.19810 2.08681 -173.66879 528.01021 6220.0000 -178.52023 -173.00674 5.51350 2.12153 -173.07338 558.10465 6225.0000 -178.35756 -173.24023 5.11733 2.13259 -172.88385 544.79846 6230.0000 -177.83473 -172.77695 5.05777 2.13065 -172.91701 554.30332 6235.0000 -178.12439 -173.11465 5.00975 2.11090 -173.25575 541.78726 6240.0000 -177.64147 -172.71566 4.92580 2.16329 -172.35742 561.46810 6245.0000 -178.64539 -174.34505 4.30034 2.10640 -173.33284 497.38174 6250.0000 -178.75689 -173.31703 5.43986 2.06744 -174.00088 491.56278 FREEZING PROCESS: loop number 26 T-loop= 500.00000000000000 main_MD> interactions number 26 at Temperature= 500.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 0.30375 2.37686 0.85317 force_rgl> df(natom) 0.28509 4.19586 1.49587 6255.0000 -179.28431 -174.50224 4.78207 2.07791 -173.82137 479.48708 6260.0000 -178.80511 -174.22912 4.57599 2.02403 -174.74526 467.52908 6265.0000 -178.11196 -173.08739 5.02457 2.08433 -173.71131 525.35503 6270.0000 -180.31712 -175.69363 4.62349 2.06939 -173.96744 531.90000 6275.0000 -179.82626 -174.67017 5.15610 2.00412 -175.08655 492.22304 6280.0000 -180.22740 -175.61648 4.61092 2.02216 -174.77726 512.31540 6285.0000 -179.57988 -175.39333 4.18655 1.95740 -175.88761 455.67641 6290.0000 -178.99661 -175.23780 3.75880 1.99412 -175.25812 486.84196 6295.0000 -179.53808 -174.98493 4.55315 2.02673 -174.69890 527.66270 6300.0000 -179.99049 -174.99610 4.99439 2.02604 -174.71076 514.61346 6305.0000 -179.00526 -174.23753 4.76773 2.04540 -174.37874 518.20522 6310.0000 -179.09471 -174.51659 4.57812 2.01898 -174.83187 519.38336 6315.0000 -179.04041 -174.39970 4.64071 2.03058 -174.63287 534.66681 6320.0000 -179.17379 -173.84470 5.32908 2.09693 -173.49530 566.44691 6325.0000 -180.14575 -175.61248 4.53328 2.01746 -174.85786 506.48357 6330.0000 -178.96584 -174.70063 4.26520 2.00972 -174.99059 490.69570 6335.0000 -179.12108 -174.31232 4.80876 2.02131 -174.79184 494.72247 6340.0000 -179.27160 -174.81712 4.45448 2.03252 -174.59964 502.88558 6345.0000 -180.01485 -175.47087 4.54398 2.00740 -175.03031 474.42512 6350.0000 -179.59905 -175.19992 4.39913 1.97145 -175.64680 453.36285 6355.0000 -179.58585 -175.05642 4.52943 1.98255 -175.45640 469.54539 6360.0000 -179.61085 -175.26806 4.34278 1.96527 -175.75267 448.88029 6365.0000 -179.89641 -174.96723 4.92919 2.00429 -175.08373 484.74497 6370.0000 -178.76109 -174.90630 3.85479 2.04691 -174.35285 508.30460 6375.0000 -179.27258 -174.15607 5.11651 2.05452 -174.22239 520.71642 6380.0000 -178.85126 -173.78857 5.06269 2.05867 -174.15132 520.96771 6385.0000 -179.51318 -175.11648 4.39670 2.03355 -174.58199 515.75628 6390.0000 -178.70446 -174.11797 4.58648 2.04219 -174.43387 526.41110 6395.0000 -178.82133 -174.45680 4.36453 2.05497 -174.21468 505.95043 6400.0000 -179.48672 -174.88464 4.60208 2.01616 -174.88012 465.39898 6405.0000 -179.09582 -174.30209 4.79374 2.01349 -174.92588 465.55878 6410.0000 -178.50660 -172.58208 5.92451 2.10572 -173.34454 521.15923 6415.0000 -178.29234 -174.02889 4.26344 2.07375 -173.89273 484.38836 6420.0000 -178.74175 -174.94050 3.80126 2.07123 -173.93599 470.31610 6425.0000 -178.80329 -175.04051 3.76278 2.03223 -174.60456 467.37873 6430.0000 -178.68518 -174.32338 4.36180 2.03185 -174.61115 479.15767 6435.0000 -178.88852 -174.34344 4.54508 2.04427 -174.39825 501.02381 6440.0000 -178.10978 -174.43646 3.67332 2.04453 -174.39372 500.66775 6445.0000 -178.74140 -174.43024 4.31116 2.04841 -174.32718 495.23306 6450.0000 -179.16699 -174.39784 4.76915 2.04054 -174.46221 502.66800 6455.0000 -179.47522 -175.28028 4.19494 2.00323 -175.10180 459.76126 6460.0000 -179.22415 -174.51204 4.71211 1.99137 -175.30531 454.21035 6465.0000 -178.86802 -174.32139 4.54663 2.02398 -174.74605 476.09946 6470.0000 -178.91972 -175.23598 3.68374 2.00979 -174.98944 466.07337 6475.0000 -178.46810 -173.99658 4.47152 2.03222 -174.60484 485.30490 6480.0000 -178.84670 -173.39758 5.44912 2.05345 -174.24082 495.41898 6485.0000 -178.46666 -174.43239 4.03427 2.06348 -174.06885 501.05027 6490.0000 -177.98833 -173.82480 4.16353 2.06719 -174.00521 490.54491 6495.0000 -179.54600 -174.68528 4.86072 2.06218 -174.09105 506.20553 6500.0000 -179.46209 -175.96990 3.49219 2.01319 -174.93102 472.81073 FREEZING PROCESS: loop number 27 T-loop= 475.00000000000000 main_MD> interactions number 27 at Temperature= 475.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -1.70957 -2.06721 0.93937 force_rgl> df(natom) 0.79722 2.01956 -0.94774 6505.0000 -179.68848 -175.17792 4.51056 1.99196 -175.29519 465.37990 6510.0000 -178.94091 -174.62530 4.31560 2.00095 -175.14101 462.28544 6515.0000 -178.68783 -174.37487 4.31296 2.03636 -174.53373 476.04216 6520.0000 -178.52662 -174.19700 4.32962 2.02314 -174.76053 455.88450 6525.0000 -179.89495 -175.39511 4.49984 2.02066 -174.80308 476.12178 6530.0000 -179.98504 -175.72749 4.25755 1.96392 -175.77591 452.38428 6535.0000 -179.41713 -175.27862 4.13851 1.96593 -175.74139 461.22118 6540.0000 -179.69028 -175.62872 4.06156 1.97071 -175.65949 459.21630 6545.0000 -179.64695 -175.31693 4.33002 1.97688 -175.55366 475.81530 6550.0000 -179.64454 -174.96993 4.67461 1.99787 -175.19371 490.42217 6555.0000 -179.84750 -175.30979 4.53772 1.97505 -175.58514 466.66764 6560.0000 -180.42707 -175.25558 5.17149 1.96661 -175.72985 454.39415 6565.0000 -178.71671 -174.20569 4.51103 2.03374 -174.57868 497.61366 6570.0000 -178.74456 -174.70522 4.03934 2.03755 -174.51347 465.37315 6575.0000 -179.20446 -174.62802 4.57644 2.02582 -174.71449 473.96536 6580.0000 -178.59176 -173.95316 4.63860 2.05705 -174.17913 517.41642 6585.0000 -178.99682 -174.19681 4.80001 2.05350 -174.23994 512.19357 6590.0000 -180.53270 -176.30228 4.23042 2.00060 -175.14695 477.40135 6595.0000 -179.87493 -175.94602 3.92892 1.92701 -176.40885 419.36120 6600.0000 -179.56561 -175.51177 4.05385 1.97692 -175.55304 459.89886 6605.0000 -178.90238 -174.96798 3.93440 2.00016 -175.15443 460.91083 6610.0000 -178.98553 -174.97068 4.01485 2.00935 -174.99700 475.92425 6615.0000 -180.56157 -176.34742 4.21414 1.96443 -175.76714 455.74284 6620.0000 -179.93718 -175.77224 4.16494 1.95428 -175.94111 436.46995 6625.0000 -179.13303 -174.15610 4.97693 2.01171 -174.95647 477.04994 6630.0000 -179.66774 -174.70737 4.96037 2.02026 -174.80980 494.01077 6635.0000 -180.02325 -176.30814 3.71511 1.97113 -175.65220 459.01348 6640.0000 -179.34881 -175.73192 3.61689 1.93102 -176.34000 422.68309 6645.0000 -180.45877 -175.85675 4.60201 1.98839 -175.35639 465.98241 6650.0000 -179.62926 -175.44140 4.18786 1.96608 -175.73894 458.08432 6655.0000 -180.63506 -176.05747 4.57759 1.96041 -175.83615 459.87699 6660.0000 -179.64389 -175.64127 4.00262 1.94910 -176.02997 456.75329 6665.0000 -179.92354 -176.63287 3.29067 1.95203 -175.97970 453.74957 6670.0000 -179.57534 -175.66216 3.91317 1.94653 -176.07400 435.08735 6675.0000 -179.60755 -175.31081 4.29674 1.99996 -175.15797 483.53683 6680.0000 -179.73442 -175.38476 4.34966 1.97775 -175.53877 464.33311 6685.0000 -180.00721 -176.05194 3.95527 1.96288 -175.79369 466.85919 6690.0000 -180.29506 -176.37565 3.91942 1.93394 -176.28990 438.37462 6695.0000 -180.91255 -176.93573 3.97682 1.93065 -176.34628 434.64826 6700.0000 -179.48261 -175.64058 3.84203 1.93237 -176.31693 429.63087 6705.0000 -180.14263 -176.38509 3.75753 1.96804 -175.70529 454.92086 6710.0000 -180.11155 -176.31408 3.79747 1.94164 -176.15794 449.70131 6715.0000 -180.35143 -176.32059 4.03084 1.91160 -176.67300 423.53482 6720.0000 -179.67155 -175.58923 4.08231 1.97942 -175.51006 466.92966 6725.0000 -179.38171 -174.83310 4.54861 1.99814 -175.18918 488.23017 6730.0000 -178.89528 -174.44001 4.45527 2.02557 -174.71877 501.13418 6735.0000 -179.50736 -175.19821 4.30915 2.04054 -174.46206 506.03015 6740.0000 -179.19911 -175.29857 3.90054 1.99630 -175.22071 457.02634 6745.0000 -180.30388 -175.67337 4.63051 1.97779 -175.53800 465.35246 6750.0000 -179.82375 -175.38025 4.44350 1.99332 -175.27176 472.31381 FREEZING PROCESS: loop number 28 T-loop= 450.00000000000000 main_MD> interactions number 28 at Temperature= 450.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -3.18211 -2.02037 3.29446 force_rgl> df(natom) -1.70008 0.72064 0.76956 6755.0000 -180.06372 -175.88622 4.17750 1.99557 -175.23324 476.82058 6760.0000 -180.01350 -176.83471 3.17879 1.92296 -176.47820 407.95626 6765.0000 -179.54743 -175.76457 3.78286 1.92289 -176.47949 407.51962 6770.0000 -179.44168 -175.37438 4.06730 1.95750 -175.88594 431.98529 6775.0000 -179.95664 -175.49245 4.46419 1.98155 -175.47357 454.27675 6780.0000 -179.80032 -175.58899 4.21132 1.97943 -175.50997 450.41601 6785.0000 -179.15636 -174.19913 4.95723 2.05204 -174.26499 474.64380 6790.0000 -179.08485 -175.02562 4.05923 2.02976 -174.64705 462.59021 6795.0000 -179.79269 -175.46335 4.32935 2.00102 -175.13969 448.17414 6800.0000 -178.86018 -174.48790 4.37228 2.01732 -174.86022 462.71572 6805.0000 -178.13074 -174.43830 3.69244 2.01670 -174.87084 450.87577 6810.0000 -178.74472 -173.91842 4.82630 2.05680 -174.18343 498.64369 6815.0000 -176.94837 -173.13763 3.81073 2.10513 -173.35468 511.71881 6820.0000 -178.08737 -173.66328 4.42409 2.09167 -173.58537 514.34166 6825.0000 -179.32727 -174.96074 4.36652 2.02272 -174.76765 452.85305 6830.0000 -178.19777 -174.08870 4.10907 2.04940 -174.31022 483.08249 6835.0000 -179.31397 -174.33818 4.97579 2.03752 -174.51397 476.96169 6840.0000 -179.12017 -174.88150 4.23867 2.03406 -174.57327 483.30359 6845.0000 -179.47667 -174.77604 4.70063 1.99576 -175.23002 462.93632 6850.0000 -179.70392 -175.84963 3.85429 1.96770 -175.71101 454.58871 6855.0000 -179.54495 -175.56935 3.97560 1.98520 -175.41096 454.54874 6860.0000 -179.69272 -175.68349 4.00923 1.96792 -175.70729 426.58073 6865.0000 -179.95970 -176.35764 3.60206 1.91759 -176.57033 407.34722 6870.0000 -180.07401 -175.88411 4.18990 1.93181 -176.32655 405.25564 6875.0000 -180.50491 -176.04159 4.46331 1.95832 -175.87195 449.27165 6880.0000 -179.46128 -175.15151 4.30977 1.97893 -175.51847 465.76956 6885.0000 -179.74089 -175.22190 4.51900 2.00860 -175.00984 487.72684 6890.0000 -180.33917 -176.03578 4.30339 1.96704 -175.72240 469.98552 6895.0000 -180.61064 -176.60080 4.00984 1.94010 -176.18435 446.96725 6900.0000 -180.88104 -176.51310 4.36795 1.91531 -176.60935 422.94453 6905.0000 -180.63166 -176.63772 3.99394 1.93241 -176.31611 443.44320 6910.0000 -180.46030 -176.50292 3.95737 1.91459 -176.62165 430.88977 6915.0000 -180.44406 -176.29848 4.14557 1.93330 -176.30096 438.62059 6920.0000 -180.36154 -176.53372 3.82781 1.93287 -176.30824 435.77748 6925.0000 -180.45534 -176.96018 3.49517 1.89494 -176.95860 408.13430 6930.0000 -180.50767 -177.05045 3.45723 1.91357 -176.63930 423.99614 6935.0000 -179.34973 -175.53206 3.81768 1.92978 -176.36132 438.98387 6940.0000 -180.86413 -176.79291 4.07123 1.92541 -176.43615 431.52861 6945.0000 -180.16119 -176.40199 3.75921 1.90500 -176.78611 417.00216 6950.0000 -179.88554 -175.74021 4.14533 1.94140 -176.16198 436.49122 6955.0000 -180.10842 -175.60742 4.50100 1.96620 -175.73675 463.66099 6960.0000 -179.82472 -175.46646 4.35827 1.97474 -175.59040 475.87686 6965.0000 -181.21289 -176.72888 4.48402 1.92849 -176.38343 430.12439 6970.0000 -180.24187 -176.21256 4.02931 1.91885 -176.54861 426.44466 6975.0000 -179.82428 -176.03615 3.78813 1.97533 -175.58019 473.46272 6980.0000 -180.48088 -176.44619 4.03469 1.92853 -176.38279 438.81596 6985.0000 -181.04232 -176.29247 4.74985 1.91322 -176.64526 420.34178 6990.0000 -179.67184 -175.35493 4.31691 1.93599 -176.25478 442.19859 6995.0000 -180.05610 -175.69107 4.36503 2.00223 -175.11899 498.48771 7000.0000 -180.09335 -176.76151 3.33183 1.89964 -176.87803 408.56969 FREEZING PROCESS: loop number 29 T-loop= 425.00000000000000 main_MD> interactions number 29 at Temperature= 425.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -2.39035 3.44599 0.20591 force_rgl> df(natom) -1.22767 -0.51033 -0.90755 7005.0000 -179.50484 -175.56503 3.93981 1.91087 -176.68546 419.27934 7010.0000 -180.65265 -176.83723 3.81542 1.93867 -176.20892 442.85144 7015.0000 -180.09264 -176.80297 3.28967 1.90257 -176.82782 410.22189 7020.0000 -180.50901 -176.79705 3.71196 1.90119 -176.85140 411.17140 7025.0000 -180.88163 -176.80501 4.07662 1.89824 -176.90214 412.20523 7030.0000 -180.28501 -176.44654 3.83847 1.91929 -176.54107 431.39517 7035.0000 -180.70714 -176.59467 4.11247 1.91162 -176.67270 426.58288 7040.0000 -180.29458 -177.22409 3.07048 1.91127 -176.67867 420.43855 7045.0000 -181.12393 -177.70797 3.41596 1.87036 -177.38013 388.56788 7050.0000 -180.85145 -177.56996 3.28150 1.88377 -177.15018 400.45957 7055.0000 -181.01374 -177.60031 3.41343 1.86301 -177.50607 373.18635 7060.0000 -180.60246 -176.24980 4.35265 1.92456 -176.45085 433.03228 7065.0000 -180.35599 -176.50046 3.85553 1.91859 -176.55318 428.63946 7070.0000 -180.42065 -176.56537 3.85528 1.91613 -176.59524 427.45374 7075.0000 -180.68835 -176.68297 4.00538 1.91554 -176.60540 423.81994 7080.0000 -180.82130 -176.37131 4.44999 1.94141 -176.16193 442.60694 7085.0000 -180.82518 -176.85809 3.96709 1.91611 -176.59559 428.38943 7090.0000 -180.56897 -176.23481 4.33416 1.93924 -176.19916 443.94223 7095.0000 -180.44727 -176.92533 3.52194 1.91151 -176.67446 413.52653 7100.0000 -180.89947 -176.81730 4.08217 1.92379 -176.46400 433.45554 7105.0000 -180.99964 -176.94963 4.05001 1.92211 -176.49287 435.19750 7110.0000 -179.49112 -175.34866 4.14246 1.92004 -176.52829 429.73830 7115.0000 -180.54616 -176.87144 3.67471 1.95909 -175.85878 461.24800 7120.0000 -179.58843 -175.08211 4.50631 1.94934 -176.02583 452.43120 7125.0000 -180.13842 -175.58305 4.55538 1.96234 -175.80295 467.23720 7130.0000 -180.40464 -175.39315 5.01148 1.97599 -175.56901 476.34583 7135.0000 -180.09740 -176.25644 3.84096 1.98608 -175.39585 476.48584 7140.0000 -180.88480 -176.97098 3.91382 1.92584 -176.42876 435.11690 7145.0000 -180.23665 -176.50946 3.72719 1.90645 -176.76122 418.66361 7150.0000 -180.23755 -176.05986 4.17769 1.95177 -175.98427 451.33095 7155.0000 -180.88168 -176.25681 4.62488 1.94242 -176.14456 451.48923 7160.0000 -179.67637 -175.34580 4.33057 1.94840 -176.04203 454.46137 7165.0000 -180.86533 -176.61181 4.25352 1.95967 -175.84874 454.04958 7170.0000 -180.64600 -175.92778 4.71822 1.92427 -176.45577 434.44286 7175.0000 -181.21819 -176.22021 4.99798 1.94383 -176.12043 449.12139 7180.0000 -179.39483 -175.40693 3.98790 1.96245 -175.80102 457.53944 7185.0000 -180.27153 -176.16967 4.10186 1.95559 -175.91871 460.74587 7190.0000 -180.69460 -177.01510 3.67950 1.90203 -176.83716 413.57339 7195.0000 -180.38538 -176.29756 4.08783 1.89088 -177.02835 407.27962 7200.0000 -179.95299 -176.09773 3.85526 1.94154 -176.15966 445.17713 7205.0000 -180.32687 -175.97247 4.35440 1.96309 -175.79005 466.04665 7210.0000 -180.78661 -176.86805 3.91856 1.92300 -176.47757 436.34548 7215.0000 -180.35960 -176.13468 4.22493 1.93238 -176.31668 440.08607 7220.0000 -180.63204 -176.39835 4.23368 1.92142 -176.50453 434.33878 7225.0000 -181.09817 -176.62054 4.47763 1.92528 -176.43851 435.72863 7230.0000 -180.02341 -176.32964 3.69377 1.91047 -176.69235 424.32958 7235.0000 -180.82566 -176.65813 4.16753 1.91863 -176.55252 422.88180 7240.0000 -180.55178 -176.34486 4.20691 1.92074 -176.51636 432.87280 7245.0000 -180.21616 -176.49646 3.71970 1.93600 -176.25467 443.83943 7250.0000 -180.39625 -176.02005 4.37620 1.95427 -175.94140 465.68038 FREEZING PROCESS: loop number 30 T-loop= 400.00000000000000 main_MD> interactions number 30 at Temperature= 400.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 2.14260 -0.29180 -0.19668 force_rgl> df(natom) -0.76620 -0.57031 0.53517 7255.0000 -181.24616 -177.42054 3.82562 1.89453 -176.96563 408.82196 7260.0000 -181.37184 -178.34006 3.03178 1.84653 -177.78877 367.57872 7265.0000 -181.31027 -177.59824 3.71203 1.86062 -177.54710 382.40162 7270.0000 -180.46507 -177.21697 3.24810 1.87751 -177.25756 396.70172 7275.0000 -180.63506 -177.17185 3.46321 1.88712 -177.09276 400.51998 7280.0000 -180.19068 -177.38064 2.81004 1.86662 -177.44421 385.84240 7285.0000 -181.26140 -177.74410 3.51730 1.86888 -177.40544 389.39815 7290.0000 -180.73648 -177.57878 3.15770 1.87605 -177.28253 396.87514 7295.0000 -181.00984 -178.08918 2.92066 1.84709 -177.77911 371.22239 7300.0000 -180.21695 -177.00066 3.21629 1.85660 -177.61609 376.49847 7305.0000 -180.33215 -176.85954 3.47261 1.89192 -177.01036 397.39216 7310.0000 -180.50647 -176.86115 3.64532 1.91242 -176.65894 421.79548 7315.0000 -180.93784 -177.01650 3.92134 1.89888 -176.89108 415.43648 7320.0000 -180.87951 -177.53239 3.34712 1.88023 -177.21093 393.96920 7325.0000 -180.18772 -176.50386 3.68386 1.89513 -176.95532 410.81278 7330.0000 -180.33815 -176.30540 4.03275 1.92311 -176.47572 420.14932 7335.0000 -181.05061 -177.33849 3.71212 1.89188 -177.01114 407.23573 7340.0000 -181.00959 -177.97617 3.03342 1.84648 -177.78949 367.47499 7345.0000 -181.41022 -177.80018 3.61004 1.83295 -178.02154 356.80792 7350.0000 -181.76129 -177.86255 3.89873 1.85922 -177.57110 380.25633 7355.0000 -180.48942 -176.67564 3.81378 1.88396 -177.14692 404.18774 7360.0000 -180.57211 -177.23096 3.34115 1.91450 -176.62326 419.49196 7365.0000 -181.26581 -177.63622 3.62959 1.86920 -177.40002 386.86951 7370.0000 -181.15616 -177.43390 3.72226 1.88669 -177.10016 401.97572 7375.0000 -180.77628 -177.21983 3.55645 1.88786 -177.08012 402.95061 7380.0000 -181.51686 -178.25362 3.26324 1.85541 -177.63647 376.79393 7385.0000 -181.39916 -177.71001 3.68915 1.83318 -178.01763 356.25368 7390.0000 -181.21619 -177.90496 3.31123 1.83874 -177.92232 361.81495 7395.0000 -182.00528 -178.25615 3.74913 1.83832 -177.92956 360.47307 7400.0000 -181.09185 -178.01152 3.08032 1.85358 -177.66779 376.89759 7405.0000 -180.59848 -177.41302 3.18546 1.85132 -177.70655 370.11128 7410.0000 -180.95221 -177.45616 3.49605 1.88666 -177.10068 403.68341 7415.0000 -180.95565 -176.93051 4.02514 1.90689 -176.75380 422.35803 7420.0000 -180.99828 -176.82232 4.17597 1.89566 -176.94639 412.48056 7425.0000 -180.34970 -176.83299 3.51671 1.91987 -176.53121 429.36455 7430.0000 -180.75213 -176.86104 3.89108 1.89575 -176.94478 407.96659 7435.0000 -180.87328 -176.67182 4.20146 1.89377 -176.97879 410.03014 7440.0000 -180.46783 -176.63454 3.83329 1.90567 -176.77459 421.33988 7445.0000 -181.56293 -177.94979 3.61314 1.89357 -176.98216 409.68602 7450.0000 -181.13524 -177.71322 3.42202 1.85183 -177.69780 375.76197 7455.0000 -179.99063 -175.40280 4.58783 1.89711 -176.92144 403.81281 7460.0000 -181.11210 -176.90557 4.20654 1.94087 -176.17106 439.27432 7465.0000 -180.08163 -176.43413 3.64751 1.89461 -176.96423 411.97155 7470.0000 -180.55138 -176.88098 3.67040 1.90865 -176.72360 420.84363 7475.0000 -180.78777 -177.76521 3.02256 1.88082 -177.20073 394.76372 7480.0000 -180.65073 -177.09984 3.55089 1.86809 -177.41898 379.14532 7485.0000 -180.93343 -177.33887 3.59456 1.86356 -177.49674 378.32457 7490.0000 -180.98855 -177.52196 3.46659 1.87166 -177.35785 389.06510 7495.0000 -181.17205 -177.87529 3.29676 1.86161 -177.53011 381.69575 7500.0000 -180.89196 -177.53598 3.35598 1.86299 -177.50657 376.46942 FREEZING PROCESS: loop number 31 T-loop= 375.00000000000000 main_MD> interactions number 31 at Temperature= 375.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 1.93024 1.70726 1.63645 force_rgl> df(natom) -0.88884 -0.88854 -0.74643 7505.0000 -181.39187 -177.95423 3.43764 1.84356 -177.83962 367.17970 7510.0000 -181.20449 -178.26234 2.94215 1.82943 -178.08194 354.11459 7515.0000 -180.97591 -177.97378 3.00213 1.80795 -178.45024 336.06320 7520.0000 -181.13029 -177.33233 3.79796 1.84823 -177.75957 372.04661 7525.0000 -180.85637 -177.26783 3.58854 1.88031 -177.20952 393.02812 7530.0000 -180.62299 -176.70544 3.91755 1.90118 -176.85158 410.26447 7535.0000 -181.04529 -177.57727 3.46803 1.89123 -177.02229 403.93321 7540.0000 -180.91113 -177.71660 3.19453 1.85054 -177.71996 372.42209 7545.0000 -181.19664 -177.52697 3.66967 1.85441 -177.65367 374.74204 7550.0000 -181.53109 -178.66882 2.86227 1.82523 -178.15386 346.37716 7555.0000 -181.15954 -177.56725 3.59230 1.82822 -178.10265 346.00434 7560.0000 -181.60067 -178.19655 3.40412 1.83057 -178.06228 350.03522 7565.0000 -181.23320 -177.86481 3.36838 1.82521 -178.15434 346.18192 7570.0000 -182.01745 -178.08036 3.93709 1.82762 -178.11292 353.70213 7575.0000 -181.33995 -177.35846 3.98149 1.85942 -177.56773 384.46143 7580.0000 -181.60677 -178.15752 3.44925 1.82519 -178.15456 348.58884 7585.0000 -180.43857 -177.73401 2.70455 1.84527 -177.81033 367.91078 7590.0000 -181.52221 -177.95962 3.56259 1.84567 -177.80352 366.10307 7595.0000 -180.94264 -177.79083 3.15181 1.83970 -177.90588 362.32707 7600.0000 -180.92822 -177.42366 3.50456 1.87880 -177.23533 393.96222 7605.0000 -180.66740 -176.85721 3.81019 1.88589 -177.11375 404.29385 7610.0000 -181.37965 -177.41351 3.96613 1.88806 -177.07663 401.88517 7615.0000 -181.14544 -177.97716 3.16828 1.83968 -177.90613 368.46842 7620.0000 -181.36968 -177.86379 3.50588 1.84658 -177.78791 370.25754 7625.0000 -180.82293 -176.89060 3.93233 1.86497 -177.47256 387.86858 7630.0000 -181.03934 -177.44699 3.59235 1.87299 -177.33510 390.60281 7635.0000 -181.42250 -177.79579 3.62671 1.83676 -177.95620 362.58217 7640.0000 -180.62464 -177.12391 3.50073 1.84435 -177.82614 364.79446 7645.0000 -180.55066 -177.14273 3.40793 1.87500 -177.30057 388.58579 7650.0000 -180.81592 -177.68112 3.13480 1.86866 -177.40921 384.22943 7655.0000 -181.01544 -177.81975 3.19569 1.85960 -177.56466 377.81065 7660.0000 -181.59436 -178.55382 3.04054 1.83423 -177.99967 359.20918 7665.0000 -181.53293 -178.18070 3.35223 1.80352 -178.52624 332.07126 7670.0000 -180.65567 -177.66762 2.98804 1.82753 -178.11453 351.60588 7675.0000 -180.71980 -177.10910 3.61070 1.86434 -177.48341 378.40076 7680.0000 -180.96063 -177.50499 3.45564 1.88207 -177.17931 395.03934 7685.0000 -181.18130 -177.74521 3.43609 1.86319 -177.50302 382.58890 7690.0000 -180.44585 -176.82325 3.62260 1.86600 -177.45490 389.50540 7695.0000 -181.43680 -178.23766 3.19915 1.84214 -177.86407 363.54312 7700.0000 -181.26235 -177.69117 3.57118 1.82168 -178.21487 346.30507 7705.0000 -181.58626 -178.64020 2.94606 1.83747 -177.94401 360.78605 7710.0000 -181.07682 -177.77444 3.30237 1.81703 -178.29459 346.84086 7715.0000 -181.47707 -177.78808 3.68898 1.84357 -177.83943 364.15253 7720.0000 -181.32343 -178.75202 2.57141 1.82363 -178.18134 343.18301 7725.0000 -181.25526 -177.86434 3.39092 1.82975 -178.07639 352.68846 7730.0000 -181.24101 -177.95832 3.28269 1.82311 -178.19023 346.34313 7735.0000 -180.70696 -177.52407 3.18289 1.85053 -177.72004 373.35760 7740.0000 -180.77166 -177.30654 3.46511 1.88434 -177.14049 397.47016 7745.0000 -181.52036 -178.02196 3.49839 1.86813 -177.41829 383.25018 7750.0000 -181.61536 -178.16951 3.44584 1.83176 -178.04200 351.83570 FREEZING PROCESS: loop number 32 T-loop= 350.00000000000000 main_MD> interactions number 32 at Temperature= 350.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -0.85750 0.91553 1.89083 force_rgl> df(natom) -1.01043 1.42267 -0.41481 7755.0000 -182.16030 -178.78858 3.37171 1.79370 -178.69460 321.69098 7760.0000 -181.75024 -178.48025 3.26999 1.81533 -178.32376 342.79148 7765.0000 -180.97180 -177.74279 3.22900 1.82442 -178.16790 351.01231 7770.0000 -181.06349 -177.91154 3.15194 1.84532 -177.80950 371.57049 7775.0000 -181.29798 -178.18064 3.11733 1.81631 -178.30679 341.70515 7780.0000 -180.81147 -177.58719 3.22428 1.82435 -178.16908 349.41512 7785.0000 -180.16730 -176.88131 3.28599 1.86242 -177.51626 377.97947 7790.0000 -181.24635 -177.80794 3.43841 1.85350 -177.66916 373.83630 7795.0000 -181.75194 -178.27680 3.47514 1.83912 -177.91569 361.89679 7800.0000 -181.53219 -178.54121 2.99098 1.81397 -178.34705 338.85390 7805.0000 -180.85691 -177.59913 3.25778 1.82273 -178.19688 348.04913 7810.0000 -181.12986 -177.55584 3.57402 1.86562 -177.46138 379.49276 7815.0000 -180.79801 -177.28430 3.51370 1.84556 -177.80538 366.05944 7820.0000 -181.25881 -177.89318 3.36563 1.83500 -177.98645 359.87002 7825.0000 -181.75128 -179.09008 2.66120 1.81751 -178.28626 340.99112 7830.0000 -181.58281 -178.37112 3.21169 1.77877 -178.95063 307.32514 7835.0000 -181.43417 -177.88574 3.54843 1.83997 -177.90115 365.00073 7840.0000 -180.47699 -177.25443 3.22256 1.84602 -177.79745 370.79762 7845.0000 -180.82728 -177.37414 3.45314 1.89347 -176.98385 410.34812 7850.0000 -181.34121 -178.08881 3.25240 1.85136 -177.70598 374.48971 7855.0000 -180.92825 -177.95332 2.97494 1.82870 -178.09442 354.36077 7860.0000 -181.09436 -177.97556 3.11880 1.85913 -177.57273 380.45640 7865.0000 -181.63786 -178.23528 3.40257 1.82494 -178.15887 346.44436 7870.0000 -181.65046 -178.23984 3.41062 1.80392 -178.51924 328.97163 7875.0000 -181.41785 -178.27452 3.14333 1.81392 -178.34790 341.68718 7880.0000 -181.74704 -178.46825 3.27879 1.80553 -178.49163 331.12768 7885.0000 -181.68216 -178.22916 3.45300 1.80952 -178.42332 339.85874 7890.0000 -181.86082 -178.54750 3.31331 1.81334 -178.35774 338.87084 7895.0000 -181.65410 -179.12922 2.52487 1.78305 -178.87724 317.08515 7900.0000 -181.43878 -178.42194 3.01683 1.79932 -178.59813 326.76964 7905.0000 -181.87768 -178.73514 3.14254 1.82032 -178.23808 343.19396 7910.0000 -181.69297 -178.25937 3.43359 1.79591 -178.65662 321.18929 7915.0000 -181.60997 -178.11552 3.49445 1.83068 -178.06042 350.29561 7920.0000 -181.55812 -178.22607 3.33205 1.81835 -178.27188 344.50148 7925.0000 -181.66804 -178.23486 3.43319 1.82110 -178.22469 348.54754 7930.0000 -181.24101 -177.88918 3.35183 1.81889 -178.26269 345.17276 7935.0000 -181.89479 -178.63519 3.25960 1.81972 -178.24844 342.79494 7940.0000 -181.50853 -178.28281 3.22573 1.79715 -178.63544 326.06553 7945.0000 -181.95940 -178.74544 3.21396 1.81613 -178.30992 342.10350 7950.0000 -180.91754 -177.60955 3.30798 1.82562 -178.14730 353.56543 7955.0000 -181.30515 -177.70747 3.59767 1.85651 -177.61763 376.47547 7960.0000 -181.15117 -177.92232 3.22885 1.85334 -177.67186 374.72334 7965.0000 -181.60971 -178.04621 3.56350 1.83332 -178.01514 357.68612 7970.0000 -181.12953 -177.70355 3.42597 1.83582 -177.97233 361.17862 7975.0000 -181.20561 -178.27541 2.93020 1.83660 -177.95903 360.23198 7980.0000 -181.37314 -177.52575 3.84739 1.83735 -177.94606 359.17861 7985.0000 -181.02739 -178.14638 2.88101 1.84135 -177.87745 362.90120 7990.0000 -180.69333 -177.73547 2.95786 1.84779 -177.76711 371.59173 7995.0000 -181.24656 -177.68983 3.55673 1.84600 -177.79785 367.56263 8000.0000 -181.23922 -178.07428 3.16495 1.84377 -177.83607 360.87446 FREEZING PROCESS: loop number 33 T-loop= 325.00000000000000 main_MD> interactions number 33 at Temperature= 325.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 0.44060 -2.42866 1.80121 force_rgl> df(natom) -1.38844 2.32847 3.51526 8005.0000 -181.40804 -178.43910 2.96894 1.81189 -178.38268 337.52549 8010.0000 -181.67080 -178.58538 3.08542 1.78615 -178.82403 317.47284 8015.0000 -181.42680 -178.17145 3.25536 1.79902 -178.60335 326.21719 8020.0000 -181.49736 -178.55727 2.94009 1.82107 -178.22526 347.58742 8025.0000 -181.28879 -178.32635 2.96244 1.80728 -178.46173 332.45417 8030.0000 -181.63122 -178.68929 2.94192 1.79048 -178.74984 319.11163 8035.0000 -181.41071 -178.64720 2.76351 1.79980 -178.58999 326.63592 8040.0000 -181.56652 -178.53321 3.03331 1.79780 -178.62424 320.64299 8045.0000 -181.22483 -178.31667 2.90816 1.81703 -178.29452 344.54703 8050.0000 -181.80239 -178.73452 3.06787 1.81637 -178.30587 346.11624 8055.0000 -181.63771 -178.67335 2.96436 1.79213 -178.72154 318.99262 8060.0000 -181.22319 -178.44699 2.77620 1.80596 -178.48441 335.84087 8065.0000 -181.80278 -178.80673 2.99606 1.79987 -178.58868 330.40010 8070.0000 -181.29193 -178.36914 2.92278 1.79516 -178.66950 324.83261 8075.0000 -181.33934 -178.19736 3.14198 1.80252 -178.54340 330.04832 8080.0000 -181.85525 -178.79928 3.05597 1.80942 -178.42508 337.64663 8085.0000 -181.33168 -178.28019 3.05149 1.79722 -178.63427 323.37216 8090.0000 -181.79816 -178.75236 3.04580 1.79308 -178.70513 321.41549 8095.0000 -181.69655 -178.75351 2.94304 1.80526 -178.49636 335.80885 8100.0000 -181.70063 -178.85742 2.84321 1.78569 -178.83187 313.92006 8105.0000 -181.49025 -178.70246 2.78779 1.79194 -178.72466 322.05629 8110.0000 -181.28236 -178.07858 3.20378 1.80983 -178.41791 333.56663 8115.0000 -181.57045 -177.88106 3.68939 1.83342 -178.01355 355.56393 8120.0000 -181.74532 -178.65240 3.09292 1.80344 -178.52759 328.63940 8125.0000 -181.62350 -178.32168 3.30182 1.81280 -178.36704 339.26943 8130.0000 -181.74693 -178.29754 3.44939 1.81570 -178.31732 341.57363 8135.0000 -181.28187 -178.73489 2.54698 1.81473 -178.33391 339.22741 8140.0000 -181.56853 -178.61698 2.95154 1.79706 -178.63687 325.41419 8145.0000 -181.74497 -178.73622 3.00875 1.78963 -178.76437 318.55129 8150.0000 -182.00884 -178.96952 3.03932 1.78375 -178.86518 312.43312 8155.0000 -181.69182 -178.49316 3.19865 1.77865 -178.95265 309.73264 8160.0000 -181.72034 -178.74676 2.97358 1.78705 -178.80855 317.20925 8165.0000 -181.76235 -178.74157 3.02078 1.80240 -178.54537 331.99338 8170.0000 -181.86283 -178.88407 2.97876 1.80397 -178.51847 327.70958 8175.0000 -181.93834 -178.88335 3.05500 1.79956 -178.59410 329.40284 8180.0000 -181.64247 -178.78570 2.85677 1.78289 -178.87995 304.24929 8185.0000 -181.43252 -178.06482 3.36770 1.80759 -178.45635 333.32720 8190.0000 -181.36813 -178.89022 2.47791 1.79106 -178.73974 319.62474 8195.0000 -181.72564 -179.07654 2.64910 1.77352 -179.04065 310.97848 8200.0000 -181.43857 -178.75919 2.67938 1.76517 -179.18374 294.86217 8205.0000 -181.34380 -178.42232 2.92148 1.79675 -178.64233 324.78817 8210.0000 -181.17109 -177.93519 3.23590 1.82875 -178.09359 355.51366 8215.0000 -181.43247 -178.46261 2.96986 1.81213 -178.37863 333.30655 8220.0000 -181.40007 -178.73702 2.66305 1.79566 -178.66089 322.61308 8225.0000 -181.97260 -178.78757 3.18503 1.79109 -178.73929 321.13447 8230.0000 -181.56890 -178.28582 3.28308 1.81141 -178.39095 337.94484 8235.0000 -181.24298 -178.47411 2.76887 1.81677 -178.29900 338.61699 8240.0000 -180.94534 -177.57650 3.36884 1.82880 -178.09264 350.02502 8245.0000 -181.63882 -178.51128 3.12754 1.84083 -177.88651 364.22715 8250.0000 -181.75694 -178.96080 2.79614 1.78258 -178.88518 308.52943 FREEZING PROCESS: loop number 34 T-loop= 300.00000000000000 main_MD> interactions number 34 at Temperature= 300.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 0.62461 1.53759 0.46265 force_rgl> df(natom) 0.91213 -0.41606 0.32308 8255.0000 -181.95326 -179.03943 2.91383 1.79199 -178.72385 319.33010 8260.0000 -182.03817 -179.49216 2.54601 1.77593 -178.99925 306.86257 8265.0000 -181.61287 -179.27276 2.34012 1.75451 -179.36654 287.75558 8270.0000 -182.17427 -179.74438 2.42988 1.75593 -179.34214 289.09403 8275.0000 -181.85099 -179.47889 2.37210 1.75645 -179.33334 290.92050 8280.0000 -181.79730 -178.91940 2.87790 1.76523 -179.18270 299.05041 8285.0000 -181.86839 -179.75751 2.11088 1.76062 -179.26170 293.87498 8290.0000 -182.34113 -179.38468 2.95645 1.74585 -179.51500 282.54697 8295.0000 -181.46091 -178.97307 2.48784 1.77525 -179.01091 307.49530 8300.0000 -182.39649 -179.86412 2.53237 1.74707 -179.49405 280.99988 8305.0000 -181.88739 -179.73964 2.14775 1.72640 -179.84849 267.14617 8310.0000 -181.97188 -179.20814 2.76375 1.73488 -179.70306 269.71309 8315.0000 -181.55509 -178.62067 2.93442 1.78535 -178.83769 311.90409 8320.0000 -182.05050 -179.56658 2.48392 1.75644 -179.33346 290.33303 8325.0000 -181.61992 -178.94806 2.67186 1.77463 -179.02160 304.06923 8330.0000 -181.18146 -178.33557 2.84589 1.79103 -178.74041 318.03498 8335.0000 -181.89797 -179.05841 2.83956 1.79025 -178.75378 320.78782 8340.0000 -182.13425 -179.40283 2.73142 1.75900 -179.28948 289.52189 8345.0000 -181.91447 -179.11671 2.79775 1.77109 -179.08222 303.84238 8350.0000 -181.83356 -179.14600 2.68756 1.75553 -179.34900 292.80827 8355.0000 -182.01669 -179.58947 2.42722 1.77613 -178.99573 306.68860 8360.0000 -182.04065 -179.29138 2.74927 1.75657 -179.33121 287.61148 8365.0000 -181.66353 -178.93393 2.72960 1.75008 -179.44255 284.36197 8370.0000 -182.10904 -179.62759 2.48145 1.77772 -178.96850 306.33475 8375.0000 -182.14118 -179.52537 2.61581 1.75050 -179.43525 282.78359 8380.0000 -182.07608 -179.24291 2.83318 1.75898 -179.28985 290.53123 8385.0000 -181.96334 -179.42010 2.54324 1.75044 -179.43623 286.29451 8390.0000 -181.37590 -178.45383 2.92208 1.78094 -178.91332 308.46599 8395.0000 -181.92785 -179.07365 2.85421 1.79458 -178.67938 324.08687 8400.0000 -182.21233 -179.09354 3.11879 1.77021 -179.09741 301.03113 8405.0000 -181.27222 -178.48561 2.78661 1.78168 -178.90065 309.79949 8410.0000 -181.99144 -178.98419 3.00725 1.77811 -178.96189 309.52668 8415.0000 -182.15229 -179.58791 2.56438 1.75859 -179.29656 292.16473 8420.0000 -181.91874 -179.64148 2.27726 1.74659 -179.50235 281.83179 8425.0000 -181.71942 -179.03598 2.68344 1.76632 -179.16406 297.96097 8430.0000 -181.78317 -179.21886 2.56431 1.77261 -179.05620 307.26343 8435.0000 -181.57755 -179.11380 2.46376 1.76463 -179.19294 295.06557 8440.0000 -181.50352 -178.76850 2.73502 1.78372 -178.86561 314.50248 8445.0000 -182.12535 -179.34969 2.77566 1.76129 -179.25034 295.10809 8450.0000 -182.34381 -179.56131 2.78250 1.76154 -179.24594 292.72929 8455.0000 -182.06130 -179.29458 2.76672 1.74191 -179.58256 276.96033 8460.0000 -181.71355 -178.79941 2.91413 1.78677 -178.81331 315.78544 8465.0000 -182.07613 -179.01846 3.05768 1.79625 -178.65084 323.88641 8470.0000 -181.75567 -179.34649 2.40918 1.76437 -179.19738 294.76435 8475.0000 -182.04730 -179.40952 2.63779 1.75484 -179.36087 285.57650 8480.0000 -182.43420 -179.37834 3.05586 1.76043 -179.26504 293.83001 8485.0000 -181.99701 -179.68957 2.30744 1.74560 -179.51925 282.98613 8490.0000 -181.63369 -178.85985 2.77384 1.75174 -179.41397 285.34866 8495.0000 -182.04906 -179.77986 2.26920 1.77742 -178.97368 306.28390 8500.0000 -182.01971 -179.64644 2.37327 1.72557 -179.86279 263.63790 main_MD> EXECUTION TIME: 0 [day], 0 [hour], 12 [min], 46.3131470 [s]. main_MD> Deallocating global variables