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_39.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 = 39 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: 39 3900 main_MD> Size of nv and nvoiz: 39 3900 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 = 39 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> 0.16550243492765196 -8.3150254294236652E-003 -0.18136061270137668 initial drift of cluster / NP1 for coalescence init> 0.36605591744002647 0.32396798053290959 0.25376028507286880 scaling for velocity /for coalescence NP1 init.f90 > facguy = 3.6488297939666512E-003 preparo> IN BIGVOI : LIMIT 1.2247448652052084 1.2247448652052084 1.2247448652052084 preparo> END t=0 TIME STEP force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -0.39359 -1.35759 2.06073 force_rgl> df(natom) 4.64494 -7.31512 -1.57583 preparo> THERMALIZATION PROCESS AT 1156.1892712837368 preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA 5000 -85.524760871382384 4.1773240212140443 -89.702084892596432 5.6614100292264329E-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= 1130.0000000000000 main_MD> interactions number 1 at Temperature= 1130.0000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -0.69074 -1.09800 0.43859 force_rgl> df(natom) 1.67140 2.82334 1.10820 5.0000 -90.68458 -85.74433 4.94025 2.65796 -84.48262 1105.50367 10.0000 -91.46843 -86.14522 5.32321 2.57808 -85.40132 1061.63541 15.0000 -89.85363 -84.35305 5.50058 2.61541 -84.97193 1092.86686 20.0000 -89.06585 -82.03482 7.03103 2.78224 -83.05340 1244.29217 25.0000 -88.33419 -82.48113 5.85306 2.86938 -82.05119 1270.68239 30.0000 -89.40128 -82.48046 6.92082 2.84986 -82.27575 1253.45815 35.0000 -88.24885 -81.95443 6.29441 2.86082 -82.14971 1244.27004 40.0000 -89.93180 -83.14691 6.78489 2.76245 -83.28101 1219.97351 45.0000 -91.61650 -85.45512 6.16138 2.67823 -84.24952 1102.38894 50.0000 -88.86663 -83.03204 5.83459 2.73849 -83.55649 1167.09344 55.0000 -89.79184 -85.63449 4.15735 2.62875 -84.81855 1067.74550 60.0000 -90.05930 -84.46714 5.59216 2.70508 -83.94075 1142.83392 65.0000 -89.69803 -85.56039 4.13764 2.67874 -84.24364 1126.80083 70.0000 -90.62487 -84.81801 5.80686 2.61254 -85.00501 1030.27253 75.0000 -89.18647 -83.45134 5.73514 2.68604 -84.15964 1135.57961 80.0000 -91.56211 -84.84442 6.71769 2.68736 -84.14447 1143.49559 85.0000 -89.43045 -85.14843 4.28202 2.59687 -85.18512 1072.26118 90.0000 -90.07661 -84.41113 5.66548 2.58513 -85.32017 1078.63819 95.0000 -87.42186 -82.52428 4.89758 2.75456 -83.37166 1160.05145 100.0000 -87.55430 -80.41532 7.13898 2.92898 -81.36579 1299.81059 105.0000 -89.14313 -84.46217 4.68096 2.84408 -82.34221 1256.18804 110.0000 -89.19189 -84.03550 5.15639 2.68413 -84.18170 1086.44592 115.0000 -89.89421 -85.21835 4.67585 2.60861 -85.05014 1055.36043 120.0000 -90.78051 -85.65445 5.12606 2.61086 -85.02424 1072.70696 125.0000 -90.86187 -85.90869 4.95318 2.55335 -85.68568 1057.23176 130.0000 -91.32447 -85.75776 5.56671 2.50245 -86.27105 947.24631 135.0000 -88.99963 -83.20000 5.79963 2.68615 -84.15838 1101.15429 140.0000 -88.57002 -82.53087 6.03915 2.84104 -82.37715 1219.91403 145.0000 -88.38028 -82.90857 5.47172 2.82215 -82.59434 1243.61903 150.0000 -90.82634 -84.32891 6.49744 2.72869 -83.66918 1196.48504 155.0000 -90.26574 -84.95745 5.30829 2.67497 -84.28695 1135.47562 160.0000 -90.14557 -84.09353 6.05205 2.61084 -85.02452 1077.24071 165.0000 -87.90967 -81.02098 6.88869 2.74833 -83.44336 1208.86921 170.0000 -87.83774 -81.60222 6.23552 2.96112 -80.99613 1347.54583 175.0000 -90.11646 -84.12574 5.99071 2.83671 -82.42695 1242.99476 180.0000 -88.59524 -83.24618 5.34907 2.71145 -83.86745 1144.92695 185.0000 -90.66296 -83.05428 7.60868 2.82876 -82.51838 1283.02078 190.0000 -89.19743 -83.89890 5.29853 2.77268 -83.16326 1240.09961 195.0000 -90.16998 -85.17324 4.99675 2.65957 -84.46410 1123.19128 200.0000 -90.62478 -85.57484 5.04994 2.61039 -85.02969 1099.08993 205.0000 -91.33023 -84.79262 6.53761 2.59287 -85.23120 996.62967 210.0000 -88.54281 -81.78248 6.76032 2.75833 -83.32836 1163.18046 215.0000 -89.51654 -83.77048 5.74606 2.80429 -82.79983 1205.73821 220.0000 -89.28076 -83.67820 5.60256 2.76202 -83.28595 1205.07412 225.0000 -90.46038 -84.37435 6.08602 2.77860 -83.09519 1254.10742 230.0000 -88.97326 -84.32825 4.64501 2.67355 -84.30330 1071.01262 235.0000 -89.11918 -82.24645 6.87273 2.74702 -83.45841 1112.72818 240.0000 -88.87402 -81.95382 6.92019 2.85500 -82.21665 1228.79390 245.0000 -88.90644 -84.09108 4.81536 2.82493 -82.56238 1229.24291 250.0000 -89.80422 -82.74791 7.05631 2.72733 -83.68486 1195.80002 FREEZING PROCESS: loop number 2 T-loop= 1105.0000000000000 main_MD> interactions number 2 at Temperature= 1105.0000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -0.20726 -2.83599 -0.79114 force_rgl> df(natom) -9.77090 5.07983 4.98118 255.0000 -90.70454 -84.43821 6.26633 2.69241 -84.08638 1191.38369 260.0000 -88.80341 -83.09745 5.70596 2.68976 -84.11695 1145.81666 265.0000 -89.89959 -82.24271 7.65688 2.78059 -83.07232 1192.42146 270.0000 -89.04980 -83.54292 5.50688 2.82151 -82.60171 1228.11352 275.0000 -90.45197 -83.71830 6.73367 2.76191 -83.28711 1182.41509 280.0000 -88.44937 -82.08426 6.36512 2.79578 -82.89769 1222.85507 285.0000 -91.20735 -85.22221 5.98514 2.71932 -83.77694 1142.29977 290.0000 -91.24992 -86.04519 5.20474 2.50912 -86.19435 956.95396 295.0000 -89.19549 -84.99290 4.20259 2.60452 -85.09717 1083.59664 300.0000 -89.42916 -85.22776 4.20140 2.60550 -85.08588 1066.76800 305.0000 -89.71608 -83.83136 5.88472 2.66176 -84.43895 1107.76999 310.0000 -89.90287 -83.56746 6.33541 2.65234 -84.54723 1057.33809 315.0000 -90.62759 -85.25734 5.37025 2.64951 -84.57976 1072.22571 320.0000 -89.08921 -82.85657 6.23264 2.75626 -83.35220 1170.11277 325.0000 -89.94362 -83.79093 6.15270 2.80380 -82.80547 1195.73806 330.0000 -89.35487 -83.52023 5.83464 2.67401 -84.29808 1136.01749 335.0000 -89.27055 -83.67120 5.59935 2.76101 -83.29750 1198.36880 340.0000 -88.24936 -82.84780 5.40156 2.79137 -82.94838 1240.73448 345.0000 -87.91358 -81.83055 6.08302 2.81078 -82.72518 1263.39926 350.0000 -89.95658 -83.89128 6.06530 2.79438 -82.91374 1236.91041 355.0000 -88.84389 -83.75117 5.09272 2.76978 -83.19660 1171.11654 360.0000 -89.41324 -82.90055 6.51268 2.71396 -83.83857 1110.08152 365.0000 -89.18812 -83.17149 6.01662 2.75789 -83.33342 1154.48741 370.0000 -90.06551 -83.63808 6.42743 2.76451 -83.25730 1177.04942 375.0000 -88.28724 -80.82560 7.46164 2.83263 -82.47391 1224.35165 380.0000 -90.19443 -85.90448 4.28994 2.74571 -83.47348 1166.91890 385.0000 -91.02126 -85.55266 5.46859 2.55571 -85.65850 1021.71741 390.0000 -90.58684 -85.32573 5.26111 2.60446 -85.09790 1090.99338 395.0000 -91.09318 -85.33083 5.76234 2.54604 -85.76972 1047.59135 400.0000 -89.72178 -84.66096 5.06082 2.62406 -84.87245 1096.59246 405.0000 -89.88536 -83.94186 5.94349 2.70018 -83.99703 1126.33942 410.0000 -88.33090 -81.67520 6.65569 2.83179 -82.48353 1248.92405 415.0000 -88.33013 -82.15776 6.17238 2.81609 -82.66409 1193.45598 420.0000 -88.55261 -83.13417 5.41844 2.78323 -83.04200 1188.27590 425.0000 -90.79049 -83.97762 6.81286 2.70101 -83.98749 1166.53747 430.0000 -89.90729 -84.50131 5.40598 2.64861 -84.59013 1119.07433 435.0000 -89.67946 -83.99429 5.68517 2.75060 -83.41726 1170.19852 440.0000 -89.65754 -84.25295 5.40459 2.70835 -83.90307 1158.08939 445.0000 -88.79139 -82.91283 5.87856 2.76310 -83.27353 1181.79368 450.0000 -90.55862 -84.07533 6.48329 2.74335 -83.50066 1168.11452 455.0000 -90.03586 -84.89150 5.14436 2.69469 -84.06024 1175.11243 460.0000 -89.95226 -84.59957 5.35269 2.64328 -84.65140 1072.15477 465.0000 -90.92749 -85.55807 5.36943 2.62383 -84.87516 1056.13314 470.0000 -90.58019 -83.91047 6.66971 2.64226 -84.66319 1085.03671 475.0000 -91.34352 -84.34767 6.99585 2.64556 -84.62523 1142.22547 480.0000 -90.02973 -85.53968 4.49006 2.58174 -85.35915 1046.41062 485.0000 -91.02207 -86.76819 4.25388 2.52512 -86.01035 986.66709 490.0000 -90.50775 -85.20889 5.29887 2.52899 -85.96583 964.90673 495.0000 -90.89712 -85.97375 4.92337 2.57190 -85.47239 1000.13987 500.0000 -92.02154 -85.95900 6.06254 2.56593 -85.54100 1009.83287 FREEZING PROCESS: loop number 3 T-loop= 1080.0000000000000 main_MD> interactions number 3 at Temperature= 1080.0000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 1.20699 -3.00181 0.04138 force_rgl> df(natom) -2.10509 -1.93251 -0.21187 505.0000 -90.02521 -85.50339 4.52182 2.59566 -85.19911 1032.37625 510.0000 -90.63863 -84.70873 5.92991 2.62947 -84.81031 1075.80149 515.0000 -89.29266 -83.96565 5.32701 2.67732 -84.25993 1120.17035 520.0000 -89.42748 -83.80612 5.62136 2.70750 -83.91286 1171.03505 525.0000 -90.33252 -84.30984 6.02268 2.71127 -83.86950 1111.87215 530.0000 -89.57647 -84.17337 5.40311 2.67690 -84.26478 1096.75502 535.0000 -91.36306 -86.43958 4.92348 2.63331 -84.76612 1036.32744 540.0000 -92.36927 -85.91942 6.44985 2.49180 -86.39350 926.36659 545.0000 -89.36842 -84.03007 5.33835 2.63279 -84.77212 1069.22881 550.0000 -89.94817 -85.20783 4.74033 2.60968 -85.03781 1078.59296 555.0000 -91.44546 -83.51914 7.92632 2.66813 -84.36562 1092.27357 560.0000 -89.18894 -83.44103 5.74791 2.71011 -83.88284 1157.38834 565.0000 -90.00867 -83.32771 6.68095 2.69848 -84.01661 1095.07189 570.0000 -89.46272 -82.97836 6.48435 2.87102 -82.03233 1256.91835 575.0000 -90.45628 -83.76771 6.68857 2.70860 -83.90021 1107.22015 580.0000 -90.61904 -85.42244 5.19660 2.65996 -84.45963 1110.70208 585.0000 -88.43230 -83.94040 4.49190 2.56468 -85.55542 998.60110 590.0000 -88.55311 -82.20746 6.34565 2.75588 -83.35650 1181.80963 595.0000 -90.63454 -85.41901 5.21553 2.62216 -84.89438 1090.19076 600.0000 -89.16115 -83.35670 5.80444 2.74849 -83.44154 1180.62362 605.0000 -89.29520 -83.13990 6.15529 2.76720 -83.22636 1193.43789 610.0000 -89.66110 -83.58740 6.07370 2.74100 -83.52764 1179.61299 615.0000 -91.33191 -85.61967 5.71224 2.59209 -85.24015 1056.35582 620.0000 -91.17789 -85.38090 5.79699 2.55802 -85.63195 1043.92577 625.0000 -92.77398 -87.60893 5.16505 2.44592 -86.92118 910.43190 630.0000 -90.17577 -84.47722 5.69856 2.49428 -86.36495 988.10741 635.0000 -90.60660 -84.37390 6.23270 2.65260 -84.54422 1098.50393 640.0000 -89.54123 -84.51494 5.02629 2.61380 -84.99043 1080.52775 645.0000 -91.09122 -85.28172 5.80950 2.62915 -84.81390 1081.38014 650.0000 -91.73428 -85.63220 6.10208 2.50768 -86.21091 970.07879 655.0000 -92.02259 -86.09295 5.92965 2.56315 -85.57298 1037.96911 660.0000 -90.03338 -85.29396 4.73942 2.58009 -85.37819 1036.26222 665.0000 -89.68426 -83.63618 6.04808 2.62965 -84.80824 1063.60661 670.0000 -89.31309 -84.46328 4.84981 2.69477 -84.05931 1122.12835 675.0000 -90.22820 -83.22428 7.00393 2.68627 -84.15701 1115.66302 680.0000 -88.40261 -83.08806 5.31455 2.77511 -83.13532 1178.26768 685.0000 -88.71230 -81.20930 7.50300 2.86878 -82.05814 1253.18556 690.0000 -88.10837 -81.80412 6.30425 2.91990 -81.47026 1277.74463 695.0000 -90.24608 -83.50844 6.73764 2.75564 -83.35926 1203.43357 700.0000 -89.81357 -83.68803 6.12554 2.71625 -83.81222 1147.27070 705.0000 -88.83891 -83.69642 5.14249 2.70835 -83.90310 1128.13345 710.0000 -89.61368 -83.45883 6.15486 2.77758 -83.10692 1255.66047 715.0000 -89.79256 -85.30715 4.48541 2.70773 -83.91022 1125.83199 720.0000 -89.99765 -84.24620 5.75146 2.61772 -84.94540 1063.07442 725.0000 -89.72083 -84.75738 4.96345 2.70507 -83.94083 1208.24442 730.0000 -91.19138 -85.22353 5.96786 2.58367 -85.33695 1054.30690 735.0000 -90.05859 -85.56234 4.49625 2.60809 -85.05612 1073.64344 740.0000 -88.92697 -85.06788 3.85909 2.64876 -84.58843 1068.25491 745.0000 -91.25338 -86.21936 5.03401 2.52495 -86.01232 976.75384 750.0000 -90.10250 -84.14347 5.95903 2.62576 -84.85290 1075.35590 FREEZING PROCESS: loop number 4 T-loop= 1055.0000000000000 main_MD> interactions number 4 at Temperature= 1055.0000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -1.03850 1.41140 1.21723 force_rgl> df(natom) -1.12987 0.68325 -0.35455 755.0000 -88.12994 -82.48415 5.64578 2.76268 -83.27834 1170.76206 760.0000 -89.06594 -81.43598 7.62996 2.85357 -82.23308 1239.16912 765.0000 -88.39578 -81.48849 6.90729 2.92600 -81.40007 1317.04808 770.0000 -88.37889 -84.02264 4.35625 2.84729 -82.30530 1257.30744 775.0000 -90.56290 -84.84020 5.72270 2.72018 -83.76702 1134.03902 780.0000 -89.42540 -84.45330 4.97210 2.66535 -84.39764 1092.35824 785.0000 -91.23705 -85.68055 5.55650 2.59461 -85.21119 1074.78790 790.0000 -89.86389 -84.28743 5.57646 2.61864 -84.93482 1113.53877 795.0000 -89.40949 -84.08485 5.32464 2.66765 -84.37119 1121.19577 800.0000 -90.99720 -85.37042 5.62678 2.66067 -84.45140 1130.31740 805.0000 -90.66752 -85.55290 5.11462 2.56880 -85.50798 1052.37845 810.0000 -89.90263 -85.48179 4.42084 2.58150 -85.36191 1053.18396 815.0000 -89.43895 -84.22750 5.21145 2.64535 -84.62764 1074.68776 820.0000 -90.08172 -83.94921 6.13251 2.69224 -84.08835 1085.43351 825.0000 -89.86655 -84.77400 5.09255 2.69572 -84.04843 1136.75228 830.0000 -91.94642 -86.51856 5.42786 2.46935 -86.65168 923.40906 835.0000 -90.72283 -85.01745 5.70538 2.56774 -85.52018 1045.61165 840.0000 -89.25896 -84.10551 5.15345 2.65765 -84.48614 1089.49787 845.0000 -91.28945 -85.50167 5.78779 2.59527 -85.20352 1048.36856 850.0000 -90.47735 -84.36494 6.11241 2.62811 -84.82594 1081.54146 855.0000 -91.27520 -85.60810 5.66710 2.66401 -84.41302 1135.34188 860.0000 -89.65852 -84.93945 4.71907 2.63277 -84.77229 1085.90975 865.0000 -90.82421 -85.17175 5.65245 2.59929 -85.15734 1071.96866 870.0000 -90.04256 -85.80414 4.23841 2.60835 -85.05311 1043.32185 875.0000 -92.01034 -87.52785 4.48249 2.53367 -85.91201 1013.41056 880.0000 -92.44153 -87.11461 5.32693 2.40674 -87.37172 910.96157 885.0000 -88.98087 -84.55411 4.42675 2.52733 -85.98494 1013.43041 890.0000 -89.43391 -83.52903 5.90488 2.75858 -83.32549 1191.93071 895.0000 -90.60941 -83.91568 6.69373 2.63894 -84.70134 1061.71138 900.0000 -89.73361 -84.44023 5.29338 2.65390 -84.52928 1128.05344 905.0000 -90.99965 -83.90423 7.09542 2.60571 -85.08346 1103.84714 910.0000 -90.60340 -85.95697 4.64642 2.61201 -85.01111 1098.20664 915.0000 -91.09902 -85.33179 5.76723 2.55945 -85.61557 971.28987 920.0000 -90.16628 -85.48466 4.68162 2.53701 -85.87358 960.91083 925.0000 -89.78034 -85.09669 4.68365 2.59074 -85.25570 1078.55317 930.0000 -90.30005 -85.87709 4.42296 2.57969 -85.38279 1022.69394 935.0000 -90.05662 -84.28484 5.77178 2.59508 -85.20580 1064.48067 940.0000 -90.37426 -84.52474 5.84952 2.76598 -83.24034 1161.52174 945.0000 -91.85867 -86.29744 5.56123 2.58441 -85.32843 1044.02977 950.0000 -89.94295 -84.22365 5.71930 2.56125 -85.59480 1024.69576 955.0000 -90.06352 -84.52101 5.54252 2.66010 -84.45801 1089.42703 960.0000 -89.02646 -84.31745 4.70901 2.71288 -83.85103 1168.35838 965.0000 -88.47095 -83.35302 5.11793 2.63847 -84.70675 1057.85346 970.0000 -88.19537 -82.32019 5.87518 2.70126 -83.98470 1114.01948 975.0000 -90.22816 -83.13558 7.09258 2.79828 -82.86884 1184.85299 980.0000 -89.47728 -84.13843 5.33885 2.73238 -83.62676 1132.34912 985.0000 -92.11783 -86.84984 5.26799 2.60287 -85.11613 1077.50524 990.0000 -91.56591 -85.92095 5.64496 2.52301 -86.03464 1031.11074 995.0000 -89.58590 -84.79469 4.79121 2.60267 -85.11843 1052.16415 1000.0000 -90.65411 -84.96533 5.68878 2.58111 -85.36637 1029.20121 FREEZING PROCESS: loop number 5 T-loop= 1030.0000000000000 main_MD> interactions number 5 at Temperature= 1030.0000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 0.12070 -3.35126 1.27534 force_rgl> df(natom) -2.89926 -2.09457 1.04802 1005.0000 -90.75362 -85.93570 4.81792 2.56085 -85.59943 1010.67395 1010.0000 -90.47064 -85.27892 5.19172 2.61151 -85.01677 1072.84005 1015.0000 -90.02611 -84.85866 5.16745 2.59990 -85.15034 1065.50083 1020.0000 -92.02565 -85.27026 6.75539 2.62959 -84.80885 1074.01157 1025.0000 -90.35362 -84.83006 5.52355 2.63734 -84.71976 1067.53079 1030.0000 -90.33946 -85.11204 5.22741 2.61461 -84.98122 1119.79236 1035.0000 -91.02255 -85.39854 5.62401 2.54932 -85.73201 1027.52677 1040.0000 -90.31508 -84.75020 5.56488 2.57205 -85.47065 1032.70791 1045.0000 -90.64527 -84.28335 6.36193 2.63427 -84.75502 1095.52757 1050.0000 -89.98932 -85.56251 4.42681 2.60569 -85.08370 1026.28580 1055.0000 -89.51172 -84.35817 5.15356 2.64776 -84.59989 1093.85398 1060.0000 -90.42397 -85.26503 5.15894 2.63839 -84.70766 1112.54949 1065.0000 -90.12280 -84.50545 5.61735 2.56825 -85.51427 1004.22344 1070.0000 -91.72898 -87.14789 4.58109 2.54856 -85.74079 1018.20099 1075.0000 -92.02567 -87.45908 4.56660 2.39736 -87.47965 896.95186 1080.0000 -90.90958 -86.21598 4.69360 2.51135 -86.16867 988.90189 1085.0000 -91.38146 -86.47667 4.90479 2.57011 -85.49290 990.69571 1090.0000 -91.19864 -87.19203 4.00661 2.48877 -86.42836 992.12050 1095.0000 -90.84955 -85.40749 5.44206 2.47657 -86.56867 956.66020 1100.0000 -89.58672 -84.46724 5.11949 2.58684 -85.30051 1005.06189 1105.0000 -90.88275 -86.19920 4.68355 2.56654 -85.53394 1008.24066 1110.0000 -91.65668 -87.45010 4.20658 2.44560 -86.92488 932.00487 1115.0000 -91.34850 -86.60400 4.74450 2.45975 -86.76214 951.72844 1120.0000 -92.48727 -86.88284 5.60443 2.41933 -87.22699 943.72419 1125.0000 -91.58318 -87.10027 4.48291 2.44640 -86.91559 955.17635 1130.0000 -92.17000 -85.85605 6.31396 2.48258 -86.49954 991.92566 1135.0000 -90.74713 -86.35500 4.39213 2.49972 -86.30243 970.88743 1140.0000 -90.12953 -85.66532 4.46421 2.54586 -85.77179 1008.24744 1145.0000 -89.54951 -85.58627 3.96324 2.47222 -86.61872 938.38500 1150.0000 -89.91865 -83.87365 6.04501 2.58334 -85.34076 1002.60282 1155.0000 -90.63195 -85.22200 5.40995 2.67774 -84.25515 1133.75832 1160.0000 -90.50989 -85.29607 5.21382 2.55130 -85.70924 1025.68665 1165.0000 -90.04809 -85.34165 4.70644 2.57789 -85.40345 973.69880 1170.0000 -90.75931 -86.36198 4.39733 2.48751 -86.44285 958.81722 1175.0000 -90.07445 -85.66283 4.41162 2.51509 -86.12571 982.27529 1180.0000 -89.85961 -84.55331 5.30630 2.61775 -84.94505 1068.80324 1185.0000 -89.95285 -84.14822 5.80463 2.67829 -84.24881 1144.91791 1190.0000 -91.32104 -85.52641 5.79462 2.56920 -85.50338 1040.42818 1195.0000 -90.48327 -84.97567 5.50760 2.57904 -85.39020 1023.55042 1200.0000 -91.03706 -85.61250 5.42456 2.66002 -84.45893 1113.11337 1205.0000 -90.44500 -85.13995 5.30505 2.59410 -85.21708 1062.62652 1210.0000 -89.98487 -83.47821 6.50665 2.66040 -84.45460 1109.66562 1215.0000 -90.62653 -85.01358 5.61295 2.62210 -84.89499 1060.59944 1220.0000 -90.64767 -84.37608 6.27159 2.60405 -85.10262 1061.26012 1225.0000 -90.29629 -84.77014 5.52615 2.66403 -84.41280 1118.84282 1230.0000 -89.94795 -84.43450 5.51344 2.64782 -84.59923 1046.99628 1235.0000 -90.36975 -85.53404 4.83570 2.66669 -84.38221 1117.86681 1240.0000 -89.98112 -86.05640 3.92472 2.56171 -85.58947 1010.13273 1245.0000 -90.56737 -84.75449 5.81288 2.56331 -85.57117 1012.86968 1250.0000 -91.17231 -85.80172 5.37059 2.62935 -84.81167 1052.89079 FREEZING PROCESS: loop number 6 T-loop= 1005.0000000000000 main_MD> interactions number 6 at Temperature= 1005.0000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -1.05959 -0.87009 1.95936 force_rgl> df(natom) 1.50569 1.21742 1.86263 1255.0000 -91.51872 -85.63534 5.88337 2.53118 -85.94061 994.26768 1260.0000 -90.50862 -84.85259 5.65602 2.57293 -85.46048 999.71412 1265.0000 -92.24244 -85.57964 6.66280 2.63392 -84.75914 1056.15628 1270.0000 -90.19751 -85.09776 5.09974 2.60267 -85.11848 1049.53083 1275.0000 -90.10045 -85.83526 4.26519 2.55112 -85.71128 1010.56753 1280.0000 -90.93192 -84.43542 6.49649 2.61398 -84.98840 1037.28430 1285.0000 -90.93164 -86.01480 4.91684 2.56941 -85.50102 992.04341 1290.0000 -89.65850 -85.22567 4.43282 2.59315 -85.22796 983.05881 1295.0000 -88.58502 -83.73297 4.85205 2.62603 -84.84978 1055.86238 1300.0000 -89.43591 -84.90418 4.53173 2.69592 -84.04609 1047.16506 1305.0000 -91.74211 -86.09197 5.65015 2.49944 -86.30569 912.69939 1310.0000 -91.22703 -85.46985 5.75718 2.55127 -85.70958 999.33396 1315.0000 -90.80583 -85.09491 5.71092 2.60547 -85.08630 1043.86559 1320.0000 -91.45003 -85.78291 5.66712 2.52985 -85.95590 981.39120 1325.0000 -91.26076 -85.59230 5.66846 2.55088 -85.71408 1067.65929 1330.0000 -90.70533 -86.32555 4.37978 2.48595 -86.46084 962.06683 1335.0000 -90.11064 -84.42403 5.68660 2.66501 -84.40152 1137.16335 1340.0000 -89.81875 -83.50622 6.31253 2.65413 -84.52670 1086.49602 1345.0000 -91.32356 -87.13823 4.18533 2.59355 -85.22340 1064.83547 1350.0000 -91.48178 -86.48025 5.00153 2.48279 -86.49708 974.46553 1355.0000 -90.75980 -86.46449 4.29531 2.48219 -86.50407 923.17636 1360.0000 -90.32437 -85.01936 5.30501 2.60628 -85.07691 1019.04351 1365.0000 -91.13714 -86.45103 4.68611 2.50568 -86.23391 970.94867 1370.0000 -91.86943 -86.66692 5.20252 2.50324 -86.26195 957.93111 1375.0000 -89.80385 -85.25112 4.55273 2.55360 -85.68277 1000.35188 1380.0000 -90.63853 -85.28635 5.35218 2.59895 -85.16130 1084.54539 1385.0000 -90.84339 -86.18335 4.66004 2.56854 -85.51099 1030.61121 1390.0000 -91.91798 -87.51618 4.40180 2.51469 -86.13022 1009.36873 1395.0000 -91.59225 -86.81944 4.77281 2.44012 -86.98788 900.65527 1400.0000 -91.68803 -86.96637 4.72166 2.48319 -86.49255 963.96926 1405.0000 -89.33908 -85.29299 4.04609 2.53193 -85.93198 961.62668 1410.0000 -89.18949 -84.65762 4.53187 2.57040 -85.48954 969.72017 1415.0000 -89.98734 -85.44167 4.54567 2.58305 -85.34407 1015.39312 1420.0000 -90.30022 -85.46672 4.83350 2.66828 -84.36398 1122.51074 1425.0000 -90.04614 -85.31644 4.72970 2.54198 -85.81648 899.57414 1430.0000 -90.20786 -85.11506 5.09280 2.57491 -85.43778 1056.79298 1435.0000 -91.27673 -85.77026 5.50647 2.55043 -85.71927 1004.25034 1440.0000 -91.15037 -85.30825 5.84211 2.52438 -86.01887 1018.45885 1445.0000 -91.83133 -86.75750 5.07383 2.50551 -86.23589 1004.56001 1450.0000 -90.73645 -85.50321 5.23324 2.52865 -85.96969 1016.24070 1455.0000 -90.83251 -85.71377 5.11874 2.56540 -85.54715 1041.69227 1460.0000 -90.33142 -85.26837 5.06306 2.52530 -86.00831 958.70585 1465.0000 -90.61766 -85.44920 5.16845 2.60733 -85.06487 1017.20555 1470.0000 -90.64807 -85.13017 5.51790 2.58285 -85.34644 1031.62633 1475.0000 -92.45113 -86.84277 5.60836 2.53511 -85.89548 1044.64239 1480.0000 -92.13182 -87.38260 4.74923 2.38083 -87.66976 881.04521 1485.0000 -90.90585 -84.77384 6.13201 2.50799 -86.20730 967.79602 1490.0000 -89.85032 -83.51073 6.33959 2.70610 -83.92901 1067.23410 1495.0000 -90.48425 -84.21325 6.27099 2.65792 -84.48312 1078.20749 1500.0000 -90.96370 -85.85758 5.10612 2.56409 -85.56211 1006.57005 FREEZING PROCESS: loop number 7 T-loop= 980.00000000000000 main_MD> interactions number 7 at Temperature= 980.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 0.97505 -0.13017 3.77898 force_rgl> df(natom) 0.81830 0.59406 -0.13382 1505.0000 -90.95485 -86.45010 4.50475 2.43664 -87.02786 922.80317 1510.0000 -91.49558 -86.68330 4.81228 2.53123 -85.94008 1002.99446 1515.0000 -90.13908 -85.74283 4.39626 2.44312 -86.95331 892.42557 1520.0000 -91.20075 -85.70098 5.49977 2.52612 -85.99886 963.99419 1525.0000 -91.10488 -86.17687 4.92802 2.54245 -85.81102 1008.26098 1530.0000 -90.36624 -84.40805 5.95819 2.65435 -84.52412 1111.25187 1535.0000 -90.62108 -85.15893 5.46214 2.64715 -84.60690 1073.91421 1540.0000 -89.21939 -84.31927 4.90012 2.65596 -84.50560 1088.87756 1545.0000 -91.76442 -86.73042 5.03400 2.53267 -85.92348 951.07892 1550.0000 -90.67316 -85.84090 4.83227 2.46513 -86.70028 969.67007 1555.0000 -91.94222 -86.78980 5.15242 2.50248 -86.27067 958.80646 1560.0000 -91.23644 -86.46480 4.77164 2.49470 -86.36013 976.27843 1565.0000 -91.87996 -88.26645 3.61351 2.40177 -87.42888 904.26957 1570.0000 -90.43201 -86.45820 3.97381 2.41624 -87.26250 905.92051 1575.0000 -91.51380 -86.10532 5.40847 2.51397 -86.13851 961.36590 1580.0000 -92.14201 -88.41895 3.72306 2.42561 -87.15476 941.11949 1585.0000 -91.55997 -87.13704 4.42293 2.40995 -87.33480 883.92283 1590.0000 -90.69355 -85.14434 5.54921 2.53769 -85.86581 945.18667 1595.0000 -89.75208 -83.66738 6.08470 2.66667 -84.38250 1129.99814 1600.0000 -89.48364 -84.67352 4.81012 2.64111 -84.67643 1027.99264 1605.0000 -90.14601 -85.58982 4.55618 2.56904 -85.50521 1028.15756 1610.0000 -89.49323 -83.94654 5.54669 2.57211 -85.46996 1024.53374 1615.0000 -90.51575 -86.00536 4.51039 2.64771 -84.60047 1059.06788 1620.0000 -91.80813 -86.42123 5.38690 2.53571 -85.88859 988.38551 1625.0000 -91.87638 -86.95716 4.91922 2.44841 -86.89255 894.73382 1630.0000 -91.05926 -85.47728 5.58199 2.52312 -86.03333 997.25251 1635.0000 -90.86336 -85.80465 5.05871 2.60007 -85.14843 1066.83926 1640.0000 -91.46172 -86.32681 5.13491 2.51012 -86.18285 972.43725 1645.0000 -89.83843 -85.23625 4.60218 2.55575 -85.65805 998.69516 1650.0000 -90.31033 -85.94691 4.36342 2.56560 -85.54476 983.41861 1655.0000 -92.13725 -85.94148 6.19578 2.55637 -85.65097 999.27136 1660.0000 -89.61974 -84.54319 5.07655 2.62238 -84.89176 1073.56536 1665.0000 -89.82859 -83.73745 6.09114 2.70470 -83.94514 1168.14309 1670.0000 -90.32128 -84.44004 5.88124 2.77896 -83.09113 1177.87951 1675.0000 -89.79178 -84.32476 5.46702 2.71117 -83.87074 1114.13896 1680.0000 -92.32664 -85.71260 6.61404 2.63054 -84.79797 1079.89325 1685.0000 -90.65500 -85.99497 4.66003 2.54185 -85.81787 998.65014 1690.0000 -90.99580 -85.72197 5.27383 2.52740 -85.98413 978.61975 1695.0000 -90.82555 -85.21064 5.61491 2.60164 -85.13033 1053.51316 1700.0000 -91.87170 -85.84333 6.02837 2.56414 -85.56160 995.16409 1705.0000 -91.42909 -87.71296 3.71613 2.43004 -87.10375 906.87289 1710.0000 -92.40206 -87.95382 4.44824 2.34148 -88.12224 807.24255 1715.0000 -93.44270 -88.12950 5.31320 2.33302 -88.21950 882.35408 1720.0000 -91.00926 -85.74387 5.26540 2.45320 -86.83738 906.76364 1725.0000 -88.87785 -84.08047 4.79737 2.61668 -84.95741 1055.04686 1730.0000 -89.85956 -85.39252 4.46704 2.62363 -84.87740 1045.72125 1735.0000 -90.17894 -84.96696 5.21198 2.56762 -85.52160 961.54569 1740.0000 -90.80231 -85.41651 5.38580 2.62276 -84.88740 1050.04761 1745.0000 -91.05337 -86.80879 4.24458 2.54579 -85.77258 1000.29618 1750.0000 -91.34674 -84.98818 6.35856 2.62028 -84.91595 1045.14429 FREEZING PROCESS: loop number 8 T-loop= 955.00000000000000 main_MD> interactions number 8 at Temperature= 955.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -0.42149 -1.08954 2.77419 force_rgl> df(natom) -0.01183 -2.70866 -1.77401 1755.0000 -89.92772 -85.17362 4.75410 2.58482 -85.32378 1048.09433 1760.0000 -91.81277 -86.30712 5.50565 2.54615 -85.76851 941.86726 1765.0000 -91.19154 -86.41262 4.77892 2.55010 -85.72301 995.74314 1770.0000 -91.54056 -85.48852 6.05204 2.56011 -85.60788 1023.13704 1775.0000 -89.82934 -84.46897 5.36037 2.56421 -85.56082 976.41408 1780.0000 -89.47017 -84.47995 4.99022 2.63722 -84.72117 1047.14884 1785.0000 -91.67249 -87.47448 4.19802 2.50811 -86.20592 953.03892 1790.0000 -90.91252 -86.74254 4.16998 2.42243 -87.19132 918.06405 1795.0000 -91.01651 -85.60144 5.41507 2.48123 -86.51502 959.31627 1800.0000 -89.99610 -84.70420 5.29190 2.61601 -84.96506 1101.53608 1805.0000 -90.92916 -86.48362 4.44554 2.53050 -85.94850 989.58821 1810.0000 -91.30789 -86.54489 4.76300 2.46797 -86.66761 921.07641 1815.0000 -90.97717 -85.83757 5.13960 2.51257 -86.15466 963.33033 1820.0000 -90.76976 -85.79697 4.97280 2.51654 -86.10894 944.05194 1825.0000 -90.01043 -84.78791 5.22252 2.61114 -85.02108 1059.65265 1830.0000 -90.24893 -83.75592 6.49300 2.67752 -84.25762 1085.78936 1835.0000 -90.60671 -85.96289 4.64382 2.66709 -84.37761 1123.03802 1840.0000 -93.14627 -87.98846 5.15781 2.42763 -87.13154 903.55923 1845.0000 -91.24596 -86.18714 5.05882 2.41578 -87.26778 887.53251 1850.0000 -91.87285 -85.41337 6.45949 2.54067 -85.83151 1024.94755 1855.0000 -91.01625 -85.70834 5.30792 2.58396 -85.33365 1018.13047 1860.0000 -90.92725 -86.43363 4.49362 2.53235 -85.92715 1015.41464 1865.0000 -89.93345 -83.94165 5.99180 2.58709 -85.29768 1031.11411 1870.0000 -90.07885 -85.25966 4.81918 2.62505 -84.86110 1057.18810 1875.0000 -92.56138 -86.70582 5.85556 2.54745 -85.75353 1052.76495 1880.0000 -92.36270 -87.74040 4.62230 2.39298 -87.53000 911.26974 1885.0000 -92.86225 -87.74665 5.11560 2.39389 -87.51947 933.66683 1890.0000 -92.25633 -87.46565 4.79068 2.35503 -87.96643 879.46948 1895.0000 -91.92596 -87.30045 4.62551 2.47121 -86.63036 915.20505 1900.0000 -91.46673 -87.18105 4.28568 2.36407 -87.86239 857.67204 1905.0000 -91.92809 -88.47787 3.45022 2.40317 -87.41281 924.70698 1910.0000 -93.33473 -88.98459 4.35015 2.32693 -88.28953 847.28110 1915.0000 -91.58766 -87.16882 4.41884 2.36038 -87.90493 849.49679 1920.0000 -90.07590 -85.04842 5.02748 2.44638 -86.91587 909.75209 1925.0000 -90.86630 -85.66619 5.20012 2.57990 -85.38029 1037.02250 1930.0000 -90.81698 -85.92883 4.88815 2.59075 -85.25561 1043.17785 1935.0000 -90.54493 -85.57787 4.96706 2.54102 -85.82742 982.32577 1940.0000 -92.34628 -87.41535 4.93093 2.43012 -87.10286 900.25961 1945.0000 -92.81985 -88.94575 3.87409 2.33810 -88.16111 835.30632 1950.0000 -91.41503 -87.46194 3.95309 2.35500 -87.96674 818.46194 1955.0000 -90.97989 -85.94327 5.03663 2.53484 -85.89856 979.62098 1960.0000 -90.34120 -84.69281 5.64838 2.53991 -85.84026 974.33061 1965.0000 -91.59182 -86.00929 5.58253 2.58410 -85.33207 1003.00059 1970.0000 -91.35837 -86.50577 4.85259 2.48252 -86.50028 945.25953 1975.0000 -89.25135 -84.20528 5.04607 2.61291 -85.00070 1050.81899 1980.0000 -91.10694 -85.83752 5.26942 2.61818 -84.94010 1035.19577 1985.0000 -90.86399 -85.43193 5.43206 2.54505 -85.78117 1003.10131 1990.0000 -91.42996 -85.97884 5.45112 2.53961 -85.84363 984.54589 1995.0000 -91.15375 -86.73879 4.41496 2.46232 -86.73259 911.35457 2000.0000 -89.98165 -85.12318 4.85847 2.52826 -85.97426 989.96943 FREEZING PROCESS: loop number 9 T-loop= 930.00000000000000 main_MD> interactions number 9 at Temperature= 930.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 0.55750 -1.28532 0.02148 force_rgl> df(natom) -0.43456 0.90562 1.18062 2005.0000 -91.44179 -86.79072 4.65106 2.44969 -86.87781 860.89755 2010.0000 -92.15589 -87.61674 4.53915 2.41022 -87.33168 883.87128 2015.0000 -90.87231 -86.16507 4.70724 2.40378 -87.40573 900.29745 2020.0000 -90.90063 -86.32014 4.58049 2.49666 -86.33758 954.17833 2025.0000 -91.47477 -87.31625 4.15853 2.44390 -86.94433 900.81404 2030.0000 -90.58357 -86.56552 4.01806 2.48368 -86.48690 934.43558 2035.0000 -91.45009 -87.76822 3.68187 2.47106 -86.63204 939.35127 2040.0000 -92.55201 -88.10769 4.44432 2.40166 -87.43018 851.37619 2045.0000 -92.50515 -88.14238 4.36276 2.33439 -88.20375 829.96934 2050.0000 -92.77424 -87.99587 4.77838 2.40269 -87.41831 895.53711 2055.0000 -91.38359 -85.95095 5.43264 2.44773 -86.90032 948.47527 2060.0000 -91.03751 -85.69800 5.33951 2.55004 -85.72375 1016.85192 2065.0000 -91.49568 -86.51971 4.97597 2.50079 -86.29012 958.73731 2070.0000 -90.18157 -85.22955 4.95201 2.56685 -85.53040 1010.33411 2075.0000 -91.85211 -86.97538 4.87674 2.47508 -86.58582 942.69712 2080.0000 -91.40363 -86.63733 4.76630 2.50071 -86.29108 966.25139 2085.0000 -90.77996 -86.32546 4.45450 2.48026 -86.52619 957.15083 2090.0000 -91.28538 -85.62463 5.66075 2.55689 -85.64494 1023.66973 2095.0000 -91.80433 -86.64562 5.15871 2.54168 -85.81987 1015.46674 2100.0000 -91.65866 -86.98732 4.67134 2.52229 -86.04290 966.12610 2105.0000 -91.90824 -88.10637 3.80187 2.38910 -87.57459 867.16400 2110.0000 -92.15600 -87.20486 4.95114 2.37430 -87.74476 873.81690 2115.0000 -91.35932 -86.13279 5.22654 2.43791 -87.01331 926.56033 2120.0000 -90.22004 -84.40940 5.81064 2.56475 -85.55456 1016.77221 2125.0000 -90.55119 -85.32286 5.22833 2.63331 -84.76615 1079.50027 2130.0000 -92.47357 -87.21665 5.25692 2.47516 -86.58491 983.36924 2135.0000 -91.70586 -88.34094 3.36491 2.33394 -88.20895 857.31423 2140.0000 -92.82584 -87.97537 4.85048 2.37266 -87.76368 898.95501 2145.0000 -91.03892 -86.08369 4.95523 2.44693 -86.90958 945.82224 2150.0000 -92.51465 -87.26730 5.24734 2.43291 -87.07078 969.40437 2155.0000 -93.04200 -88.86875 4.17325 2.38877 -87.57837 881.19497 2160.0000 -92.01424 -87.94594 4.06830 2.35457 -87.97169 856.36836 2165.0000 -92.04886 -87.50288 4.54598 2.38950 -87.57004 881.93102 2170.0000 -91.46531 -85.76371 5.70160 2.45418 -86.82621 930.83457 2175.0000 -91.41754 -86.86669 4.55085 2.48771 -86.44057 973.61886 2180.0000 -91.31644 -86.55292 4.76352 2.48166 -86.51007 957.16054 2185.0000 -90.94199 -85.21850 5.72349 2.50717 -86.21680 964.46428 2190.0000 -91.64400 -86.82767 4.81633 2.49136 -86.39862 986.98845 2195.0000 -90.89819 -85.84296 5.05523 2.48344 -86.48968 954.71307 2200.0000 -91.40957 -86.67096 4.73861 2.46278 -86.72727 925.06350 2205.0000 -90.97378 -85.08902 5.88476 2.51452 -86.13227 974.54251 2210.0000 -89.65728 -84.15319 5.50409 2.64888 -84.58705 1079.55309 2215.0000 -90.90649 -84.92230 5.98420 2.55976 -85.61197 1039.10009 2220.0000 -89.13193 -84.44894 4.68299 2.63284 -84.77147 1060.63099 2225.0000 -90.40059 -84.70740 5.69318 2.66325 -84.42181 1085.06447 2230.0000 -90.65103 -84.79518 5.85585 2.58774 -85.29013 1007.85100 2235.0000 -91.72996 -86.23715 5.49280 2.57316 -85.45786 1000.17007 2240.0000 -91.23897 -85.52741 5.71156 2.46479 -86.70419 966.80639 2245.0000 -90.87036 -86.26946 4.60090 2.53014 -85.95258 1014.53627 2250.0000 -91.89415 -87.34538 4.54877 2.44093 -86.97854 927.82958 FREEZING PROCESS: loop number 10 T-loop= 905.00000000000000 main_MD> interactions number 10 at Temperature= 905.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 0.30760 -0.02477 0.26425 force_rgl> df(natom) -0.21465 -0.50399 2.43413 2255.0000 -90.89030 -86.85307 4.03723 2.44403 -86.94289 933.11667 2260.0000 -92.23699 -87.42920 4.80779 2.42862 -87.12012 909.27693 2265.0000 -92.86531 -89.11968 3.74562 2.30918 -88.49371 810.46546 2270.0000 -92.13133 -87.60849 4.52284 2.30177 -88.57889 838.82595 2275.0000 -91.85062 -87.50622 4.34440 2.37125 -87.77991 898.38804 2280.0000 -91.09379 -86.42610 4.66769 2.40733 -87.36498 870.84465 2285.0000 -91.12799 -87.43610 3.69189 2.44128 -86.97452 902.92361 2290.0000 -91.84573 -87.72947 4.11626 2.44085 -86.97941 952.92458 2295.0000 -92.46044 -89.06927 3.39116 2.31484 -88.42864 810.38703 2300.0000 -92.97377 -88.58880 4.38497 2.27127 -88.92971 784.35063 2305.0000 -91.93955 -88.30202 3.63753 2.29346 -88.67452 789.67480 2310.0000 -92.68938 -88.16431 4.52506 2.33359 -88.21297 892.86385 2315.0000 -91.69458 -87.38858 4.30600 2.37659 -87.71850 862.60739 2320.0000 -93.00103 -88.36327 4.63776 2.38223 -87.65359 881.06771 2325.0000 -91.75301 -88.01704 3.73597 2.30196 -88.57674 779.32640 2330.0000 -91.65811 -87.74214 3.91597 2.36100 -87.89777 863.35135 2335.0000 -92.06935 -86.97397 5.09538 2.36888 -87.80709 864.94187 2340.0000 -91.63936 -86.56493 5.07443 2.42435 -87.16918 928.06163 2345.0000 -91.98891 -88.66154 3.32737 2.41624 -87.26247 938.91426 2350.0000 -92.21432 -87.55706 4.65726 2.35109 -88.01177 835.06562 2355.0000 -91.51923 -87.60582 3.91341 2.38137 -87.66355 879.00333 2360.0000 -92.59886 -87.95293 4.64593 2.34372 -88.09650 831.60413 2365.0000 -90.59939 -86.37069 4.22870 2.42587 -87.15178 890.78594 2370.0000 -92.38134 -86.63971 5.74163 2.49572 -86.34845 973.84688 2375.0000 -93.10615 -87.63498 5.47117 2.41350 -87.29399 941.39153 2380.0000 -92.21772 -88.11286 4.10486 2.31545 -88.42163 836.37611 2385.0000 -91.07460 -87.01804 4.05656 2.38898 -87.57603 868.75208 2390.0000 -91.59600 -85.63517 5.96083 2.56265 -85.57875 1022.09879 2395.0000 -92.22708 -87.04580 5.18128 2.54561 -85.77463 1038.64394 2400.0000 -91.51190 -87.73982 3.77208 2.34333 -88.10098 807.82808 2405.0000 -92.00100 -86.13322 5.86778 2.45408 -86.82733 965.52599 2410.0000 -91.77397 -87.22538 4.54859 2.47844 -86.54718 985.00827 2415.0000 -92.02290 -88.42616 3.59674 2.38107 -87.66689 866.99883 2420.0000 -91.71644 -88.02834 3.68810 2.33841 -88.15757 828.98037 2425.0000 -91.89278 -87.82904 4.06373 2.35829 -87.92887 869.64008 2430.0000 -93.09247 -89.11485 3.97762 2.28056 -88.82289 800.61297 2435.0000 -92.48443 -88.17095 4.31348 2.24498 -89.23204 735.20563 2440.0000 -92.75344 -87.82336 4.93008 2.36312 -87.87335 851.93570 2445.0000 -92.66895 -89.08141 3.58755 2.31793 -88.39312 826.70104 2450.0000 -92.84538 -88.98133 3.86405 2.29892 -88.61174 831.12027 2455.0000 -92.18079 -87.94327 4.23751 2.30346 -88.55953 839.35692 2460.0000 -91.38033 -87.44323 3.93709 2.31509 -88.42570 818.13946 2465.0000 -92.21385 -88.84027 3.37358 2.38170 -87.65974 896.98562 2470.0000 -91.46319 -87.98312 3.48007 2.32206 -88.34562 817.45540 2475.0000 -90.93342 -86.28358 4.64984 2.45324 -86.83698 952.90894 2480.0000 -92.66591 -87.90253 4.76338 2.43630 -87.03179 923.86444 2485.0000 -91.79501 -87.93090 3.86412 2.33987 -88.14072 814.05512 2490.0000 -92.89193 -88.18146 4.71048 2.37494 -87.73739 876.34227 2495.0000 -92.88961 -87.14457 5.74505 2.38716 -87.59687 868.33795 2500.0000 -90.81569 -86.57120 4.24449 2.46188 -86.73756 945.47424 FREEZING PROCESS: loop number 11 T-loop= 880.00000000000000 main_MD> interactions number 11 at Temperature= 880.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -1.11119 -2.85035 -0.71158 force_rgl> df(natom) 0.58118 4.33127 1.28498 2505.0000 -91.78561 -87.37620 4.40941 2.45688 -86.79513 929.22495 2510.0000 -91.69699 -87.22976 4.46723 2.36147 -87.89231 858.90409 2515.0000 -92.41495 -88.70936 3.70559 2.39451 -87.51243 884.18947 2520.0000 -92.58970 -88.65190 3.93780 2.29797 -88.62262 792.07058 2525.0000 -93.39873 -88.56366 4.83507 2.30075 -88.59066 833.55626 2530.0000 -93.47639 -90.11624 3.36015 2.23560 -89.33992 791.83788 2535.0000 -92.76075 -88.41519 4.34556 2.20172 -89.72953 740.17218 2540.0000 -92.49312 -88.44589 4.04723 2.29470 -88.66023 796.31067 2545.0000 -92.12995 -87.67859 4.45137 2.33806 -88.16163 796.36048 2550.0000 -91.24524 -87.31588 3.92936 2.41800 -87.24226 890.29458 2555.0000 -92.56391 -87.24123 5.32268 2.37191 -87.77227 832.87949 2560.0000 -92.51922 -88.64439 3.87483 2.33439 -88.20377 850.83430 2565.0000 -91.56118 -87.78447 3.77670 2.34085 -88.12951 831.11993 2570.0000 -91.88800 -86.96584 4.92217 2.42651 -87.14442 914.07721 2575.0000 -92.61451 -87.93692 4.67759 2.39944 -87.45565 856.56375 2580.0000 -92.57987 -87.82081 4.75906 2.36522 -87.84920 835.59499 2585.0000 -91.35786 -86.74651 4.61135 2.41516 -87.27486 874.95990 2590.0000 -91.74542 -86.89544 4.84998 2.50406 -86.25250 967.66440 2595.0000 -91.50324 -87.16892 4.33432 2.43571 -87.03856 950.74036 2600.0000 -92.10099 -87.30465 4.79635 2.42953 -87.10967 881.40856 2605.0000 -92.01363 -87.60499 4.40864 2.38087 -87.66924 840.65907 2610.0000 -91.67903 -87.61349 4.06553 2.34843 -88.04235 821.02298 2615.0000 -92.89122 -87.25649 5.63474 2.38088 -87.66916 871.02690 2620.0000 -91.05958 -86.98253 4.07706 2.44396 -86.94373 945.50541 2625.0000 -90.96735 -86.52375 4.44360 2.51586 -86.11679 931.14648 2630.0000 -92.63009 -87.91604 4.71405 2.41543 -87.27181 892.68715 2635.0000 -93.32127 -88.07221 5.24907 2.42222 -87.19367 897.16913 2640.0000 -91.93489 -88.92158 3.01330 2.29308 -88.67882 763.12317 2645.0000 -91.89149 -87.52223 4.36926 2.32443 -88.31828 810.04339 2650.0000 -91.90799 -87.39836 4.50962 2.30878 -88.49830 781.03683 2655.0000 -91.24738 -87.48882 3.75856 2.43573 -87.03829 888.75714 2660.0000 -92.54535 -88.17428 4.37108 2.35635 -87.95119 851.73042 2665.0000 -92.70112 -89.02241 3.67871 2.29461 -88.66131 794.26375 2670.0000 -92.11701 -87.53812 4.57890 2.33892 -88.15165 868.77933 2675.0000 -91.99656 -87.42476 4.57181 2.44154 -86.97149 923.48842 2680.0000 -92.51139 -88.48030 4.03109 2.35124 -88.00995 853.68334 2685.0000 -91.17197 -86.74628 4.42569 2.43119 -87.09058 935.56991 2690.0000 -91.50719 -87.08038 4.42681 2.43130 -87.08923 925.08545 2695.0000 -91.93253 -87.64502 4.28751 2.38399 -87.63338 892.01336 2700.0000 -92.52631 -87.69091 4.83540 2.43350 -87.06394 915.97200 2705.0000 -92.04992 -86.70438 5.34554 2.45486 -86.81835 910.61362 2710.0000 -91.51436 -87.31853 4.19583 2.34418 -88.09120 835.59565 2715.0000 -91.82195 -87.53492 4.28703 2.45952 -86.76477 935.01611 2720.0000 -90.85465 -86.25997 4.59467 2.44665 -86.91278 926.89885 2725.0000 -92.18755 -86.71015 5.47741 2.49155 -86.39638 926.23450 2730.0000 -93.15517 -87.18862 5.96655 2.42598 -87.15044 910.45047 2735.0000 -92.49863 -88.49298 4.00566 2.32519 -88.30964 839.60209 2740.0000 -91.19453 -87.34379 3.85074 2.35362 -87.98257 832.61913 2745.0000 -90.93728 -85.27675 5.66053 2.48077 -86.52032 951.63505 2750.0000 -90.96353 -86.11650 4.84703 2.48616 -86.45833 950.79946 FREEZING PROCESS: loop number 12 T-loop= 855.00000000000000 main_MD> interactions number 12 at Temperature= 855.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -0.60136 -0.09130 2.73432 force_rgl> df(natom) 3.15520 -3.18069 -3.07274 2755.0000 -92.18562 -88.52299 3.66264 2.40845 -87.35212 913.11795 2760.0000 -92.09465 -88.39351 3.70113 2.34737 -88.05449 831.88251 2765.0000 -93.61529 -90.06856 3.54673 2.23521 -89.34434 751.53466 2770.0000 -92.63001 -88.83148 3.79853 2.19159 -89.84606 713.82471 2775.0000 -91.63161 -87.50762 4.12399 2.30171 -88.57965 819.78473 2780.0000 -91.74235 -87.74105 4.00130 2.37277 -87.76237 822.83920 2785.0000 -92.37590 -88.06811 4.30779 2.35649 -87.94960 853.74738 2790.0000 -92.80367 -89.18332 3.62035 2.28865 -88.72986 785.49889 2795.0000 -90.99221 -86.83610 4.15611 2.39685 -87.48541 854.06956 2800.0000 -92.12102 -87.58773 4.53329 2.40925 -87.34288 863.91922 2805.0000 -91.09755 -87.22652 3.87103 2.39964 -87.45333 889.76733 2810.0000 -92.72211 -87.45082 5.27129 2.40726 -87.36575 913.12333 2815.0000 -92.68713 -87.74988 4.93726 2.34287 -88.10621 829.22989 2820.0000 -92.83134 -87.95254 4.87880 2.32387 -88.32478 829.34147 2825.0000 -91.77953 -88.03032 3.74921 2.37475 -87.73967 873.81382 2830.0000 -91.92587 -88.08690 3.83897 2.35690 -87.94491 876.49300 2835.0000 -91.60659 -88.17618 3.43041 2.37150 -87.77706 872.35593 2840.0000 -92.98314 -88.00938 4.97376 2.32917 -88.26377 808.90300 2845.0000 -92.97357 -88.11155 4.86203 2.30515 -88.54006 797.41206 2850.0000 -92.32345 -87.60003 4.72342 2.37210 -87.77005 846.81810 2855.0000 -92.02760 -87.59946 4.42814 2.42110 -87.20662 920.49996 2860.0000 -92.86080 -88.42257 4.43823 2.37214 -87.76960 853.57718 2865.0000 -92.94027 -89.40202 3.53824 2.26490 -89.00292 793.55556 2870.0000 -92.69293 -88.28230 4.41063 2.29636 -88.64109 783.40373 2875.0000 -92.65716 -87.00708 5.65008 2.37652 -87.71925 869.20280 2880.0000 -91.11615 -85.91577 5.20039 2.46124 -86.74500 921.57682 2885.0000 -91.12901 -86.37726 4.75174 2.50554 -86.23552 945.30559 2890.0000 -90.91739 -86.33762 4.57977 2.51303 -86.14937 955.57141 2895.0000 -91.48735 -86.98567 4.50168 2.47341 -86.60503 920.41904 2900.0000 -91.00102 -86.56779 4.43322 2.44382 -86.94532 916.18121 2905.0000 -92.07227 -87.39734 4.67493 2.36913 -87.80428 847.62449 2910.0000 -90.71480 -87.21586 3.49894 2.38816 -87.58543 845.94162 2915.0000 -92.49131 -88.38533 4.10599 2.38122 -87.66522 859.92933 2920.0000 -92.51109 -88.17616 4.33492 2.32933 -88.26202 867.51913 2925.0000 -91.68001 -86.45726 5.22275 2.45896 -86.77120 959.37134 2930.0000 -90.14949 -86.37499 3.77451 2.49152 -86.39671 897.69156 2935.0000 -91.89982 -86.25599 5.64384 2.49927 -86.30765 959.08712 2940.0000 -92.24442 -87.11114 5.13328 2.44701 -86.90859 938.68705 2945.0000 -92.02176 -87.23385 4.78791 2.41195 -87.31186 863.18566 2950.0000 -92.20398 -85.83088 6.37310 2.51288 -86.15112 1033.96857 2955.0000 -90.32341 -85.63429 4.68912 2.57338 -85.45526 1022.70897 2960.0000 -90.92001 -86.91511 4.00490 2.52318 -86.03259 935.86897 2965.0000 -93.32164 -89.05289 4.26875 2.36155 -87.89140 840.29928 2970.0000 -93.53307 -89.76764 3.76542 2.22660 -89.44340 743.93299 2975.0000 -94.48523 -90.55489 3.93033 2.12867 -90.56962 685.99875 2980.0000 -93.20555 -89.17627 4.02927 2.20751 -89.66292 735.29294 2985.0000 -92.99341 -88.90984 4.08357 2.30929 -88.49239 801.23596 2990.0000 -92.63085 -88.69573 3.93512 2.29658 -88.63862 800.35377 2995.0000 -92.53239 -88.06289 4.46950 2.31944 -88.37567 811.55178 3000.0000 -92.91276 -88.53658 4.37618 2.32473 -88.31487 835.37203 FREEZING PROCESS: loop number 13 T-loop= 830.00000000000000 main_MD> interactions number 13 at Temperature= 830.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 0.24939 -1.00599 2.14640 force_rgl> df(natom) 0.87247 -0.94687 0.04346 3005.0000 -93.18863 -89.41628 3.77235 2.25581 -89.10752 765.67292 3010.0000 -93.37211 -89.00283 4.36928 2.25517 -89.11488 779.04588 3015.0000 -93.52346 -89.63262 3.89084 2.29365 -88.67233 751.23715 3020.0000 -93.05303 -89.22037 3.83266 2.27920 -88.83848 789.07193 3025.0000 -92.62741 -88.31893 4.30848 2.29569 -88.64885 788.41960 3030.0000 -93.14651 -88.77213 4.37439 2.29829 -88.61897 783.83147 3035.0000 -92.80343 -89.59543 3.20800 2.23670 -89.32724 751.65183 3040.0000 -93.65135 -89.56971 4.08164 2.28583 -88.76226 773.08315 3045.0000 -92.62743 -87.40870 5.21873 2.32309 -88.33378 837.57661 3050.0000 -92.15894 -87.22100 4.93794 2.37153 -87.77663 874.38958 3055.0000 -93.13472 -88.31588 4.81884 2.37646 -87.71992 865.54804 3060.0000 -92.45677 -88.25303 4.20375 2.34153 -88.12161 847.86915 3065.0000 -92.55185 -88.52244 4.02941 2.29744 -88.62874 832.90526 3070.0000 -93.69918 -89.21449 4.48469 2.25856 -89.07580 756.63349 3075.0000 -93.27639 -89.74673 3.52966 2.23109 -89.39171 728.19632 3080.0000 -92.53431 -89.17782 3.35649 2.26521 -88.99939 786.29282 3085.0000 -93.44686 -88.70125 4.74561 2.27302 -88.90951 748.22559 3090.0000 -91.94392 -88.10617 3.83775 2.31940 -88.37622 834.70758 3095.0000 -91.91814 -87.78760 4.13054 2.36283 -87.87672 875.06805 3100.0000 -91.43727 -87.46461 3.97266 2.40974 -87.33721 894.63942 3105.0000 -93.13841 -89.30265 3.83576 2.31060 -88.47735 837.93909 3110.0000 -92.55120 -88.54825 4.00296 2.27454 -88.89210 799.34375 3115.0000 -92.72684 -89.46266 3.26417 2.25862 -89.07510 811.57383 3120.0000 -93.48416 -89.42897 4.05518 2.22207 -89.49555 747.13910 3125.0000 -93.41923 -88.95736 4.46188 2.25541 -89.11204 784.75415 3130.0000 -92.51885 -88.52037 3.99848 2.28667 -88.75263 810.80624 3135.0000 -92.81900 -89.29785 3.52115 2.23977 -89.29190 752.16931 3140.0000 -92.35223 -88.22398 4.12825 2.24866 -89.18971 760.66241 3145.0000 -92.78840 -88.80463 3.98377 2.30549 -88.53609 810.28230 3150.0000 -93.83521 -89.67054 4.16467 2.26733 -88.97493 724.24879 3155.0000 -92.15164 -87.76319 4.38846 2.29118 -88.70076 780.63731 3160.0000 -92.44447 -87.19743 5.24704 2.39202 -87.54097 862.08513 3165.0000 -91.02553 -87.09518 3.93035 2.48369 -86.48681 960.05542 3170.0000 -92.32951 -87.92922 4.40029 2.34297 -88.10508 855.76184 3175.0000 -92.94469 -88.55936 4.38534 2.35599 -87.95537 861.63113 3180.0000 -92.38930 -88.59788 3.79142 2.29030 -88.71078 818.47170 3185.0000 -91.87253 -88.77050 3.10203 2.23398 -89.35849 711.87582 3190.0000 -93.00800 -89.02310 3.98490 2.29894 -88.61143 792.25778 3195.0000 -92.73022 -88.35708 4.37314 2.32981 -88.25640 786.37996 3200.0000 -93.43254 -89.21220 4.22034 2.19582 -89.79737 742.81374 3205.0000 -92.98628 -88.39269 4.59358 2.27625 -88.87236 782.61873 3210.0000 -92.53042 -88.51850 4.01192 2.32587 -88.30174 826.84807 3215.0000 -93.34833 -89.15554 4.19279 2.27542 -88.88195 804.38352 3220.0000 -92.67857 -87.80118 4.87739 2.29439 -88.66376 814.30847 3225.0000 -92.17237 -87.68879 4.48358 2.39525 -87.50391 887.65151 3230.0000 -93.01736 -88.68745 4.32992 2.34530 -88.07828 866.12813 3235.0000 -92.61904 -87.28057 5.33847 2.38185 -87.65794 865.03062 3240.0000 -91.49170 -87.37857 4.11313 2.40194 -87.42695 886.89849 3245.0000 -92.28909 -87.44194 4.84714 2.40521 -87.38932 879.44014 3250.0000 -92.36586 -88.61035 3.75551 2.38780 -87.58950 875.63588 FREEZING PROCESS: loop number 14 T-loop= 805.00000000000000 main_MD> interactions number 14 at Temperature= 805.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -0.11039 1.48618 -1.61848 force_rgl> df(natom) 2.96705 -2.76540 -0.16060 3255.0000 -92.04744 -87.40022 4.64722 2.34456 -88.08686 789.30428 3260.0000 -92.58531 -87.63842 4.94689 2.37720 -87.71148 788.52687 3265.0000 -92.77199 -89.39158 3.38041 2.31930 -88.37735 807.76769 3270.0000 -92.72501 -88.54079 4.18422 2.32500 -88.31173 797.51237 3275.0000 -92.17605 -88.84124 3.33481 2.28128 -88.81452 781.24452 3280.0000 -91.33125 -87.36763 3.96362 2.36624 -87.83745 878.04786 3285.0000 -90.84686 -87.19639 3.65047 2.43888 -87.00214 895.26808 3290.0000 -91.54632 -87.56720 3.97912 2.41687 -87.25521 872.49542 3295.0000 -93.26976 -89.32178 3.94798 2.33779 -88.16466 828.44061 3300.0000 -92.53984 -87.49725 5.04260 2.35646 -87.94992 865.01619 3305.0000 -92.47847 -88.53311 3.94536 2.36877 -87.80843 854.55302 3310.0000 -92.68325 -88.61269 4.07056 2.30373 -88.55638 817.42589 3315.0000 -92.38520 -88.54763 3.83757 2.29139 -88.69833 768.70197 3320.0000 -92.64997 -87.67923 4.97074 2.33009 -88.25328 837.66413 3325.0000 -91.88249 -87.70291 4.17958 2.38813 -87.58570 883.20344 3330.0000 -93.06616 -89.27582 3.79034 2.33115 -88.24099 773.75462 3335.0000 -93.98441 -90.47592 3.50849 2.20907 -89.64495 701.78360 3340.0000 -92.99766 -89.65726 3.34040 2.14342 -90.40001 671.17109 3345.0000 -92.48147 -88.09936 4.38211 2.30698 -88.51895 816.82369 3350.0000 -92.81619 -88.21425 4.60194 2.31365 -88.44231 794.49576 3355.0000 -92.97062 -89.00954 3.96108 2.31087 -88.47427 816.43222 3360.0000 -93.38369 -89.13749 4.24621 2.28291 -88.79586 771.22340 3365.0000 -92.72111 -88.48544 4.23566 2.25627 -89.10214 747.27800 3370.0000 -92.55672 -87.85547 4.70124 2.34015 -88.13750 834.27835 3375.0000 -93.30818 -89.44203 3.86615 2.30894 -88.49647 831.30421 3380.0000 -93.66545 -90.08901 3.57644 2.17594 -90.02601 702.61823 3385.0000 -92.82246 -88.29682 4.52564 2.29494 -88.65747 822.24306 3390.0000 -91.63284 -87.24021 4.39264 2.38797 -87.58759 857.77899 3395.0000 -93.12342 -88.35750 4.76592 2.33676 -88.17657 836.85403 3400.0000 -91.07346 -86.97254 4.10092 2.36797 -87.81762 845.90660 3405.0000 -91.70483 -87.48259 4.22224 2.41426 -87.28523 863.16463 3410.0000 -92.15166 -88.02520 4.12646 2.36220 -87.88400 810.74121 3415.0000 -92.08573 -88.97781 3.10792 2.27573 -88.87838 776.96868 3420.0000 -93.92371 -90.54100 3.38271 2.20149 -89.73215 732.20389 3425.0000 -93.24047 -89.61145 3.62902 2.13795 -90.46293 679.35302 3430.0000 -92.72015 -89.61084 3.10931 2.24249 -89.26071 782.73478 3435.0000 -92.26100 -87.69177 4.56923 2.30133 -88.58402 840.57553 3440.0000 -91.81266 -88.35360 3.45906 2.36556 -87.84526 881.45376 3445.0000 -93.33891 -88.37195 4.96696 2.25061 -89.16728 769.54669 3450.0000 -91.90622 -87.66117 4.24505 2.33497 -88.19714 815.50222 3455.0000 -92.22400 -87.52110 4.70291 2.40720 -87.36644 878.96735 3460.0000 -92.42599 -87.48022 4.94578 2.35084 -88.01461 837.89964 3465.0000 -93.53367 -89.53142 4.00225 2.30116 -88.58590 812.80884 3470.0000 -93.02854 -88.83592 4.19262 2.27348 -88.90431 796.93920 3475.0000 -92.52204 -88.39023 4.13182 2.32291 -88.33577 822.49809 3480.0000 -91.97891 -87.42571 4.55320 2.33330 -88.21637 827.03292 3485.0000 -92.21648 -88.57661 3.63988 2.35511 -87.96550 855.06258 3490.0000 -92.74432 -88.61153 4.13279 2.28006 -88.82857 801.61521 3495.0000 -92.06506 -87.88297 4.18209 2.24460 -89.23638 789.88454 3500.0000 -93.11608 -89.98709 3.12900 2.27390 -88.89943 791.55256 FREEZING PROCESS: loop number 15 T-loop= 780.00000000000000 main_MD> interactions number 15 at Temperature= 780.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 1.56786 -1.04948 0.08590 force_rgl> df(natom) -3.73835 -2.43112 -0.15003 3505.0000 -92.77599 -88.77976 3.99623 2.24444 -89.23822 765.63068 3510.0000 -93.60851 -89.63159 3.97692 2.24736 -89.20464 774.02421 3515.0000 -92.79948 -88.59005 4.20943 2.22876 -89.41856 746.39578 3520.0000 -92.94552 -89.84778 3.09774 2.19194 -89.84203 745.07992 3525.0000 -94.24502 -90.29929 3.94572 2.18479 -89.92426 751.29713 3530.0000 -94.50375 -90.29565 4.20810 2.12920 -90.56358 680.01497 3535.0000 -93.00055 -88.93979 4.06077 2.22559 -89.45502 768.07847 3540.0000 -92.42850 -87.98033 4.44818 2.29765 -88.62635 798.79678 3545.0000 -92.93094 -89.12004 3.81091 2.34950 -88.03001 834.60120 3550.0000 -93.80153 -89.87863 3.92291 2.22993 -89.40512 762.26981 3555.0000 -93.43422 -89.28875 4.14547 2.21709 -89.55275 731.59387 3560.0000 -91.92675 -87.95000 3.97675 2.32803 -88.27693 836.81594 3565.0000 -91.18556 -86.41618 4.76938 2.40166 -87.43013 865.96606 3570.0000 -91.36129 -87.04800 4.31329 2.42992 -87.10519 901.72171 3575.0000 -92.29160 -88.06800 4.22360 2.40581 -87.38243 912.60007 3580.0000 -93.12493 -88.69705 4.42788 2.33772 -88.16543 823.85366 3585.0000 -92.84401 -88.36084 4.48317 2.32851 -88.27134 822.68443 3590.0000 -91.32199 -87.52808 3.79390 2.36567 -87.84404 778.12356 3595.0000 -91.39601 -87.24943 4.14658 2.36770 -87.82070 795.41277 3600.0000 -92.82911 -89.15026 3.67885 2.34936 -88.03167 796.35911 3605.0000 -93.69278 -89.92649 3.76629 2.24329 -89.25142 745.98452 3610.0000 -93.90436 -90.10331 3.80105 2.21462 -89.58114 763.12403 3615.0000 -92.27339 -88.15026 4.12313 2.21705 -89.55319 757.89465 3620.0000 -92.94918 -89.27787 3.67131 2.30549 -88.53617 814.53265 3625.0000 -92.52606 -89.29552 3.23054 2.18994 -89.86504 715.48535 3630.0000 -92.45222 -88.39537 4.05685 2.29155 -88.69640 818.77485 3635.0000 -91.83973 -87.54888 4.29085 2.34732 -88.05502 873.07616 3640.0000 -92.38570 -89.22998 3.15571 2.29462 -88.66111 841.10519 3645.0000 -93.49162 -89.95038 3.54124 2.24579 -89.22274 750.76341 3650.0000 -93.30880 -89.16179 4.14701 2.18704 -89.89838 690.37113 3655.0000 -93.29864 -89.65827 3.64038 2.24701 -89.20862 782.31705 3660.0000 -93.49237 -88.51600 4.97637 2.21682 -89.55593 741.02454 3665.0000 -92.42156 -88.33698 4.08458 2.32295 -88.33536 796.35922 3670.0000 -93.08901 -89.74141 3.34760 2.27387 -88.89973 773.42584 3675.0000 -93.99539 -89.79063 4.20476 2.22449 -89.46768 725.83481 3680.0000 -91.80325 -88.48108 3.32217 2.22649 -89.44470 688.47143 3685.0000 -92.10935 -88.43262 3.67673 2.26667 -88.98253 750.86045 3690.0000 -92.56149 -88.65186 3.90963 2.28826 -88.73426 831.37919 3695.0000 -92.63145 -89.13378 3.49768 2.27663 -88.86806 796.00630 3700.0000 -91.88015 -88.76393 3.11622 2.21632 -89.56162 726.85085 3705.0000 -93.40267 -89.78037 3.62231 2.23331 -89.36625 731.24308 3710.0000 -93.59872 -90.02135 3.57737 2.20336 -89.71069 725.59233 3715.0000 -92.55442 -88.24628 4.30815 2.23641 -89.33054 768.54393 3720.0000 -92.50425 -88.77596 3.72829 2.31216 -88.45941 763.10338 3725.0000 -92.79074 -88.55889 4.23185 2.27677 -88.86639 799.10913 3730.0000 -92.38351 -88.19541 4.18809 2.27490 -88.88798 806.74279 3735.0000 -92.33929 -88.83132 3.50798 2.31898 -88.38103 824.98357 3740.0000 -92.63591 -89.04480 3.59111 2.25783 -89.08430 795.54780 3745.0000 -91.86650 -88.96288 2.90362 2.27398 -88.89847 740.40074 3750.0000 -93.26028 -89.97606 3.28422 2.22116 -89.50597 732.60139 FREEZING PROCESS: loop number 16 T-loop= 755.00000000000000 main_MD> interactions number 16 at Temperature= 755.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 0.33682 0.40471 1.99776 force_rgl> df(natom) 3.03054 -5.44014 0.49186 3755.0000 -93.96788 -90.42392 3.54396 2.14682 -90.36091 651.63856 3760.0000 -92.58396 -88.97700 3.60696 2.21299 -89.59993 749.55279 3765.0000 -92.83954 -88.73746 4.10208 2.26349 -89.01919 762.12005 3770.0000 -93.19499 -88.73027 4.46472 2.22347 -89.47939 709.88381 3775.0000 -93.15809 -89.34504 3.81305 2.20951 -89.63998 730.49672 3780.0000 -93.59492 -90.03231 3.56261 2.23696 -89.32431 756.67829 3785.0000 -92.32112 -88.28795 4.03317 2.24674 -89.21178 789.50846 3790.0000 -93.42894 -89.58031 3.84863 2.31074 -88.47573 774.23676 3795.0000 -92.42603 -88.49440 3.93163 2.24388 -89.24471 753.08534 3800.0000 -92.86099 -89.09769 3.76330 2.31830 -88.38886 806.37122 3805.0000 -93.99911 -90.47460 3.52451 2.23279 -89.37221 727.46067 3810.0000 -93.55195 -89.78906 3.76290 2.14970 -90.32778 703.30973 3815.0000 -91.38267 -87.48632 3.89636 2.28306 -88.79407 776.69259 3820.0000 -93.99510 -89.85787 4.13722 2.28524 -88.76901 824.99723 3825.0000 -93.73922 -89.22047 4.51875 2.27360 -88.90290 798.41422 3830.0000 -93.81331 -90.38126 3.43206 2.16932 -90.10208 692.78810 3835.0000 -93.94337 -90.22946 3.71391 2.15635 -90.25124 681.75207 3840.0000 -93.48296 -89.76486 3.71810 2.20146 -89.73248 760.99153 3845.0000 -93.68555 -89.88773 3.79781 2.19139 -89.84829 706.04673 3850.0000 -93.67925 -90.95316 2.72609 2.12895 -90.56636 690.96950 3855.0000 -94.19356 -90.74161 3.45195 2.07970 -91.13285 623.79713 3860.0000 -93.90162 -90.85512 3.04650 2.10933 -90.79207 637.33837 3865.0000 -94.33546 -90.04263 4.29283 2.05242 -91.44651 566.65172 3870.0000 -93.10367 -89.20017 3.90350 2.19837 -89.76805 754.11858 3875.0000 -91.97326 -88.46811 3.50515 2.24902 -89.18554 735.28845 3880.0000 -93.37874 -89.47297 3.90577 2.27975 -88.83210 764.17274 3885.0000 -94.06412 -90.25956 3.80455 2.22176 -89.49904 728.61001 3890.0000 -92.81997 -89.16117 3.65880 2.24548 -89.22622 759.84408 3895.0000 -92.80380 -88.92921 3.87459 2.25405 -89.12771 771.44317 3900.0000 -92.55159 -88.67131 3.88027 2.26718 -88.97667 759.37353 3905.0000 -93.59681 -90.17760 3.41921 2.26254 -89.03006 759.59576 3910.0000 -92.57869 -89.29722 3.28147 2.27548 -88.88124 757.42538 3915.0000 -92.51880 -88.52227 3.99653 2.27103 -88.93241 766.46218 3920.0000 -93.17674 -89.11514 4.06159 2.29899 -88.61088 797.70308 3925.0000 -93.71636 -90.05581 3.66056 2.21416 -89.58651 708.68492 3930.0000 -92.81837 -88.83702 3.98135 2.29353 -88.67367 786.23989 3935.0000 -93.07906 -89.25031 3.82876 2.22623 -89.44767 745.01148 3940.0000 -92.92805 -89.96025 2.96780 2.19405 -89.81771 718.71207 3945.0000 -93.81632 -89.89709 3.91922 2.18995 -89.86483 721.76155 3950.0000 -93.32375 -90.16317 3.16058 2.16884 -90.10771 673.74192 3955.0000 -93.06679 -89.23903 3.82776 2.20201 -89.72614 687.95560 3960.0000 -92.98985 -89.26409 3.72576 2.23442 -89.35343 751.83395 3965.0000 -93.10142 -89.40909 3.69233 2.27114 -88.93117 806.44964 3970.0000 -93.13346 -90.48268 2.65078 2.19512 -89.80547 717.81698 3975.0000 -94.15664 -90.70184 3.45480 2.15922 -90.21829 722.48740 3980.0000 -93.71734 -89.42466 4.29268 2.18817 -89.88532 708.79026 3985.0000 -92.22795 -88.27970 3.94825 2.32115 -88.35602 801.82542 3990.0000 -93.36557 -89.15082 4.21475 2.30410 -88.55214 801.77443 3995.0000 -92.15243 -88.31744 3.83500 2.28805 -88.73675 800.05072 4000.0000 -93.65343 -90.96636 2.68707 2.19150 -89.84708 705.67605 FREEZING PROCESS: loop number 17 T-loop= 730.00000000000000 main_MD> interactions number 17 at Temperature= 730.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 1.80112 -1.16021 -0.07663 force_rgl> df(natom) 2.19311 -3.14870 -1.22485 4005.0000 -93.11425 -89.88298 3.23127 2.15306 -90.28910 652.18545 4010.0000 -93.68976 -89.39858 4.29118 2.24963 -89.17855 772.23429 4015.0000 -93.43833 -90.07747 3.36086 2.19123 -89.85017 743.35134 4020.0000 -92.33572 -88.69153 3.64419 2.21057 -89.62769 720.75596 4025.0000 -92.68176 -88.78793 3.89383 2.30881 -88.49801 828.38160 4030.0000 -92.56604 -88.56332 4.00272 2.25862 -89.07511 729.35435 4035.0000 -91.93333 -88.02933 3.90400 2.29103 -88.70242 761.84028 4040.0000 -92.67912 -88.20755 4.47156 2.31851 -88.38642 825.15571 4045.0000 -92.03203 -88.60661 3.42542 2.33356 -88.21329 821.78506 4050.0000 -93.65234 -90.39403 3.25831 2.19499 -89.80698 681.18637 4055.0000 -92.74798 -90.10994 2.63804 2.11809 -90.69126 639.19572 4060.0000 -93.99297 -91.07350 2.91947 2.11579 -90.71775 622.66247 4065.0000 -94.08075 -90.59563 3.48512 2.09241 -90.98665 629.50933 4070.0000 -94.86459 -91.37610 3.48850 2.10426 -90.85031 643.83471 4075.0000 -94.35370 -91.03458 3.31912 2.09020 -91.01205 616.69033 4080.0000 -94.73316 -91.35321 3.37995 2.06667 -91.28269 609.70666 4085.0000 -93.09466 -89.62596 3.46871 2.13045 -90.54920 640.38925 4090.0000 -92.92286 -88.88199 4.04087 2.26700 -88.97875 753.18553 4095.0000 -93.92383 -90.24106 3.68277 2.20558 -89.68516 720.99459 4100.0000 -93.71547 -89.87062 3.84485 2.19066 -89.85672 700.36467 4105.0000 -93.48743 -90.11429 3.37314 2.17385 -90.05009 696.53564 4110.0000 -92.44775 -89.46214 2.98561 2.20117 -89.73584 683.50834 4115.0000 -94.53653 -90.71250 3.82403 2.20859 -89.65056 720.54399 4120.0000 -94.11081 -90.17983 3.93097 2.15229 -90.29803 672.80308 4125.0000 -92.62073 -89.01411 3.60662 2.23197 -89.38162 746.95409 4130.0000 -93.33481 -89.71365 3.62117 2.18874 -89.87885 691.11868 4135.0000 -93.19900 -90.10180 3.09719 2.19046 -89.85899 679.54042 4140.0000 -93.88300 -90.46625 3.41675 2.17096 -90.08332 695.62868 4145.0000 -93.11890 -89.21314 3.90576 2.17987 -89.98078 720.50782 4150.0000 -93.76144 -89.31805 4.44339 2.22699 -89.43891 747.30507 4155.0000 -93.67842 -89.88888 3.78953 2.21083 -89.62478 735.11273 4160.0000 -92.48527 -89.10240 3.38287 2.24101 -89.27764 781.66433 4165.0000 -94.04029 -89.23943 4.80086 2.22518 -89.45972 758.29857 4170.0000 -93.76568 -89.48055 4.28513 2.24465 -89.23580 806.24768 4175.0000 -92.75063 -88.91588 3.83475 2.23768 -89.31599 742.49515 4180.0000 -93.37678 -89.55017 3.82661 2.21569 -89.56887 735.20528 4185.0000 -92.56423 -89.31017 3.25406 2.22439 -89.46887 717.87441 4190.0000 -92.37024 -88.49448 3.87575 2.23190 -89.38249 721.10750 4195.0000 -93.95383 -90.49679 3.45704 2.26113 -89.04634 775.97893 4200.0000 -93.26727 -90.02012 3.24715 2.17272 -90.06299 721.14540 4205.0000 -93.54123 -89.68965 3.85158 2.22308 -89.48383 748.24329 4210.0000 -93.36928 -90.23469 3.13459 2.18259 -89.94952 724.05866 4215.0000 -94.15700 -91.50164 2.65537 2.09276 -90.98256 642.98744 4220.0000 -94.52882 -91.27341 3.25542 2.07542 -91.18201 625.74488 4225.0000 -94.46019 -91.15607 3.30413 2.08638 -91.05598 644.17108 4230.0000 -92.69846 -89.56032 3.13814 2.15322 -90.28725 699.61762 4235.0000 -94.54791 -90.32210 4.22581 2.20702 -89.66863 711.88718 4240.0000 -92.79528 -89.86700 2.92828 2.15160 -90.30591 685.29472 4245.0000 -93.61319 -89.69600 3.91719 2.21411 -89.58705 698.86294 4250.0000 -93.28648 -89.56748 3.71900 2.19033 -89.86049 674.34360 FREEZING PROCESS: loop number 18 T-loop= 705.00000000000000 main_MD> interactions number 18 at Temperature= 705.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -1.41713 1.56684 1.35112 force_rgl> df(natom) 0.84005 -0.85049 -3.22753 4255.0000 -93.67695 -90.27976 3.39719 2.16189 -90.18758 708.02036 4260.0000 -92.85735 -88.92069 3.93666 2.19643 -89.79040 698.70672 4265.0000 -94.32082 -91.49923 2.82159 2.17072 -90.08599 726.71156 4270.0000 -94.37921 -90.60394 3.77526 2.08603 -91.05999 627.67273 4275.0000 -93.31094 -90.25978 3.05116 2.11673 -90.70689 642.14388 4280.0000 -92.95497 -89.54777 3.40719 2.21749 -89.54820 737.25734 4285.0000 -93.66687 -90.90245 2.76442 2.20825 -89.65445 736.54560 4290.0000 -93.57221 -90.02969 3.54252 2.17530 -90.03341 707.83396 4295.0000 -93.95628 -89.87648 4.07980 2.19267 -89.83361 738.08073 4300.0000 -93.52826 -90.61001 2.91825 2.20081 -89.73997 718.77746 4305.0000 -92.86869 -89.79813 3.07055 2.19286 -89.83137 677.47259 4310.0000 -93.72712 -90.21582 3.51131 2.21333 -89.59598 742.03775 4315.0000 -93.07955 -89.37866 3.70089 2.20543 -89.68689 681.71608 4320.0000 -93.73131 -90.73340 2.99791 2.17853 -89.99626 695.83435 4325.0000 -93.89966 -89.84367 4.05598 2.13349 -90.51416 688.03532 4330.0000 -94.07846 -90.85622 3.22224 2.13790 -90.46350 654.62089 4335.0000 -94.08315 -91.13223 2.95092 2.08699 -91.04895 648.71604 4340.0000 -93.50886 -89.67608 3.83278 2.14190 -90.41742 682.90190 4345.0000 -92.83910 -88.76459 4.07451 2.25470 -89.12019 789.92236 4350.0000 -93.76820 -89.56147 4.20673 2.27007 -88.94350 799.37668 4355.0000 -93.56093 -90.12453 3.43641 2.19612 -89.79392 743.02749 4360.0000 -94.58431 -91.61027 2.97404 2.10888 -90.79719 654.32131 4365.0000 -94.79192 -91.47241 3.31951 2.05762 -91.38678 620.06774 4370.0000 -94.38314 -91.63242 2.75072 2.05472 -91.42003 619.80687 4375.0000 -94.65898 -91.15278 3.50621 2.09046 -91.00905 636.92707 4380.0000 -94.48139 -90.96905 3.51233 2.11870 -90.68430 675.63265 4385.0000 -93.73582 -91.32187 2.41395 2.03346 -91.66453 571.14046 4390.0000 -93.52155 -90.99781 2.52374 2.11690 -90.70495 643.16479 4395.0000 -95.43950 -91.28906 4.15044 2.10207 -90.87559 654.71733 4400.0000 -93.73399 -90.70670 3.02729 2.09470 -90.96028 648.35916 4405.0000 -93.14939 -90.07465 3.07474 2.16206 -90.18562 682.01100 4410.0000 -94.18957 -90.03204 4.15753 2.15742 -90.23895 691.40044 4415.0000 -94.28619 -91.01853 3.26765 2.14798 -90.34750 701.91879 4420.0000 -94.10496 -90.57480 3.53016 2.12805 -90.57676 699.27033 4425.0000 -94.31925 -91.05019 3.26906 2.11276 -90.75255 666.74535 4430.0000 -94.06401 -90.02753 4.03648 2.11286 -90.75144 650.40592 4435.0000 -93.86879 -90.64567 3.22312 2.14954 -90.32965 695.82394 4440.0000 -93.55824 -90.01612 3.54212 2.12785 -90.57904 672.88767 4445.0000 -93.87470 -90.47550 3.39920 2.19879 -89.76319 741.93199 4450.0000 -92.77179 -89.58358 3.18821 2.17091 -90.08383 688.87288 4455.0000 -93.23064 -89.42605 3.80459 2.21811 -89.54105 722.28186 4460.0000 -93.78448 -90.53108 3.25340 2.14349 -90.39915 668.76948 4465.0000 -93.18450 -90.03512 3.14938 2.14355 -90.39846 655.17772 4470.0000 -93.20909 -89.91897 3.29013 2.17344 -90.05481 666.21281 4475.0000 -92.71352 -89.73716 2.97636 2.19274 -89.83277 686.57013 4480.0000 -93.12980 -88.96347 4.16633 2.26995 -88.94489 764.47700 4485.0000 -93.23823 -89.00569 4.23254 2.27504 -88.88630 797.73556 4490.0000 -93.20773 -89.10319 4.10454 2.25218 -89.14918 782.35439 4495.0000 -93.62771 -89.45092 4.17679 2.23003 -89.40391 764.51852 4500.0000 -92.75527 -88.73820 4.01708 2.26212 -89.03490 746.21260 FREEZING PROCESS: loop number 19 T-loop= 680.00000000000000 main_MD> interactions number 19 at Temperature= 680.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 1.58928 -2.09397 -1.87217 force_rgl> df(natom) -2.78816 -1.97319 -1.09756 4505.0000 -93.27278 -89.76955 3.50324 2.22267 -89.48860 719.82664 4510.0000 -94.61055 -91.02890 3.58165 2.15428 -90.27516 684.78615 4515.0000 -94.53726 -91.02017 3.51710 2.10130 -90.88436 635.31606 4520.0000 -94.27377 -91.10243 3.17134 2.06580 -91.29259 627.81186 4525.0000 -94.48450 -91.08789 3.39662 2.10204 -90.87586 665.31128 4530.0000 -94.31021 -90.96083 3.34938 2.07617 -91.17339 618.42786 4535.0000 -92.54105 -89.28184 3.25922 2.19816 -89.77048 720.77850 4540.0000 -92.30578 -88.55145 3.75433 2.23799 -89.31241 738.34529 4545.0000 -91.91400 -87.77970 4.13430 2.31274 -88.45272 800.92076 4550.0000 -92.61761 -88.95350 3.66411 2.31935 -88.37674 815.58617 4555.0000 -94.38084 -90.26838 4.11245 2.19038 -89.85990 725.23763 4560.0000 -93.95603 -90.45752 3.49851 2.15718 -90.24175 691.94561 4565.0000 -94.39124 -91.23520 3.15604 2.08248 -91.10088 640.01384 4570.0000 -93.67371 -90.72239 2.95132 2.07381 -91.20056 587.59615 4575.0000 -93.50022 -90.10096 3.39926 2.19788 -89.77370 689.02584 4580.0000 -93.33130 -90.86773 2.46357 2.17585 -90.02706 714.02064 4585.0000 -94.14587 -90.83600 3.30987 2.13855 -90.45599 694.84564 4590.0000 -93.84721 -90.33546 3.51175 2.13554 -90.49057 673.99430 4595.0000 -94.74011 -90.42530 4.31481 2.15864 -90.22499 721.15397 4600.0000 -93.67535 -90.56262 3.11273 2.12783 -90.57926 682.68272 4605.0000 -94.44500 -91.18804 3.25696 2.08783 -91.03933 636.10452 4610.0000 -94.69804 -91.76522 2.93283 2.03623 -91.63276 567.60846 4615.0000 -94.09712 -90.17321 3.92391 2.09409 -90.96729 625.44517 4620.0000 -94.02197 -90.81122 3.21075 2.14234 -90.41246 681.51784 4625.0000 -92.90040 -89.89192 3.00849 2.16011 -90.20801 700.24043 4630.0000 -92.94494 -88.66465 4.28029 2.23646 -89.33003 754.01834 4635.0000 -92.58442 -88.71926 3.86516 2.27339 -88.90527 755.40614 4640.0000 -93.45022 -89.74454 3.70568 2.24914 -89.18421 745.20138 4645.0000 -92.37725 -88.85078 3.52646 2.26544 -88.99673 785.23147 4650.0000 -93.36926 -89.93040 3.43886 2.23194 -89.38203 750.39969 4655.0000 -93.01385 -89.64751 3.36635 2.17739 -90.00930 723.52119 4660.0000 -94.61313 -91.23648 3.37664 2.10271 -90.86819 646.23350 4665.0000 -93.58212 -90.45739 3.12473 2.10080 -90.89016 613.03995 4670.0000 -93.88153 -90.96263 2.91890 2.12592 -90.60125 652.02332 4675.0000 -93.96753 -90.74871 3.21881 2.11556 -90.72034 679.16632 4680.0000 -94.07314 -91.45749 2.61565 2.05994 -91.36004 605.57083 4685.0000 -94.46534 -90.60309 3.86225 2.09307 -90.97907 633.51195 4690.0000 -94.01403 -90.64747 3.36656 2.09414 -90.96675 656.20932 4695.0000 -93.92900 -91.01687 2.91213 2.12751 -90.58291 675.79250 4700.0000 -94.52450 -90.92550 3.59900 2.09965 -90.90331 620.54622 4705.0000 -93.86659 -90.94581 2.92077 2.10562 -90.83471 648.34381 4710.0000 -93.04822 -89.47839 3.56983 2.18128 -89.96454 724.93920 4715.0000 -93.22212 -89.63310 3.58901 2.22126 -89.50478 714.76548 4720.0000 -93.42209 -90.14463 3.27746 2.18968 -89.86798 695.46236 4725.0000 -93.64281 -90.46472 3.17808 2.12450 -90.61758 605.83139 4730.0000 -93.98668 -90.70377 3.28291 2.14357 -90.39825 669.78898 4735.0000 -93.51569 -89.61377 3.90192 2.17202 -90.07108 729.56293 4740.0000 -94.15063 -91.12169 3.02894 2.16348 -90.16928 698.54987 4745.0000 -93.56142 -89.86834 3.69308 2.14730 -90.35534 685.89179 4750.0000 -92.55178 -89.38984 3.16194 2.22244 -89.49123 719.94030 FREEZING PROCESS: loop number 20 T-loop= 655.00000000000000 main_MD> interactions number 20 at Temperature= 655.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 1.64754 -1.54800 1.57032 force_rgl> df(natom) -0.65938 -1.24561 3.74406 4755.0000 -94.47451 -90.67951 3.79499 2.13066 -90.54670 667.01687 4760.0000 -94.57437 -90.79451 3.77986 2.09968 -90.90300 636.72850 4765.0000 -94.45502 -91.60966 2.84536 2.08727 -91.04572 638.09172 4770.0000 -94.74038 -92.76001 1.98037 2.00319 -92.01270 535.32876 4775.0000 -94.63963 -91.72795 2.91167 1.96097 -92.49823 503.02694 4780.0000 -94.26563 -91.37009 2.89554 2.07583 -91.17726 633.73465 4785.0000 -93.87042 -91.15793 2.71249 2.06836 -91.26315 629.48530 4790.0000 -93.30527 -90.47474 2.83053 2.13330 -90.51637 699.54655 4795.0000 -94.41541 -90.01441 4.40099 2.17553 -90.03072 707.70113 4800.0000 -93.34468 -89.66416 3.68052 2.16428 -90.16009 717.69958 4805.0000 -94.12054 -90.93990 3.18065 2.16159 -90.19101 714.57033 4810.0000 -94.35777 -90.24006 4.11770 2.12912 -90.56440 693.55621 4815.0000 -93.70414 -91.06764 2.63650 2.12974 -90.55733 692.26088 4820.0000 -93.16722 -90.42345 2.74377 2.08085 -91.11959 615.95925 4825.0000 -93.98075 -89.94937 4.03139 2.17570 -90.02878 702.68017 4830.0000 -94.04410 -91.10169 2.94241 2.12781 -90.57947 642.64011 4835.0000 -93.93396 -91.13732 2.79664 2.06407 -91.31252 588.12291 4840.0000 -94.58470 -91.70360 2.88110 2.05005 -91.47376 604.19614 4845.0000 -94.28114 -91.02203 3.25912 2.10563 -90.83464 695.06639 4850.0000 -93.75914 -90.19637 3.56277 2.16441 -90.15855 703.43876 4855.0000 -93.72403 -90.63803 3.08600 2.09319 -90.97762 624.88010 4860.0000 -93.83962 -90.54835 3.29126 2.13537 -90.49261 679.01284 4865.0000 -93.74392 -90.38148 3.36244 2.08771 -91.04063 638.48622 4870.0000 -94.00912 -90.64035 3.36877 2.12973 -90.55739 664.26017 4875.0000 -94.28028 -91.42631 2.85397 2.09291 -90.98091 651.18540 4880.0000 -94.11987 -90.19203 3.92784 2.09662 -90.93824 653.17022 4885.0000 -93.90670 -90.48501 3.42169 2.17135 -90.07879 698.73883 4890.0000 -94.53903 -91.21717 3.32185 2.09780 -90.92460 664.41130 4895.0000 -95.08986 -91.88476 3.20509 2.01050 -91.92856 577.51138 4900.0000 -94.32638 -91.41942 2.90696 2.06954 -91.24963 612.29095 4905.0000 -93.22690 -90.17222 3.05468 2.14743 -90.35385 674.55155 4910.0000 -93.90794 -90.35407 3.55387 2.14699 -90.35889 660.13060 4915.0000 -94.87617 -91.57039 3.30578 2.09326 -90.97681 632.94480 4920.0000 -93.59697 -90.50861 3.08836 2.08863 -91.03014 632.30409 4925.0000 -94.81309 -91.90848 2.90461 2.08745 -91.04368 648.75498 4930.0000 -94.53649 -91.61559 2.92091 2.02149 -91.80221 587.40843 4935.0000 -93.72813 -89.63769 4.09044 2.13075 -90.54567 686.34359 4940.0000 -93.70676 -90.03164 3.67512 2.19390 -89.81945 698.71422 4945.0000 -94.15516 -90.87094 3.28422 2.15064 -90.31702 690.51616 4950.0000 -94.68190 -90.90932 3.77259 2.09480 -90.95913 668.01786 4955.0000 -95.07775 -92.14561 2.93214 2.04188 -91.56774 630.85931 4960.0000 -94.61139 -91.20620 3.40518 2.02000 -91.81937 588.60603 4965.0000 -92.99393 -90.05581 2.93812 2.13673 -90.47688 702.54473 4970.0000 -93.92405 -91.24451 2.67954 2.15613 -90.25379 674.22451 4975.0000 -94.51828 -90.86328 3.65501 2.11882 -90.68290 653.89055 4980.0000 -94.25588 -91.58665 2.66923 2.08646 -91.05509 622.65697 4985.0000 -94.27691 -91.63058 2.64633 2.01415 -91.88667 578.25394 4990.0000 -94.72982 -91.16088 3.56894 2.08132 -91.11418 631.38169 4995.0000 -94.75118 -91.08344 3.66774 2.07892 -91.14181 637.61715 5000.0000 -93.49337 -90.30887 3.18449 2.12529 -90.60855 683.00009 FREEZING PROCESS: loop number 21 T-loop= 630.00000000000000 main_MD> interactions number 21 at Temperature= 630.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -1.87255 -0.75355 -0.58017 force_rgl> df(natom) -3.28142 -2.90402 0.65820 5005.0000 -94.58290 -91.07735 3.50556 2.08511 -91.07052 653.46762 5010.0000 -95.27468 -91.71525 3.55943 2.01638 -91.86099 612.97826 5015.0000 -95.08894 -91.79692 3.29202 2.06653 -91.28424 638.41133 5020.0000 -95.35337 -92.60383 2.74954 2.00967 -91.93818 575.82797 5025.0000 -94.63706 -91.73504 2.90202 2.02941 -91.71113 588.38141 5030.0000 -94.25879 -91.15841 3.10038 2.08643 -91.05537 622.89246 5035.0000 -93.86950 -91.08791 2.78159 2.05381 -91.43056 594.00375 5040.0000 -94.22826 -90.43715 3.79112 2.09374 -90.97128 650.61181 5045.0000 -93.87859 -90.69057 3.18801 2.11877 -90.68349 688.55518 5050.0000 -93.73892 -90.45274 3.28617 2.14061 -90.43230 694.81668 5055.0000 -93.41482 -90.55617 2.85865 2.08978 -91.01688 627.36679 5060.0000 -94.72391 -91.25754 3.46637 2.12684 -90.59066 667.37211 5065.0000 -95.66045 -92.06704 3.59341 2.03261 -91.67436 610.11293 5070.0000 -94.93729 -91.36141 3.57588 2.05829 -91.37900 633.58581 5075.0000 -94.33252 -91.17761 3.15490 2.09218 -90.98922 645.74119 5080.0000 -94.97804 -91.37986 3.59818 2.10931 -90.79229 671.06110 5085.0000 -94.51757 -91.60185 2.91572 2.06323 -91.32215 629.41552 5090.0000 -93.64211 -89.96260 3.67951 2.08235 -91.10232 636.14296 5095.0000 -93.43845 -90.90430 2.53415 2.17187 -90.07280 725.09110 5100.0000 -94.48710 -91.58266 2.90444 2.06705 -91.27828 617.73719 5105.0000 -94.16745 -91.10871 3.05874 2.08203 -91.10597 658.79027 5110.0000 -94.56183 -91.85591 2.70592 2.10597 -90.83066 647.24951 5115.0000 -93.54983 -90.21901 3.33083 2.04911 -91.48462 615.22762 5120.0000 -94.87032 -91.76685 3.10347 2.11483 -90.72876 682.06316 5125.0000 -94.30622 -90.81833 3.48789 2.03495 -91.64742 599.31173 5130.0000 -94.77777 -92.08278 2.69499 2.07805 -91.15177 627.73350 5135.0000 -95.43632 -92.01715 3.41917 2.02307 -91.78405 596.90564 5140.0000 -93.42290 -89.93141 3.49149 2.09153 -90.99671 637.88637 5145.0000 -93.47612 -89.83093 3.64519 2.19296 -89.83031 694.74600 5150.0000 -94.17025 -90.73997 3.43027 2.14718 -90.35673 657.17104 5155.0000 -94.66835 -91.19938 3.46897 2.07251 -91.21550 608.85279 5160.0000 -94.36251 -90.99264 3.36987 2.06615 -91.28865 579.78193 5165.0000 -94.29619 -90.82435 3.47183 2.13087 -90.54433 663.54923 5170.0000 -94.30415 -91.32674 2.97740 2.08694 -91.04948 651.69271 5175.0000 -93.09030 -89.75189 3.33842 2.11954 -90.67459 639.88127 5180.0000 -94.63279 -90.85876 3.77403 2.17517 -90.03488 720.16684 5185.0000 -95.26103 -92.27402 2.98700 2.01922 -91.82836 591.39462 5190.0000 -95.45610 -92.24914 3.20696 1.97444 -92.34330 571.93995 5195.0000 -94.61535 -91.38305 3.23230 2.07714 -91.16226 638.35272 5200.0000 -94.60988 -91.15350 3.45638 2.05148 -91.45738 613.96755 5205.0000 -94.48686 -91.50339 2.98347 2.08797 -91.03773 616.62694 5210.0000 -94.97366 -91.50145 3.47220 2.07426 -91.19535 616.39977 5215.0000 -93.98443 -90.47852 3.50591 2.11515 -90.72510 654.04746 5220.0000 -93.56930 -90.46012 3.10918 2.16373 -90.16643 685.49486 5225.0000 -94.86152 -91.49098 3.37054 2.08073 -91.12090 603.24039 5230.0000 -94.81345 -91.17870 3.63475 2.05502 -91.41668 630.43313 5235.0000 -94.61049 -92.19800 2.41249 2.01424 -91.88565 588.31238 5240.0000 -94.75924 -92.48569 2.27355 1.97277 -92.36249 528.25060 5245.0000 -94.97593 -91.26190 3.71403 2.04998 -91.47455 607.83752 5250.0000 -94.39584 -91.40451 2.99133 2.04900 -91.48590 583.74049 FREEZING PROCESS: loop number 22 T-loop= 605.00000000000000 main_MD> interactions number 22 at Temperature= 605.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 3.32301 1.40175 -1.33915 force_rgl> df(natom) 0.37585 -2.04222 0.94208 5255.0000 -94.65254 -91.65962 2.99292 2.00434 -91.99947 578.34648 5260.0000 -94.03177 -91.16442 2.86736 2.05814 -91.38070 613.93985 5265.0000 -94.36742 -91.52732 2.84010 2.08880 -91.02811 613.94059 5270.0000 -94.82172 -92.27738 2.54434 2.01116 -91.92098 576.84912 5275.0000 -95.22780 -92.14841 3.07939 1.96723 -92.42623 542.10165 5280.0000 -94.24012 -90.97248 3.26763 2.04040 -91.58477 584.88869 5285.0000 -94.19297 -91.29825 2.89472 2.05155 -91.45657 575.39636 5290.0000 -94.66519 -91.09339 3.57180 2.11886 -90.68247 664.51627 5295.0000 -94.98999 -91.25812 3.73188 2.07730 -91.16037 632.98813 5300.0000 -94.30443 -90.92540 3.37904 2.04134 -91.57394 597.14448 5305.0000 -95.22415 -92.04808 3.17608 2.05450 -91.42260 599.68729 5310.0000 -94.55752 -91.60593 2.95158 1.99970 -92.05281 555.49885 5315.0000 -95.07393 -92.06379 3.01014 2.02772 -91.73058 601.28634 5320.0000 -94.67408 -91.18642 3.48766 2.02610 -91.74918 579.68577 5325.0000 -94.69997 -92.06117 2.63881 2.04330 -91.55143 591.08715 5330.0000 -94.20700 -91.25597 2.95104 2.01717 -91.85188 583.88324 5335.0000 -94.83865 -92.61948 2.21918 2.00265 -92.01889 562.73469 5340.0000 -94.69371 -92.09407 2.59964 1.97339 -92.35542 536.32667 5345.0000 -94.24700 -91.49077 2.75623 1.97001 -92.39430 529.60232 5350.0000 -95.05391 -92.05306 3.00085 2.03582 -91.63742 606.83549 5355.0000 -94.11507 -91.41059 2.70448 2.08217 -91.10444 617.94349 5360.0000 -93.93604 -90.70241 3.23364 2.07255 -91.21506 577.04749 5365.0000 -93.49218 -90.27709 3.21508 2.17522 -90.03428 642.82034 5370.0000 -93.97973 -90.82060 3.15913 2.13083 -90.54480 648.24229 5375.0000 -93.61354 -91.23369 2.37986 2.08490 -91.07302 608.60569 5380.0000 -93.94944 -90.78677 3.16267 2.10196 -90.87680 635.86029 5385.0000 -93.52217 -90.47480 3.04737 2.15881 -90.22304 679.95449 5390.0000 -94.22905 -90.76275 3.46630 2.13507 -90.49607 620.51737 5395.0000 -93.57346 -90.62188 2.95158 2.13671 -90.47716 632.04391 5400.0000 -93.22155 -89.48529 3.73626 2.18690 -89.89996 696.37223 5405.0000 -94.11819 -90.35492 3.76327 2.17591 -90.02634 697.98111 5410.0000 -94.41452 -91.28062 3.13390 2.10821 -90.80497 646.38444 5415.0000 -94.85007 -91.30922 3.54084 2.02759 -91.73206 594.20434 5420.0000 -94.07813 -90.82637 3.25176 2.09332 -90.97615 660.18468 5425.0000 -94.63673 -91.20049 3.43624 2.09839 -90.91788 675.55813 5430.0000 -94.48091 -91.90141 2.57949 2.01822 -91.83982 612.23313 5435.0000 -95.13819 -91.09577 4.04242 2.04629 -91.51699 600.09122 5440.0000 -95.23957 -91.47199 3.76758 2.03306 -91.66914 581.69209 5445.0000 -93.96271 -91.08772 2.87500 2.03927 -91.59774 608.19505 5450.0000 -94.77401 -92.08384 2.69016 2.05824 -91.37958 602.41381 5455.0000 -95.81073 -92.69060 3.12013 1.96118 -92.49584 537.83259 5460.0000 -95.25476 -93.20879 2.04597 1.90928 -93.09270 519.07315 5465.0000 -95.38131 -92.23234 3.14897 1.92540 -92.90730 546.01960 5470.0000 -96.14633 -92.51393 3.63240 1.99239 -92.13686 602.53714 5475.0000 -93.90920 -90.54597 3.36323 2.06304 -91.32442 637.13237 5480.0000 -93.89311 -91.10219 2.79092 2.11886 -90.68240 673.45171 5485.0000 -94.05491 -90.74848 3.30643 2.06151 -91.34203 601.47690 5490.0000 -94.32226 -91.26648 3.05578 2.10474 -90.84488 652.08351 5495.0000 -95.52631 -92.23175 3.29457 1.99937 -92.05660 569.62418 5500.0000 -94.60558 -91.44927 3.15631 2.01334 -91.89598 579.24224 FREEZING PROCESS: loop number 23 T-loop= 580.00000000000000 main_MD> interactions number 23 at Temperature= 580.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -1.49838 -0.33306 -1.37928 force_rgl> df(natom) 0.06151 -3.36114 -1.69207 5505.0000 -94.39915 -91.82986 2.56930 2.04611 -91.51904 574.71468 5510.0000 -94.48085 -91.81201 2.66885 2.00997 -91.93472 543.74634 5515.0000 -95.62151 -91.95828 3.66323 2.01409 -91.88732 581.42946 5520.0000 -95.36127 -92.50980 2.85147 1.97555 -92.33061 542.64278 5525.0000 -95.08004 -92.20344 2.87659 1.98044 -92.27435 529.15990 5530.0000 -95.66309 -92.42103 3.24206 1.95394 -92.57910 502.45682 5535.0000 -94.88483 -91.68882 3.19600 2.02680 -91.74111 579.91167 5540.0000 -94.98752 -91.73009 3.25743 2.04210 -91.56526 626.38027 5545.0000 -94.06663 -90.96756 3.09907 2.02536 -91.75772 560.00529 5550.0000 -94.50260 -91.37273 3.12987 2.10115 -90.88617 611.79955 5555.0000 -93.81743 -91.15462 2.66281 2.06095 -91.34844 573.81055 5560.0000 -94.29916 -91.08619 3.21298 2.08248 -91.10081 611.93226 5565.0000 -93.84179 -91.16595 2.67583 2.08098 -91.11808 617.12492 5570.0000 -94.61697 -91.92128 2.69569 2.06039 -91.35484 615.78677 5575.0000 -94.49017 -91.79600 2.69416 2.02037 -91.81510 561.98114 5580.0000 -94.85334 -92.12975 2.72359 1.99477 -92.10948 518.90923 5585.0000 -94.48319 -91.39679 3.08640 2.02747 -91.73348 554.27151 5590.0000 -94.98513 -91.54849 3.43663 2.06987 -91.24585 613.80376 5595.0000 -94.99337 -91.81687 3.17650 2.02296 -91.78537 563.98886 5600.0000 -93.95156 -90.61151 3.34005 2.09108 -91.00198 642.27286 5605.0000 -94.47955 -91.38361 3.09594 2.09338 -90.97552 628.30299 5610.0000 -93.81048 -90.53882 3.27166 2.06169 -91.33993 594.91411 5615.0000 -94.39926 -91.35822 3.04104 2.08372 -91.08654 633.95940 5620.0000 -95.12552 -92.50137 2.62416 2.01375 -91.89125 575.43308 5625.0000 -94.64532 -91.24593 3.39939 1.98187 -92.25787 518.93384 5630.0000 -94.20808 -91.46316 2.74492 2.08362 -91.08771 622.61818 5635.0000 -94.60616 -91.27963 3.32654 2.07513 -91.18531 647.32662 5640.0000 -95.50176 -92.44174 3.06001 1.99680 -92.08618 552.17198 5645.0000 -95.17749 -91.36639 3.81110 2.01339 -91.89536 579.72819 5650.0000 -95.20519 -91.34284 3.86235 2.04308 -91.55394 608.72516 5655.0000 -95.28237 -92.35377 2.92860 1.97787 -92.30389 555.78806 5660.0000 -94.41424 -91.76730 2.64693 1.99526 -92.10387 561.88146 5665.0000 -94.45180 -91.50111 2.95069 2.06345 -91.31968 615.30675 5670.0000 -94.02908 -91.22730 2.80178 2.06414 -91.31178 610.36045 5675.0000 -94.70159 -91.82106 2.88053 2.04750 -91.50305 603.15492 5680.0000 -95.71501 -92.81884 2.89617 1.97660 -92.31847 547.94522 5685.0000 -95.09071 -92.38621 2.70450 1.96556 -92.44546 559.72689 5690.0000 -95.19657 -92.48681 2.70975 1.94449 -92.68773 550.12295 5695.0000 -94.90698 -91.79011 3.11687 1.98756 -92.19244 561.17995 5700.0000 -94.98256 -91.41813 3.56443 2.03020 -91.70207 619.09042 5705.0000 -95.45549 -92.22935 3.22614 1.99265 -92.13392 554.96136 5710.0000 -94.76876 -91.66363 3.10513 1.97875 -92.29379 546.48610 5715.0000 -95.06074 -91.95553 3.10521 2.04509 -91.53083 613.26788 5720.0000 -94.26223 -91.17567 3.08656 2.04360 -91.54801 605.65091 5725.0000 -94.14932 -91.72438 2.42494 2.07176 -91.22407 635.06287 5730.0000 -94.84422 -91.85381 2.99041 2.03229 -91.67806 586.18273 5735.0000 -94.58567 -91.72195 2.86372 1.99364 -92.12256 565.37648 5740.0000 -95.05864 -91.71266 3.34598 2.04276 -91.55761 606.49533 5745.0000 -94.58168 -91.44063 3.14106 2.05246 -91.44607 597.28550 5750.0000 -94.86832 -90.74536 4.12297 2.09545 -90.95168 642.66341 FREEZING PROCESS: loop number 24 T-loop= 555.00000000000000 main_MD> interactions number 24 at Temperature= 555.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 3.44039 -0.37198 -1.54617 force_rgl> df(natom) -2.36969 2.65520 -2.12558 5755.0000 -94.53471 -91.79653 2.73819 2.07057 -91.23778 602.29246 5760.0000 -94.73975 -91.86884 2.87091 2.03299 -91.66996 588.97010 5765.0000 -94.92643 -92.86341 2.06302 1.96008 -92.50849 550.04506 5770.0000 -95.17253 -92.51645 2.65609 1.97139 -92.37837 531.91260 5775.0000 -95.22700 -92.53220 2.69480 1.96479 -92.45433 532.12008 5780.0000 -95.37024 -93.30545 2.06480 1.92987 -92.85589 492.06034 5785.0000 -95.08681 -92.21014 2.87667 1.94008 -92.73849 514.09617 5790.0000 -94.59627 -91.51577 3.08049 2.03513 -91.64532 600.24752 5795.0000 -93.92171 -90.94722 2.97449 2.07298 -91.21008 614.45628 5800.0000 -94.16066 -91.22401 2.93665 2.09544 -90.95182 609.68295 5805.0000 -94.88191 -90.60387 4.27804 2.08816 -91.03549 635.53785 5810.0000 -93.63241 -90.27236 3.36005 2.10870 -90.79931 652.58519 5815.0000 -94.89310 -91.51453 3.37857 2.04818 -91.49534 574.34852 5820.0000 -94.91863 -92.11865 2.79997 1.99616 -92.09353 556.49406 5825.0000 -95.64439 -93.18424 2.46015 1.93729 -92.77057 500.31925 5830.0000 -95.23791 -92.41688 2.82104 1.93559 -92.79011 503.80846 5835.0000 -94.90388 -91.96996 2.93392 1.95740 -92.53924 524.49049 5840.0000 -94.69282 -91.03346 3.65936 2.03028 -91.70113 593.42901 5845.0000 -95.49179 -92.68108 2.81071 2.00572 -91.98355 582.06311 5850.0000 -95.43443 -92.95514 2.47929 1.92672 -92.89209 478.74949 5855.0000 -95.40426 -92.18050 3.22376 2.00630 -91.97689 546.77888 5860.0000 -94.51587 -92.41185 2.10402 2.02429 -91.77004 558.82095 5865.0000 -94.92138 -92.40112 2.52026 1.94483 -92.68385 503.86567 5870.0000 -95.17848 -91.71273 3.46574 1.99565 -92.09942 552.07251 5875.0000 -94.55047 -91.44417 3.10631 2.04200 -91.56632 607.63766 5880.0000 -94.69209 -91.62243 3.06965 2.00242 -92.02150 554.39458 5885.0000 -94.87274 -92.19762 2.67512 2.02887 -91.71735 574.93305 5890.0000 -95.08840 -92.45928 2.62912 1.97513 -92.33534 532.39761 5895.0000 -94.61254 -92.29936 2.31318 1.96007 -92.50862 504.44165 5900.0000 -95.09173 -91.82772 3.26401 1.98980 -92.16667 537.66500 5905.0000 -94.46088 -91.11557 3.34531 2.07885 -91.14261 629.58985 5910.0000 -94.63750 -91.72064 2.91687 1.99912 -92.05949 571.92767 5915.0000 -95.11041 -92.46626 2.64415 2.02197 -91.79669 577.15428 5920.0000 -95.00038 -92.16961 2.83077 1.97948 -92.28537 527.93098 5925.0000 -95.19865 -92.12426 3.07439 2.02094 -91.80850 584.29253 5930.0000 -95.32352 -92.79008 2.53345 1.96160 -92.49099 536.73868 5935.0000 -94.54744 -91.85360 2.69384 1.97223 -92.36874 529.75722 5940.0000 -94.26952 -91.59907 2.67045 2.01605 -91.86481 564.58910 5945.0000 -94.92616 -92.15720 2.76896 2.00621 -91.97790 564.07383 5950.0000 -94.75051 -91.79231 2.95820 1.99965 -92.05344 541.12462 5955.0000 -94.87614 -91.62211 3.25403 2.03240 -91.67671 579.12194 5960.0000 -94.57375 -91.40920 3.16455 1.99618 -92.09327 552.75636 5965.0000 -95.68526 -92.30310 3.38215 1.99534 -92.10300 573.52005 5970.0000 -95.45700 -92.24373 3.21327 2.00823 -91.95477 585.18477 5975.0000 -94.21941 -91.45343 2.76598 2.02718 -91.73681 565.08485 5980.0000 -95.20495 -92.61771 2.58724 2.00609 -91.97934 555.85840 5985.0000 -94.68267 -92.70159 1.98109 1.94949 -92.63031 513.74742 5990.0000 -95.44374 -92.45846 2.98528 1.94482 -92.68396 471.12678 5995.0000 -95.06961 -91.92603 3.14358 1.96389 -92.46459 526.06634 6000.0000 -94.42466 -91.99201 2.43265 2.04167 -91.57021 584.80124 FREEZING PROCESS: loop number 25 T-loop= 530.00000000000000 main_MD> interactions number 25 at Temperature= 530.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 1.25820 0.62046 1.19807 force_rgl> df(natom) 0.70048 1.66073 -1.74816 6005.0000 -94.43672 -92.36062 2.07610 1.97664 -92.31806 531.87850 6010.0000 -94.78798 -92.08461 2.70337 1.97859 -92.29564 535.65543 6015.0000 -95.06555 -92.32735 2.73820 1.98329 -92.24149 564.30495 6020.0000 -95.03099 -92.32449 2.70650 1.97807 -92.30160 542.58650 6025.0000 -94.53482 -91.82050 2.71432 1.99032 -92.16072 532.86616 6030.0000 -95.04643 -92.52683 2.51959 1.97645 -92.32024 528.68960 6035.0000 -95.12702 -92.64754 2.47948 1.97150 -92.37711 538.60477 6040.0000 -95.96816 -93.03772 2.93044 1.94870 -92.63937 521.88152 6045.0000 -94.91831 -92.48571 2.43260 1.96290 -92.47601 547.51562 6050.0000 -95.05347 -92.38751 2.66596 1.94112 -92.72650 514.87963 6055.0000 -94.97108 -92.34924 2.62184 1.97238 -92.36704 576.25406 6060.0000 -95.34975 -92.66303 2.68671 1.96248 -92.48088 541.41027 6065.0000 -94.88827 -92.23831 2.64995 1.97475 -92.33971 539.21968 6070.0000 -95.32379 -92.45603 2.86776 1.96348 -92.46933 524.51467 6075.0000 -95.11215 -92.29576 2.81640 1.97438 -92.34398 534.42977 6080.0000 -95.94859 -92.76920 3.17939 1.97232 -92.36765 542.00713 6085.0000 -94.97368 -92.29099 2.68270 1.94698 -92.65912 527.57692 6090.0000 -94.98398 -92.10029 2.88369 1.96738 -92.42455 530.45234 6095.0000 -94.80929 -92.07402 2.73527 1.98143 -92.26292 555.15246 6100.0000 -94.17192 -91.65777 2.51415 2.02730 -91.73540 572.53725 6105.0000 -95.58583 -93.40527 2.18055 1.99551 -92.10097 555.63250 6110.0000 -95.92305 -93.48641 2.43663 1.92989 -92.85563 506.82639 6115.0000 -95.41810 -93.24358 2.17453 1.90636 -93.12625 469.41992 6120.0000 -95.36939 -92.76976 2.59962 1.91649 -93.00980 497.19224 6125.0000 -95.74802 -93.46822 2.27980 1.91891 -92.98196 471.81513 6130.0000 -95.44441 -93.13874 2.30567 1.89497 -93.25721 437.47773 6135.0000 -95.11284 -92.69839 2.41444 1.93283 -92.82190 492.20927 6140.0000 -95.49564 -93.38519 2.11045 1.92142 -92.95307 500.95888 6145.0000 -96.22756 -93.53941 2.68815 1.90054 -93.19318 472.77278 6150.0000 -95.64721 -93.09295 2.55426 1.91610 -93.01422 489.24927 6155.0000 -95.22239 -92.42516 2.79722 1.91715 -93.00214 508.35531 6160.0000 -94.56106 -92.16266 2.39840 1.98171 -92.25965 557.42669 6165.0000 -95.08539 -92.19240 2.89298 1.96825 -92.41452 534.86491 6170.0000 -95.86874 -92.47077 3.39797 1.94109 -92.72689 514.83688 6175.0000 -94.27919 -91.47817 2.80102 1.99404 -92.11796 560.27502 6180.0000 -95.04290 -92.31039 2.73251 2.03143 -91.68788 583.78659 6185.0000 -94.78072 -92.14427 2.63645 1.96178 -92.48896 527.94582 6190.0000 -94.65383 -91.83164 2.82219 1.96905 -92.40534 519.76406 6195.0000 -95.31332 -92.66332 2.65000 1.97257 -92.36488 510.07036 6200.0000 -95.09020 -91.77082 3.31938 1.98473 -92.22499 526.30087 6205.0000 -94.13002 -91.55710 2.57292 2.04575 -91.52326 588.77865 6210.0000 -95.59112 -92.87577 2.71535 1.96169 -92.48993 521.50206 6215.0000 -95.11158 -93.17836 1.93322 1.94841 -92.64262 507.92676 6220.0000 -94.85531 -92.29206 2.56326 1.90305 -93.16430 448.32334 6225.0000 -94.89921 -92.31393 2.58529 1.96968 -92.39810 520.16300 6230.0000 -94.55594 -91.95037 2.60557 2.00095 -92.03848 538.60696 6235.0000 -94.55876 -91.36061 3.19815 2.04774 -91.50030 581.61540 6240.0000 -94.21714 -91.94774 2.26939 2.01432 -91.88464 551.04768 6245.0000 -94.47589 -91.59484 2.88105 2.03933 -91.59707 569.53874 6250.0000 -95.57122 -92.85298 2.71824 2.00264 -92.01904 555.54995 FREEZING PROCESS: loop number 26 T-loop= 505.00000000000000 main_MD> interactions number 26 at Temperature= 505.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -0.81734 0.00501 -0.75979 force_rgl> df(natom) 0.32649 0.49110 0.38681 6255.0000 -95.74565 -93.73862 2.00703 1.88110 -93.41679 438.69806 6260.0000 -95.61289 -93.12907 2.48382 1.90022 -93.19684 462.30591 6265.0000 -95.18350 -93.01917 2.16432 1.91355 -93.04357 466.14336 6270.0000 -95.65046 -93.39071 2.25975 1.91470 -93.03032 490.70015 6275.0000 -95.69030 -93.15332 2.53697 1.86801 -93.56735 470.21184 6280.0000 -95.55063 -93.50264 2.04799 1.90566 -93.13430 488.04931 6285.0000 -95.71708 -92.78496 2.93211 1.90191 -93.17748 492.29484 6290.0000 -95.11794 -92.97288 2.14505 1.94535 -92.67791 544.07491 6295.0000 -96.04504 -93.66316 2.38188 1.87803 -93.45206 460.75502 6300.0000 -95.45305 -93.30990 2.14315 1.90815 -93.10562 485.41766 6305.0000 -95.86758 -93.18131 2.68627 1.89523 -93.25427 478.58739 6310.0000 -95.76236 -93.64069 2.12167 1.89042 -93.30953 471.85583 6315.0000 -95.83061 -93.37955 2.45106 1.86738 -93.57451 443.97869 6320.0000 -95.71739 -93.22768 2.48971 1.88155 -93.41158 453.37667 6325.0000 -95.43458 -92.15494 3.27964 1.96844 -92.41235 568.46645 6330.0000 -95.47090 -93.51750 1.95340 1.93419 -92.80620 545.72876 6335.0000 -95.84004 -92.81615 3.02389 1.89745 -93.22876 509.61978 6340.0000 -95.90026 -93.21517 2.68509 1.88833 -93.33363 467.26853 6345.0000 -94.95938 -92.56646 2.39292 1.89792 -93.22332 448.85034 6350.0000 -95.43036 -92.87425 2.55610 1.96079 -92.50030 541.39273 6355.0000 -95.67739 -93.13527 2.54213 1.91842 -92.98751 496.44064 6360.0000 -95.78646 -93.29846 2.48801 1.88984 -93.31626 471.84684 6365.0000 -96.06461 -93.58801 2.47659 1.85784 -93.68420 430.76762 6370.0000 -96.03730 -93.17550 2.86179 1.88843 -93.33252 467.83554 6375.0000 -95.49124 -92.70668 2.78456 1.93864 -92.75506 517.61951 6380.0000 -94.82551 -92.36372 2.46179 1.93865 -92.75486 511.94495 6385.0000 -95.67250 -93.24228 2.43022 1.90351 -93.15904 479.43429 6390.0000 -95.21686 -92.66938 2.54748 1.93899 -92.75105 536.40965 6395.0000 -95.76927 -93.45228 2.31700 1.90892 -93.09680 468.36521 6400.0000 -95.72879 -93.51663 2.21216 1.89198 -93.29160 463.78069 6405.0000 -96.17337 -93.43266 2.74071 1.88332 -93.39120 465.98004 6410.0000 -95.67937 -92.95301 2.72636 1.90583 -93.13230 486.70045 6415.0000 -96.05035 -93.32434 2.72601 1.91250 -93.05566 493.07286 6420.0000 -95.49339 -92.76269 2.73070 1.89759 -93.22708 477.92544 6425.0000 -95.69210 -93.48405 2.20804 1.89387 -93.26993 481.52029 6430.0000 -95.17808 -92.64544 2.53264 1.92758 -92.88228 507.63580 6435.0000 -95.33508 -92.73496 2.60012 1.95042 -92.61953 556.74316 6440.0000 -95.59263 -93.06737 2.52527 1.91371 -93.04179 532.24964 6445.0000 -95.76553 -93.04855 2.71699 1.86251 -93.63058 469.37930 6450.0000 -96.27849 -93.80489 2.47360 1.89100 -93.30291 504.84055 6455.0000 -95.59166 -93.08261 2.50905 1.88026 -93.42638 489.72494 6460.0000 -95.85193 -93.06730 2.78463 1.90353 -93.15881 493.95468 6465.0000 -95.14441 -92.57394 2.57047 1.91437 -93.03418 479.36441 6470.0000 -95.54086 -93.21501 2.32585 1.91261 -93.05444 473.92700 6475.0000 -96.03043 -93.65123 2.37921 1.90952 -93.08994 483.79218 6480.0000 -95.48762 -93.49966 1.98796 1.87187 -93.52296 448.12276 6485.0000 -96.56640 -93.94347 2.62293 1.87123 -93.53027 446.41004 6490.0000 -96.27108 -93.61311 2.65797 1.84876 -93.78866 449.94769 6495.0000 -96.07983 -93.23592 2.84392 1.90769 -93.11101 518.64920 6500.0000 -96.00679 -93.34583 2.66096 1.87202 -93.52120 486.70093 FREEZING PROCESS: loop number 27 T-loop= 480.00000000000000 main_MD> interactions number 27 at Temperature= 480.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -0.76274 -1.16390 -1.16976 force_rgl> df(natom) 0.58957 -1.04694 0.99226 6505.0000 -96.02118 -93.55441 2.46677 1.84521 -93.82956 427.57762 6510.0000 -95.26864 -93.00760 2.26104 1.91427 -93.03530 500.07253 6515.0000 -95.28506 -92.45533 2.82973 1.93562 -92.78973 511.40822 6520.0000 -94.93591 -92.35711 2.57880 2.00158 -92.03118 570.63922 6525.0000 -95.83558 -93.29516 2.54042 1.93888 -92.75231 517.76325 6530.0000 -95.66999 -93.30293 2.36706 1.89271 -93.28322 467.10358 6535.0000 -95.75848 -93.24674 2.51173 1.89500 -93.25685 460.80495 6540.0000 -95.51317 -93.36884 2.14433 1.89427 -93.26534 466.70122 6545.0000 -95.73568 -93.26447 2.47120 1.90551 -93.13600 460.26078 6550.0000 -95.57347 -93.05828 2.51519 1.91753 -92.99777 481.13928 6555.0000 -95.57736 -93.37954 2.19782 1.89526 -93.25394 450.19529 6560.0000 -95.06804 -93.37920 1.68884 1.88949 -93.32030 462.76079 6565.0000 -95.10420 -92.58965 2.51455 1.91621 -93.01296 484.66879 6570.0000 -95.50264 -93.16623 2.33641 1.91865 -92.98487 478.94098 6575.0000 -95.91021 -93.58434 2.32587 1.86724 -93.57618 460.05081 6580.0000 -96.16771 -94.34014 1.82757 1.82893 -94.01669 425.54885 6585.0000 -95.72907 -93.96595 1.76312 1.82478 -94.06445 410.61601 6590.0000 -95.95588 -93.89635 2.05953 1.87482 -93.48897 448.00300 6595.0000 -95.90573 -93.55659 2.34915 1.84729 -93.80555 419.04381 6600.0000 -95.86579 -93.97030 1.89550 1.85691 -93.69496 438.14495 6605.0000 -95.72219 -93.69237 2.02982 1.84489 -93.83318 423.40909 6610.0000 -96.08913 -93.81346 2.27567 1.83697 -93.92432 424.52891 6615.0000 -95.54265 -92.95532 2.58733 1.88907 -93.32512 472.47127 6620.0000 -96.34318 -93.95146 2.39172 1.90831 -93.10380 485.67554 6625.0000 -96.11966 -94.06128 2.05838 1.84811 -93.79614 446.26263 6630.0000 -95.81810 -94.23664 1.58146 1.85611 -93.70416 459.37170 6635.0000 -96.25411 -93.72764 2.52647 1.82746 -94.03359 418.07001 6640.0000 -96.09057 -93.65286 2.43772 1.83126 -93.98994 422.41540 6645.0000 -95.69443 -93.42327 2.27116 1.86782 -93.56946 453.84575 6650.0000 -95.52293 -93.19749 2.32544 1.89690 -93.23506 503.05982 6655.0000 -95.90241 -93.89302 2.00939 1.88709 -93.34786 444.77138 6660.0000 -95.88894 -93.51034 2.37861 1.85309 -93.73890 423.37984 6665.0000 -95.46663 -92.80284 2.66379 1.92979 -92.85685 500.76469 6670.0000 -95.60795 -92.49753 3.11042 1.95250 -92.59568 513.22296 6675.0000 -94.80765 -92.35845 2.44920 1.98251 -92.25052 536.33740 6680.0000 -95.37289 -93.67525 1.69764 1.93686 -92.77550 476.04556 6685.0000 -95.74274 -93.38629 2.35645 1.87255 -93.51505 444.43821 6690.0000 -95.42215 -92.96653 2.45562 1.88510 -93.37073 467.19564 6695.0000 -95.67793 -93.10399 2.57393 1.94643 -92.66544 547.98916 6700.0000 -95.31327 -92.90625 2.40703 1.92763 -92.88164 507.22695 6705.0000 -95.56465 -92.96049 2.60416 1.91766 -92.99628 509.92078 6710.0000 -95.54267 -92.98498 2.55769 1.91736 -92.99975 503.91654 6715.0000 -95.26943 -93.19374 2.07569 1.92158 -92.95120 495.53401 6720.0000 -95.86784 -93.11653 2.75131 1.92593 -92.90121 505.17290 6725.0000 -96.18101 -93.16223 3.01878 1.88522 -93.36943 503.31283 6730.0000 -96.60239 -94.19218 2.41020 1.87190 -93.52253 484.98779 6735.0000 -96.10510 -93.68685 2.41825 1.85813 -93.68088 476.42436 6740.0000 -95.75749 -93.46423 2.29326 1.86621 -93.58802 481.83475 6745.0000 -95.90727 -93.07412 2.83315 1.87946 -93.43560 484.62208 6750.0000 -95.58692 -93.32101 2.26591 1.89420 -93.26612 514.89794 FREEZING PROCESS: loop number 28 T-loop= 455.00000000000000 main_MD> interactions number 28 at Temperature= 455.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 0.36885 0.29832 -0.66458 force_rgl> df(natom) -0.52838 -0.21832 1.50383 6755.0000 -95.76048 -93.25205 2.50842 1.89472 -93.26017 506.61022 6760.0000 -96.00061 -93.74219 2.25842 1.87591 -93.47647 500.24322 6765.0000 -95.93497 -93.95797 1.97700 1.84527 -93.82881 474.14169 6770.0000 -96.24224 -94.77691 1.46533 1.78685 -94.50067 405.88978 6775.0000 -96.79742 -94.47574 2.32167 1.76616 -94.73856 379.49886 6780.0000 -96.85669 -94.86626 1.99043 1.77290 -94.66113 388.85910 6785.0000 -96.71183 -94.55262 2.15921 1.76689 -94.73024 391.95334 6790.0000 -96.18568 -93.97990 2.20579 1.80414 -94.30182 422.06053 6795.0000 -96.73614 -94.15886 2.57729 1.81150 -94.21723 431.37817 6800.0000 -96.68408 -94.36114 2.32295 1.78397 -94.53378 414.25290 6805.0000 -96.23272 -94.31659 1.91613 1.81067 -94.22668 430.68892 6810.0000 -96.47284 -94.11679 2.35605 1.79932 -94.35726 425.51444 6815.0000 -96.68063 -93.80145 2.87918 1.82934 -94.01199 460.37760 6820.0000 -95.51011 -93.09136 2.41875 1.88588 -93.36178 514.09673 6825.0000 -95.83866 -92.73857 3.10009 1.92870 -92.86934 545.14286 6830.0000 -96.64656 -93.78118 2.86538 1.87730 -93.46049 508.96188 6835.0000 -96.03843 -93.65724 2.38119 1.86562 -93.59483 490.40433 6840.0000 -95.97879 -93.58558 2.39322 1.82265 -94.08896 431.11691 6845.0000 -96.08426 -93.62385 2.46041 1.84508 -93.83102 470.98660 6850.0000 -95.63381 -93.35062 2.28319 1.88397 -93.38377 481.01356 6855.0000 -95.62664 -92.95667 2.66997 1.91569 -93.01899 515.55073 6860.0000 -95.03507 -92.20778 2.82728 1.95157 -92.60628 507.53237 6865.0000 -95.43723 -92.99820 2.43903 1.96318 -92.47279 535.02775 6870.0000 -95.67362 -93.16633 2.50729 1.94255 -92.71001 510.59320 6875.0000 -95.65521 -92.56067 3.09454 1.94348 -92.69942 492.35121 6880.0000 -95.39594 -92.56066 2.83528 1.94725 -92.65597 507.24604 6885.0000 -95.09677 -92.41780 2.67897 1.94544 -92.67681 527.72512 6890.0000 -95.93072 -93.42019 2.51052 1.90726 -93.11587 451.14272 6895.0000 -96.16590 -94.29630 1.86960 1.83478 -93.94949 417.21497 6900.0000 -96.33867 -93.99747 2.34120 1.80773 -94.26053 427.62798 6905.0000 -96.10354 -94.29368 1.80986 1.82343 -94.07998 432.64651 6910.0000 -96.55854 -94.60121 1.95733 1.81319 -94.19776 422.57767 6915.0000 -96.42197 -93.76881 2.65317 1.79668 -94.38764 424.92397 6920.0000 -95.92516 -93.69202 2.23314 1.87629 -93.47208 492.75855 6925.0000 -95.89377 -93.43952 2.45425 1.86934 -93.55202 489.61981 6930.0000 -95.77339 -93.55768 2.21570 1.86956 -93.54949 468.18894 6935.0000 -95.66874 -93.46056 2.20818 1.86126 -93.64494 437.44921 6940.0000 -95.49946 -93.08006 2.41940 1.89675 -93.23683 462.73809 6945.0000 -95.26909 -92.81971 2.44938 1.92031 -92.96583 492.21439 6950.0000 -95.63271 -93.33501 2.29770 1.88206 -93.40576 461.56394 6955.0000 -95.63132 -93.63535 1.99597 1.87649 -93.46976 453.98626 6960.0000 -95.71099 -93.13234 2.57864 1.88879 -93.32829 443.93119 6965.0000 -95.95917 -93.22362 2.73555 1.90469 -93.14549 466.71657 6970.0000 -95.03170 -92.80587 2.22582 1.90993 -93.08523 485.16188 6975.0000 -95.64920 -92.89069 2.75851 1.94194 -92.71702 517.95190 6980.0000 -95.62771 -93.08657 2.54114 1.92014 -92.96779 491.11034 6985.0000 -96.06852 -93.12206 2.94646 1.88220 -93.40411 462.93387 6990.0000 -96.18157 -94.03738 2.14420 1.85858 -93.67570 460.69574 6995.0000 -96.31743 -94.77947 1.53796 1.77140 -94.67834 374.34275 7000.0000 -96.61135 -94.31586 2.29549 1.81120 -94.22063 415.85842 FREEZING PROCESS: loop number 29 T-loop= 430.00000000000000 main_MD> interactions number 29 at Temperature= 430.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 0.20917 1.29316 0.46936 force_rgl> df(natom) -1.26189 0.82378 1.76295 7005.0000 -96.48743 -94.57839 1.90904 1.80266 -94.31887 417.35183 7010.0000 -95.98387 -93.90426 2.07962 1.82576 -94.05322 434.31888 7015.0000 -96.22044 -94.20206 2.01838 1.79765 -94.37645 403.80866 7020.0000 -96.43367 -94.18316 2.25051 1.79880 -94.36323 414.56644 7025.0000 -96.13163 -93.49727 2.63437 1.82755 -94.03261 428.37569 7030.0000 -95.72561 -93.59905 2.12656 1.89267 -93.28368 479.77911 7035.0000 -96.20364 -93.90832 2.29532 1.84342 -93.85004 426.34833 7040.0000 -96.49062 -94.27307 2.21754 1.85034 -93.77053 461.76840 7045.0000 -96.56532 -94.29600 2.26932 1.82952 -94.00993 438.72668 7050.0000 -96.27077 -94.45909 1.81168 1.79243 -94.43653 402.70402 7055.0000 -96.43884 -94.17020 2.26865 1.78945 -94.47076 401.55371 7060.0000 -96.71289 -94.15721 2.55567 1.80287 -94.31641 413.55311 7065.0000 -96.96367 -94.45724 2.50644 1.77800 -94.60249 397.58348 7070.0000 -96.32390 -94.18597 2.13793 1.78747 -94.49358 402.56316 7075.0000 -96.75900 -94.62456 2.13444 1.80932 -94.24223 418.92068 7080.0000 -96.46996 -94.07213 2.39784 1.81699 -94.15405 428.77681 7085.0000 -95.83014 -93.42421 2.40593 1.84931 -93.78232 468.49704 7090.0000 -95.86549 -93.84782 2.01767 1.85854 -93.67622 453.11495 7095.0000 -95.97086 -93.69822 2.27264 1.85087 -93.76443 437.30552 7100.0000 -95.32609 -92.96817 2.35792 1.86926 -93.55291 468.13907 7105.0000 -95.39675 -93.20143 2.19532 1.89078 -93.30546 478.66748 7110.0000 -95.36015 -93.41999 1.94016 1.90233 -93.17258 460.68811 7115.0000 -95.61396 -93.05053 2.56343 1.91104 -93.07242 483.36399 7120.0000 -96.10926 -93.53378 2.57548 1.89507 -93.25607 464.89572 7125.0000 -96.17522 -94.17962 1.99560 1.80574 -94.28345 388.17187 7130.0000 -95.75370 -94.03784 1.71586 1.82894 -94.01663 412.00127 7135.0000 -95.74793 -93.93041 1.81752 1.82358 -94.07822 396.69266 7140.0000 -96.22925 -94.08126 2.14800 1.84164 -93.87056 407.90862 7145.0000 -95.93901 -94.08608 1.85292 1.83818 -93.91029 424.46334 7150.0000 -95.50325 -93.38488 2.11837 1.85652 -93.69940 444.46533 7155.0000 -96.04653 -93.67655 2.36998 1.86127 -93.64482 458.63252 7160.0000 -96.03648 -93.46146 2.57502 1.89631 -93.24182 478.11242 7165.0000 -95.67364 -92.94301 2.73062 1.87450 -93.49269 446.49301 7170.0000 -95.33805 -92.98333 2.35472 1.90988 -93.08578 474.56448 7175.0000 -95.71118 -92.95807 2.75311 1.91518 -93.02483 466.35140 7180.0000 -96.06811 -93.33004 2.73807 1.90131 -93.18429 460.93460 7185.0000 -96.24447 -93.73983 2.50464 1.87282 -93.51203 441.52622 7190.0000 -95.48227 -93.93418 1.54809 1.84434 -93.83946 402.03161 7195.0000 -96.34015 -93.83086 2.50929 1.83057 -93.99783 403.41573 7200.0000 -96.18400 -94.08584 2.09816 1.80753 -94.26280 413.82542 7205.0000 -96.15243 -93.91225 2.24019 1.79764 -94.37661 398.17818 7210.0000 -96.21055 -94.02332 2.18723 1.85621 -93.70302 470.92648 7215.0000 -97.08119 -94.48744 2.59375 1.79256 -94.43497 408.03757 7220.0000 -96.11346 -94.18982 1.92364 1.80359 -94.30813 405.66168 7225.0000 -96.52727 -94.11097 2.41630 1.81769 -94.14603 420.97362 7230.0000 -96.06478 -93.47323 2.59155 1.84049 -93.88383 449.16523 7235.0000 -96.45429 -94.65972 1.79457 1.82229 -94.09308 432.46310 7240.0000 -96.93093 -94.87518 2.05575 1.77432 -94.64478 390.31208 7245.0000 -96.57518 -94.84961 1.72558 1.77443 -94.64353 385.62648 7250.0000 -96.66216 -95.11930 1.54287 1.76330 -94.77148 376.04370 FREEZING PROCESS: loop number 30 T-loop= 405.00000000000000 main_MD> interactions number 30 at Temperature= 405.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -2.50900 -1.56946 2.19659 force_rgl> df(natom) -1.03276 0.62060 -0.96847 7255.0000 -96.27738 -94.35615 1.92123 1.78237 -94.55213 400.31055 7260.0000 -96.69211 -95.13375 1.55836 1.78724 -94.49614 395.14699 7265.0000 -96.23212 -94.28980 1.94231 1.76790 -94.71855 384.30949 7270.0000 -96.07145 -93.87718 2.19428 1.83490 -93.94812 451.85169 7275.0000 -96.27432 -94.45170 1.82263 1.84233 -93.86258 455.54897 7280.0000 -96.38781 -94.28031 2.10750 1.82167 -94.10023 434.30984 7285.0000 -96.63779 -94.03497 2.60281 1.79838 -94.36801 405.49314 7290.0000 -96.32927 -94.34391 1.98536 1.80913 -94.24445 405.27301 7295.0000 -96.29250 -94.27219 2.02031 1.79610 -94.39434 397.84727 7300.0000 -96.00029 -94.19223 1.80806 1.82345 -94.07971 430.12655 7305.0000 -96.98954 -94.73218 2.25737 1.78813 -94.48590 402.40322 7310.0000 -96.82181 -94.63413 2.18768 1.77033 -94.69065 376.76830 7315.0000 -96.20086 -94.15698 2.04389 1.80291 -94.31595 415.21137 7320.0000 -96.33374 -94.52062 1.81312 1.81572 -94.16869 412.64460 7325.0000 -96.23770 -93.93928 2.29842 1.80841 -94.25266 410.12146 7330.0000 -95.76785 -94.02559 1.74226 1.81158 -94.21622 421.76452 7335.0000 -96.53021 -94.20489 2.32531 1.83428 -93.95514 444.84329 7340.0000 -96.46300 -94.53202 1.93098 1.78560 -94.51508 411.71046 7345.0000 -96.45661 -94.36083 2.09578 1.78494 -94.52267 408.93890 7350.0000 -96.95114 -94.96511 1.98603 1.76713 -94.72741 387.20252 7355.0000 -96.85407 -95.16138 1.69270 1.73482 -95.09902 359.05248 7360.0000 -96.72237 -95.02635 1.69603 1.72775 -95.18037 341.70136 7365.0000 -96.60305 -94.39415 2.20890 1.77059 -94.68761 358.42031 7370.0000 -95.84425 -93.27156 2.57269 1.83727 -93.92087 407.50871 7375.0000 -95.59589 -92.90476 2.69114 1.89814 -93.22085 462.65633 7380.0000 -95.37579 -93.38104 1.99475 1.92012 -92.96806 488.21618 7385.0000 -95.64750 -93.15807 2.48943 1.87605 -93.47480 463.48924 7390.0000 -96.15055 -93.50960 2.64096 1.87143 -93.52800 493.97350 7395.0000 -96.39960 -94.51770 1.88190 1.82916 -94.01407 444.72006 7400.0000 -96.55552 -95.09964 1.45588 1.75682 -94.84602 361.09454 7405.0000 -96.88107 -94.60267 2.27840 1.75665 -94.84800 365.05445 7410.0000 -96.71676 -94.89806 1.81870 1.75783 -94.83439 371.24730 7415.0000 -96.95608 -94.81809 2.13798 1.77369 -94.65202 385.74289 7420.0000 -95.90956 -94.03693 1.87263 1.81124 -94.22020 415.80904 7425.0000 -96.26939 -93.87476 2.39463 1.83989 -93.89074 444.88433 7430.0000 -96.59606 -94.53040 2.06566 1.77769 -94.60601 398.87324 7435.0000 -96.70008 -94.62038 2.07970 1.78834 -94.48357 417.69726 7440.0000 -96.80093 -95.09945 1.70148 1.73957 -95.04441 350.86675 7445.0000 -96.22223 -94.58128 1.64095 1.76480 -94.75424 375.73395 7450.0000 -96.64094 -94.32038 2.32057 1.77248 -94.66591 376.92923 7455.0000 -96.24685 -94.34501 1.90184 1.80607 -94.27961 417.52683 7460.0000 -96.05605 -94.13244 1.92361 1.80887 -94.24746 425.04459 7465.0000 -96.39961 -93.94393 2.45568 1.81892 -94.13186 417.14416 7470.0000 -96.05698 -94.39304 1.66395 1.81912 -94.12953 423.30834 7475.0000 -95.97210 -93.91622 2.05588 1.82328 -94.08168 415.05005 7480.0000 -96.07815 -93.80569 2.27246 1.86279 -93.62728 473.65840 7485.0000 -96.09678 -93.85884 2.23794 1.81915 -94.12920 427.82386 7490.0000 -96.57905 -94.68659 1.89246 1.81161 -94.21594 416.46483 7495.0000 -96.72760 -94.63085 2.09675 1.76551 -94.74607 379.85462 7500.0000 -96.26759 -94.18435 2.08323 1.78520 -94.51958 386.24224 FREEZING PROCESS: loop number 31 T-loop= 380.00000000000000 main_MD> interactions number 31 at Temperature= 380.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 0.45967 -0.00973 2.71201 force_rgl> df(natom) -1.83389 1.34072 -0.36259 7505.0000 -95.72916 -93.59768 2.13148 1.84176 -93.86913 440.62871 7510.0000 -95.63796 -93.61593 2.02203 1.86534 -93.59799 477.87592 7515.0000 -96.48721 -94.64101 1.84619 1.83634 -93.93151 419.56127 7520.0000 -96.49183 -94.60389 1.88794 1.78687 -94.50043 372.55903 7525.0000 -96.18991 -94.25860 1.93132 1.78369 -94.53699 366.05808 7530.0000 -95.85338 -94.12987 1.72351 1.84640 -93.81576 432.82346 7535.0000 -96.28999 -93.93725 2.35274 1.82574 -94.05341 418.26256 7540.0000 -96.51723 -94.37406 2.14316 1.82178 -94.09898 411.24343 7545.0000 -96.31809 -94.61945 1.69864 1.77956 -94.58454 367.28815 7550.0000 -96.25208 -94.32181 1.93027 1.78943 -94.47101 375.30384 7555.0000 -96.35497 -94.76009 1.59488 1.79543 -94.40193 376.69706 7560.0000 -96.65363 -94.38129 2.27234 1.78676 -94.50164 371.19812 7565.0000 -96.59363 -94.50166 2.09197 1.77912 -94.58961 364.43020 7570.0000 -96.43924 -94.56805 1.87119 1.77794 -94.60309 356.65058 7575.0000 -96.47483 -94.47205 2.00278 1.80076 -94.34066 376.52084 7580.0000 -95.80413 -94.22142 1.58271 1.81075 -94.22586 407.35447 7585.0000 -96.22949 -94.36871 1.86078 1.81044 -94.22932 404.09561 7590.0000 -96.26520 -94.52554 1.73966 1.79068 -94.45659 361.47745 7595.0000 -96.12136 -93.96281 2.15855 1.80195 -94.32697 376.94366 7600.0000 -95.81692 -93.72729 2.08963 1.83718 -93.92184 404.36588 7605.0000 -96.26140 -94.04838 2.21302 1.84181 -93.86864 415.31234 7610.0000 -96.35615 -94.23755 2.11860 1.80919 -94.24380 389.48301 7615.0000 -96.44875 -94.34776 2.10099 1.79388 -94.41985 384.53897 7620.0000 -96.45862 -94.39672 2.06190 1.77617 -94.62347 376.37220 7625.0000 -96.56278 -94.63488 1.92789 1.79628 -94.39219 386.77695 7630.0000 -96.71712 -94.97975 1.73737 1.75646 -94.85013 358.70844 7635.0000 -96.51658 -95.23655 1.28003 1.75041 -94.91969 362.65897 7640.0000 -97.01292 -95.05133 1.96159 1.72260 -95.23954 331.75180 7645.0000 -96.34611 -94.29228 2.05384 1.78023 -94.57676 392.08415 7650.0000 -96.87174 -94.84134 2.03041 1.76179 -94.78886 371.03260 7655.0000 -96.82279 -95.03793 1.78485 1.76106 -94.79730 372.36639 7660.0000 -96.81936 -95.07283 1.74653 1.73774 -95.06550 341.80573 7665.0000 -97.14272 -95.39049 1.75223 1.73130 -95.13956 340.38376 7670.0000 -96.44115 -94.54124 1.89990 1.74894 -94.93661 357.76347 7675.0000 -96.60553 -94.77488 1.83065 1.77230 -94.66801 393.42851 7680.0000 -96.83521 -95.06781 1.76739 1.75350 -94.88420 361.14097 7685.0000 -96.45249 -94.44052 2.01197 1.76207 -94.78563 378.46558 7690.0000 -96.66561 -94.78653 1.87908 1.76583 -94.74243 374.68419 7695.0000 -96.81209 -95.20282 1.60927 1.74818 -94.94536 348.16803 7700.0000 -96.04717 -94.32846 1.71871 1.76221 -94.78402 363.52998 7705.0000 -97.01727 -95.14831 1.86895 1.77850 -94.59665 392.32804 7710.0000 -96.43887 -94.72523 1.71364 1.74770 -94.95093 352.52810 7715.0000 -96.31304 -94.75979 1.55325 1.78171 -94.55974 374.40296 7720.0000 -96.77568 -94.76333 2.01236 1.77176 -94.67417 370.15466 7725.0000 -96.36161 -94.39355 1.96806 1.79703 -94.38364 408.83942 7730.0000 -96.85706 -94.69056 2.16649 1.77199 -94.67155 386.50651 7735.0000 -96.74062 -94.56312 2.17750 1.79546 -94.40164 408.27142 7740.0000 -96.01252 -93.88498 2.12755 1.80093 -94.33870 407.17677 7745.0000 -96.07732 -93.91008 2.16724 1.83017 -94.00245 449.10069 7750.0000 -96.36574 -94.61275 1.75299 1.80605 -94.27988 414.26643 FREEZING PROCESS: loop number 32 T-loop= 355.00000000000000 main_MD> interactions number 32 at Temperature= 355.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -1.98277 0.74553 0.62519 force_rgl> df(natom) 0.01246 -4.15258 1.02962 7755.0000 -96.57545 -94.87029 1.70516 1.75997 -94.80983 372.00224 7760.0000 -96.60877 -94.66652 1.94225 1.75188 -94.90286 356.12584 7765.0000 -96.27486 -94.38337 1.89148 1.78060 -94.57249 381.63025 7770.0000 -96.72974 -94.96576 1.76398 1.75917 -94.81897 363.04239 7775.0000 -96.94622 -94.78358 2.16264 1.74868 -94.93958 365.09230 7780.0000 -96.91502 -95.25688 1.65814 1.73177 -95.13413 336.45241 7785.0000 -96.67914 -94.32327 2.35587 1.77622 -94.62294 383.99147 7790.0000 -96.87144 -95.36074 1.51071 1.75692 -94.84492 365.60466 7795.0000 -96.52718 -94.58368 1.94350 1.75568 -94.85917 367.12552 7800.0000 -96.73439 -94.65222 2.08217 1.76721 -94.72653 375.59800 7805.0000 -96.32018 -94.83953 1.48065 1.77311 -94.65865 376.58670 7810.0000 -96.96620 -95.38060 1.58560 1.71645 -95.31034 326.97508 7815.0000 -97.04306 -95.24354 1.79952 1.70933 -95.39220 309.37693 7820.0000 -96.77224 -94.97543 1.79681 1.72610 -95.19931 336.38542 7825.0000 -96.91717 -94.70508 2.21209 1.75909 -94.81991 366.84085 7830.0000 -96.83604 -95.01806 1.81798 1.74623 -94.96786 349.66442 7835.0000 -96.62147 -94.60465 2.01682 1.76124 -94.79524 372.87089 7840.0000 -96.56601 -94.75750 1.80852 1.77853 -94.59635 383.29143 7845.0000 -97.05213 -95.48549 1.56664 1.75889 -94.82224 365.59795 7850.0000 -97.07294 -95.43480 1.63813 1.71971 -95.27279 333.81409 7855.0000 -97.13121 -95.18630 1.94491 1.71994 -95.27019 340.97175 7860.0000 -97.14086 -95.51627 1.62459 1.71350 -95.34426 323.88208 7865.0000 -97.15560 -95.24147 1.91413 1.71112 -95.37159 322.23649 7870.0000 -96.99051 -95.67561 1.31490 1.70051 -95.49359 321.03293 7875.0000 -97.10416 -95.26081 1.84335 1.72214 -95.24488 340.68559 7880.0000 -96.25395 -94.46209 1.79186 1.73811 -95.06121 344.29419 7885.0000 -96.75551 -94.97112 1.78440 1.76400 -94.76343 381.81721 7890.0000 -96.85145 -94.99526 1.85618 1.74148 -95.02241 352.27377 7895.0000 -96.97699 -95.27223 1.70476 1.72851 -95.17165 349.86958 7900.0000 -96.35558 -94.31532 2.04025 1.77553 -94.63086 393.06423 7905.0000 -96.51293 -94.74273 1.77020 1.75221 -94.89904 359.25221 7910.0000 -96.59048 -94.50676 2.08372 1.77606 -94.62476 402.15344 7915.0000 -96.48045 -94.52483 1.95562 1.79818 -94.37039 414.72303 7920.0000 -96.88298 -94.96882 1.91416 1.74135 -95.02398 353.30688 7925.0000 -97.20934 -95.66316 1.54619 1.71413 -95.33696 327.83787 7930.0000 -97.18450 -95.71525 1.46925 1.70502 -95.44168 309.41564 7935.0000 -97.11829 -95.31102 1.80727 1.70641 -95.42571 316.69896 7940.0000 -96.88187 -95.16845 1.71342 1.72294 -95.23562 333.12061 7945.0000 -97.07312 -95.21512 1.85800 1.71930 -95.27749 341.89121 7950.0000 -97.04774 -94.92993 2.11781 1.73856 -95.05597 363.05020 7955.0000 -96.28957 -94.39496 1.89461 1.76369 -94.76699 380.75392 7960.0000 -97.21796 -94.66861 2.54935 1.76332 -94.77129 379.47470 7965.0000 -97.04473 -94.90665 2.13808 1.76726 -94.72590 380.23469 7970.0000 -96.83353 -95.05092 1.78261 1.73025 -95.15163 346.82261 7975.0000 -96.85031 -95.29800 1.55231 1.72330 -95.23146 343.24758 7980.0000 -97.33268 -95.84561 1.48708 1.69388 -95.56988 302.26990 7985.0000 -97.02173 -95.55759 1.46414 1.68950 -95.62027 309.38334 7990.0000 -97.00353 -95.04646 1.95706 1.74448 -94.98795 362.73015 7995.0000 -97.08536 -95.16851 1.91685 1.74453 -94.98737 353.73923 8000.0000 -96.97250 -95.05009 1.92241 1.73044 -95.14943 345.59935 FREEZING PROCESS: loop number 33 T-loop= 330.00000000000000 main_MD> interactions number 33 at Temperature= 330.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) 0.31704 1.11338 -0.96345 force_rgl> df(natom) 0.41802 -2.22559 -0.82065 8005.0000 -97.04096 -95.74441 1.29655 1.71787 -95.29400 321.85165 8010.0000 -97.09515 -95.55776 1.53739 1.69145 -95.59779 305.43111 8015.0000 -96.73123 -94.98093 1.75030 1.71055 -95.37811 327.70130 8020.0000 -96.96000 -95.40116 1.55884 1.73773 -95.06551 356.76856 8025.0000 -96.86100 -95.29046 1.57054 1.69074 -95.60601 310.54250 8030.0000 -97.24168 -95.62736 1.61432 1.70956 -95.38948 332.58510 8035.0000 -97.24272 -95.62838 1.61434 1.71223 -95.35879 328.28785 8040.0000 -96.95988 -95.34225 1.61763 1.71056 -95.37805 329.62132 8045.0000 -97.20336 -95.39169 1.81167 1.72056 -95.26303 333.88918 8050.0000 -96.94741 -95.23187 1.71554 1.71612 -95.31404 327.73956 8055.0000 -97.11736 -95.07444 2.04292 1.74891 -94.93700 373.36714 8060.0000 -96.82075 -95.15789 1.66286 1.72014 -95.26790 337.89170 8065.0000 -96.94749 -95.15430 1.79319 1.73855 -95.05613 361.41169 8070.0000 -96.56982 -94.59710 1.97272 1.74242 -95.01157 365.88301 8075.0000 -97.15177 -95.37721 1.77456 1.74627 -94.96740 363.74915 8080.0000 -96.92598 -95.19956 1.72643 1.71228 -95.35827 321.26795 8085.0000 -97.18681 -95.49080 1.69600 1.71955 -95.27463 335.30802 8090.0000 -97.25307 -95.67867 1.57441 1.69349 -95.57432 313.19429 8095.0000 -97.08133 -95.40412 1.67721 1.68157 -95.71141 304.78765 8100.0000 -97.21824 -95.60688 1.61135 1.69932 -95.50724 317.91670 8105.0000 -97.31442 -95.55650 1.75792 1.70269 -95.46854 321.41898 8110.0000 -97.32242 -95.89298 1.42945 1.67928 -95.73772 295.24327 8115.0000 -97.18939 -95.54400 1.64540 1.68191 -95.70747 297.81771 8120.0000 -96.75835 -94.56538 2.19297 1.71856 -95.28598 347.44596 8125.0000 -96.75847 -94.66701 2.09146 1.76683 -94.73086 385.05166 8130.0000 -97.04360 -95.40137 1.64223 1.74337 -95.00067 354.74805 8135.0000 -97.04478 -95.37741 1.66738 1.71460 -95.33158 330.39679 8140.0000 -97.12934 -95.29550 1.83384 1.73830 -95.05898 351.50043 8145.0000 -97.22379 -95.46060 1.76320 1.69639 -95.54099 316.60593 8150.0000 -97.25597 -95.63355 1.62242 1.70892 -95.39688 331.59524 8155.0000 -96.86932 -95.47884 1.39049 1.69364 -95.57263 316.04533 8160.0000 -97.22265 -95.42402 1.79862 1.70145 -95.48284 320.73816 8165.0000 -96.80243 -95.41541 1.38702 1.69873 -95.51409 309.13705 8170.0000 -96.84820 -95.31171 1.53649 1.71037 -95.38018 310.87861 8175.0000 -96.91132 -95.09697 1.81435 1.71424 -95.33566 319.68535 8180.0000 -96.85342 -95.21104 1.64238 1.74054 -95.03327 349.86620 8185.0000 -97.00647 -95.19071 1.81575 1.69919 -95.50878 303.39210 8190.0000 -96.87368 -95.17487 1.69881 1.72824 -95.17468 347.69712 8195.0000 -97.13003 -95.17966 1.95037 1.73285 -95.12172 349.08137 8200.0000 -97.42089 -95.89448 1.52641 1.71990 -95.27057 332.79738 8205.0000 -96.99148 -95.37002 1.62146 1.68817 -95.63549 307.90394 8210.0000 -97.28224 -95.75849 1.52374 1.68848 -95.63200 304.18097 8215.0000 -97.14685 -95.75972 1.38713 1.69518 -95.55485 299.11244 8220.0000 -96.85161 -95.09545 1.75615 1.70583 -95.43247 325.62409 8225.0000 -97.46942 -95.54256 1.92686 1.71018 -95.38244 324.31775 8230.0000 -96.80872 -95.17917 1.62956 1.71799 -95.29258 332.02354 8235.0000 -97.29813 -95.75776 1.54037 1.69779 -95.52487 312.41754 8240.0000 -97.36757 -95.53734 1.83023 1.70338 -95.46061 326.71959 8245.0000 -96.71442 -94.89150 1.82292 1.69389 -95.56973 309.22918 8250.0000 -96.89849 -95.10720 1.79129 1.74139 -95.02341 369.07300 FREEZING PROCESS: loop number 34 T-loop= 305.00000000000000 main_MD> interactions number 34 at Temperature= 305.00000000000000 force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205 force_rgl> df(1) -1.74838 1.56765 0.82858 force_rgl> df(natom) -0.07733 2.79829 -1.94354 8255.0000 -97.13700 -95.17759 1.95941 1.73445 -95.10323 355.08206 8260.0000 -97.16182 -95.49179 1.67004 1.71514 -95.32533 326.73684 8265.0000 -97.17987 -95.71743 1.46244 1.68768 -95.64114 306.68845 8270.0000 -97.45338 -95.98318 1.47020 1.68079 -95.72033 297.93663 8275.0000 -97.45546 -95.85307 1.60239 1.65827 -95.97936 273.25373 8280.0000 -96.93290 -95.57215 1.36075 1.67635 -95.77146 279.31139 8285.0000 -97.27417 -95.57309 1.70107 1.70927 -95.39286 320.81435 8290.0000 -97.34352 -96.02486 1.31867 1.67229 -95.81817 289.34929 8295.0000 -97.14442 -95.13839 2.00603 1.68645 -95.65524 299.88660 8300.0000 -97.34632 -95.80161 1.54471 1.70602 -95.43023 314.77714 8305.0000 -97.00334 -95.24045 1.76288 1.71059 -95.37768 320.62659 8310.0000 -97.19270 -95.81715 1.37555 1.68901 -95.62585 306.52132 8315.0000 -97.04835 -95.57984 1.46851 1.69164 -95.59566 308.93073 8320.0000 -97.42261 -95.75209 1.67052 1.68978 -95.61704 309.70237 8325.0000 -97.02477 -95.41753 1.60724 1.70561 -95.43500 328.12493 8330.0000 -97.16469 -95.47435 1.69034 1.69279 -95.58235 312.36622 8335.0000 -96.87441 -95.02756 1.84685 1.71355 -95.34368 338.98890 8340.0000 -97.55520 -96.19505 1.36015 1.68986 -95.61607 308.59715 8345.0000 -96.92433 -95.81780 1.10653 1.67444 -95.79336 287.20712 8350.0000 -97.24605 -95.95633 1.28972 1.66774 -95.87044 278.57163 8355.0000 -97.43600 -96.02017 1.41582 1.66435 -95.90950 282.66669 8360.0000 -97.46418 -96.10037 1.36381 1.66663 -95.88320 284.59123 8365.0000 -97.16264 -95.69420 1.46844 1.66632 -95.88683 281.66978 8370.0000 -97.26816 -96.05246 1.21570 1.67975 -95.73232 296.48177 8375.0000 -97.37577 -96.04731 1.32846 1.67844 -95.74747 294.10451 8380.0000 -97.38776 -96.11950 1.26826 1.64624 -96.11769 260.57491 8385.0000 -97.11043 -95.97129 1.13915 1.65185 -96.05315 265.72466 8390.0000 -96.97934 -95.76260 1.21674 1.68229 -95.70311 291.65434 8395.0000 -97.48292 -95.80993 1.67299 1.68176 -95.70928 299.91980 8400.0000 -96.96052 -95.12717 1.83335 1.70570 -95.43389 319.16978 8405.0000 -96.91475 -95.65529 1.25946 1.68132 -95.71424 299.02971 8410.0000 -97.31270 -95.18088 2.13182 1.71193 -95.36224 336.62135 8415.0000 -97.10337 -95.48671 1.61666 1.73047 -95.14903 346.90701 8420.0000 -97.03091 -95.56081 1.47010 1.71176 -95.36424 330.90894 8425.0000 -97.30059 -95.73373 1.56686 1.68793 -95.63827 310.65378 8430.0000 -97.35479 -95.84991 1.50488 1.67876 -95.74378 295.28891 8435.0000 -96.83259 -95.51800 1.31459 1.67161 -95.82600 287.94430 8440.0000 -97.00810 -95.43843 1.56967 1.70991 -95.38548 329.24767 8445.0000 -97.09463 -95.69084 1.40378 1.69466 -95.56092 298.58933 8450.0000 -97.56824 -95.89432 1.67392 1.67819 -95.75025 297.01644 8455.0000 -97.22631 -95.55571 1.67060 1.67488 -95.78840 288.21778 8460.0000 -97.06986 -95.90920 1.16066 1.66667 -95.88272 281.27418 8465.0000 -97.47286 -96.10618 1.36668 1.65989 -95.96071 276.83101 8470.0000 -96.77183 -95.46681 1.30502 1.66340 -95.92036 277.71996 8475.0000 -97.38707 -95.88836 1.49871 1.68810 -95.63636 307.41575 8480.0000 -97.15190 -95.62939 1.52251 1.69597 -95.54582 310.18401 8485.0000 -97.22013 -95.53574 1.68440 1.68762 -95.64184 295.78897 8490.0000 -96.82726 -95.30345 1.52380 1.71369 -95.34198 326.41978 8495.0000 -97.24367 -95.58848 1.65519 1.69394 -95.56915 313.71598 8500.0000 -97.16054 -95.37361 1.78693 1.70301 -95.46486 324.52478 main_MD> EXECUTION TIME: 0 [day], 0 [hour], 7 [min], 14.2942007 [s]. main_MD> Deallocating global variables