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nanoparticlesims/growth_Melting_Silver_ICO_3269/freezeSims/run_17/freeze.log

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main_MD> Reading input file
read_input> Process type: freezing
Read_input> Process caloric with a T-change of 25.000000000000000 [K] and a rate of 9.9999999999999992E+022 [K/ns]
read_input> Input for metadynamics has been read
read_input> Metadynamics has not been chosen.
read_input> Reading initial positions fromtoFreeze_17.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 = 17 ntipo2 = 0
read_input> Finish reading input
main_MD> Allocating global variables
main_MD> Number of outputs that will be created: 1950
main_MD> Size of nv and nvoiz: 17 1700
main_MD> Size of nv and nvoiz: 17 1700
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 = 17
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> -0.11190825939676999 5.4146209933622159E-002 -2.7752229952503756E-002 initial drift of cluster / NP1 for coalescence
init> 0.39332678006356536 0.34524832922138982 0.24627268433737615 scaling for velocity /for coalescence NP1
init.f90 > facguy = 3.8576758693137968E-003
preparo> IN BIGVOI : LIMIT 1.2247448652052084 1.2247448652052084 1.2247448652052084
preparo> END t=0 TIME STEP
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.63612 0.41298 -0.21384
force_rgl> df(natom) -0.68932 7.18842 -0.39251
preparo> THERMALIZATION PROCESS AT 1292.2369401492297
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -34.095417119871577 2.9897786367640533 -37.085195756635628 5.7264781469226387E-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 39
FREEZING PROCESS: loop number 1 T-loop= 1266.0000000000000
main_MD> interactions number 1 at Temperature= 1266.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.59110 2.64184 0.36571
force_rgl> df(natom) 1.79244 2.06908 1.39258
5.0000 -36.24450 -33.67342 2.57108 2.51797 -33.50246 1243.17754
10.0000 -35.57074 -33.26192 2.30883 2.55195 -33.27781 1432.71120
15.0000 -37.20087 -34.56346 2.63741 2.43887 -34.02545 1258.83965
20.0000 -35.95265 -33.25416 2.69849 2.45558 -33.91495 1276.20396
25.0000 -36.51774 -33.68731 2.83043 2.60072 -32.95539 1375.75179
30.0000 -35.99576 -33.13483 2.86093 2.40122 -34.27434 1102.20055
35.0000 -37.74978 -35.30869 2.44110 2.51388 -33.52948 1310.35954
40.0000 -35.88437 -32.94768 2.93669 2.52234 -33.47359 1271.01509
45.0000 -34.81771 -31.57891 3.23880 2.62598 -32.78836 1471.77907
50.0000 -36.04564 -33.16307 2.88257 2.70540 -32.26327 1458.53724
55.0000 -36.68317 -33.78591 2.89725 2.56568 -33.18701 1408.66851
60.0000 -35.51204 -32.85970 2.65234 2.58674 -33.04780 1448.83319
65.0000 -37.08843 -33.02029 4.06814 2.59351 -33.00307 1375.89869
70.0000 -37.10377 -34.38093 2.72284 2.48005 -33.75320 1321.95252
75.0000 -37.01325 -34.33995 2.67330 2.32958 -34.74799 1136.06838
80.0000 -36.84662 -33.94825 2.89837 2.41653 -34.17312 1270.14163
85.0000 -36.84559 -34.35998 2.48562 2.50896 -33.56204 1334.36901
90.0000 -36.88644 -33.69556 3.19088 2.39405 -34.32178 1144.26884
95.0000 -36.22122 -33.36427 2.85695 2.49670 -33.64312 1300.01807
100.0000 -35.37990 -31.56085 3.81905 2.73996 -32.03481 1603.21693
105.0000 -36.04392 -32.00230 4.04162 2.74296 -32.01493 1600.06068
110.0000 -37.12573 -34.04824 3.07749 2.56200 -33.21138 1342.27570
115.0000 -36.74992 -32.90039 3.84953 2.51151 -33.54516 1311.49280
120.0000 -36.18319 -33.15232 3.03087 2.58194 -33.07953 1484.84977
125.0000 -37.37953 -34.66792 2.71161 2.47514 -33.78564 1434.64687
130.0000 -37.47360 -34.87305 2.60054 2.31396 -34.85131 1096.34809
135.0000 -36.81745 -34.10672 2.71073 2.44135 -34.00902 1161.01325
140.0000 -36.07424 -33.30376 2.77048 2.58526 -33.05757 1316.75185
145.0000 -36.77502 -34.29854 2.47648 2.43428 -34.05581 1321.79607
150.0000 -37.35784 -34.39507 2.96277 2.36559 -34.50995 1142.62639
155.0000 -36.66230 -34.78876 1.87355 2.48917 -33.69291 1316.82377
160.0000 -36.86055 -34.11253 2.74802 2.35837 -34.55768 1226.61018
165.0000 -35.55563 -33.07203 2.48359 2.54154 -33.34663 1326.94149
170.0000 -37.02288 -34.13997 2.88291 2.47632 -33.77784 1321.83187
175.0000 -35.94478 -33.58528 2.35951 2.47534 -33.78432 1342.02116
180.0000 -36.43905 -32.97341 3.46564 2.54753 -33.30703 1304.03587
185.0000 -36.83903 -33.88947 2.94955 2.44356 -33.99443 1226.48245
190.0000 -37.62976 -34.59192 3.03784 2.42078 -34.14507 1163.99099
195.0000 -37.04248 -34.17694 2.86555 2.38093 -34.40849 1223.50363
200.0000 -36.75944 -34.20210 2.55734 2.36860 -34.49001 1225.07237
205.0000 -37.25360 -34.98849 2.26511 2.39344 -34.32580 1254.72466
210.0000 -35.93353 -31.86504 4.06850 2.47616 -33.77887 1291.75632
215.0000 -35.84227 -32.62246 3.21982 2.73950 -32.03784 1646.97487
220.0000 -34.91706 -31.82212 3.09494 2.75471 -31.93725 1577.49266
225.0000 -36.52761 -31.86391 4.66369 2.69434 -32.33643 1509.49342
230.0000 -35.52616 -30.69943 4.82673 2.84002 -31.37326 1745.60735
235.0000 -35.82861 -32.03241 3.79620 2.79917 -31.64329 1709.99484
240.0000 -36.45212 -32.54051 3.91160 2.69347 -32.34218 1469.13672
245.0000 -35.82236 -33.08725 2.73511 2.53624 -33.38170 1384.30798
250.0000 -36.93453 -34.80114 2.13339 2.39958 -34.28523 1156.36231
FREEZING PROCESS: loop number 2 T-loop= 1241.0000000000000
main_MD> interactions number 2 at Temperature= 1241.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.53192 5.85123 -3.81383
force_rgl> df(natom) 0.24591 -3.79824 -2.58366
255.0000 -37.14676 -34.67885 2.46791 2.41733 -34.16786 1233.54915
260.0000 -37.48017 -34.89961 2.58055 2.41253 -34.19959 1261.35621
265.0000 -36.25860 -34.46654 1.79207 2.33475 -34.71381 1125.55068
270.0000 -36.71455 -32.67574 4.03881 2.49289 -33.66829 1344.03476
275.0000 -35.47534 -31.78329 3.69204 2.71194 -32.22007 1475.83592
280.0000 -36.17453 -32.89020 3.28433 2.67775 -32.44612 1599.59716
285.0000 -36.11771 -32.56863 3.54908 2.65918 -32.56885 1548.04087
290.0000 -35.04595 -32.53410 2.51185 2.62853 -32.77148 1432.38735
295.0000 -37.88990 -34.79220 3.09770 2.47188 -33.80722 1279.04604
300.0000 -36.95659 -34.44914 2.50746 2.35372 -34.58842 1237.78894
305.0000 -36.31707 -33.28200 3.03507 2.42265 -34.13268 1238.98773
310.0000 -37.46300 -33.72109 3.74190 2.55132 -33.28196 1340.67767
315.0000 -37.39977 -33.48312 3.91665 2.53415 -33.39550 1430.71441
320.0000 -37.40691 -34.78623 2.62068 2.40754 -34.23259 1187.91396
325.0000 -37.19784 -34.00293 3.19492 2.41384 -34.19090 1209.27329
330.0000 -37.57706 -34.54928 3.02778 2.33217 -34.73086 1120.76458
335.0000 -37.57805 -34.51913 3.05892 2.40362 -34.25852 1133.75434
340.0000 -36.42674 -34.07117 2.35557 2.40510 -34.24873 1182.30274
345.0000 -37.42316 -35.53520 1.88796 2.36054 -34.54329 1125.48457
350.0000 -37.21443 -35.27650 1.93793 2.27303 -35.12189 1047.73399
355.0000 -36.54514 -33.86025 2.68488 2.42395 -34.12410 1248.56394
360.0000 -36.43275 -34.00215 2.43061 2.57529 -33.12349 1374.95045
365.0000 -36.24784 -32.97040 3.27745 2.47527 -33.78478 1205.53617
370.0000 -36.73981 -32.99726 3.74255 2.58966 -33.02849 1437.07502
375.0000 -36.43739 -32.93621 3.50118 2.51969 -33.49111 1272.64315
380.0000 -36.98663 -34.35532 2.63131 2.47434 -33.79094 1299.88205
385.0000 -36.61950 -34.40763 2.21187 2.32581 -34.77295 1120.09019
390.0000 -36.07722 -32.73142 3.34579 2.49554 -33.65079 1237.48286
395.0000 -36.62986 -33.66078 2.96908 2.53388 -33.39726 1391.96172
400.0000 -35.69276 -33.44042 2.25234 2.49330 -33.66560 1354.46117
405.0000 -36.80904 -34.18610 2.62294 2.46340 -33.86325 1217.84656
410.0000 -36.49985 -33.71849 2.78136 2.47280 -33.80112 1317.73831
415.0000 -37.50649 -34.06459 3.44190 2.43380 -34.05897 1292.29130
420.0000 -35.94884 -32.85078 3.09806 2.49389 -33.66168 1237.25569
425.0000 -36.33869 -33.08126 3.25743 2.61829 -32.83920 1380.39739
430.0000 -36.50578 -34.07211 2.43366 2.52434 -33.46039 1270.37067
435.0000 -36.38670 -32.92572 3.46098 2.54464 -33.32613 1300.36480
440.0000 -35.89000 -33.53037 2.35963 2.40861 -34.22552 1219.10808
445.0000 -36.85488 -33.96458 2.89030 2.53305 -33.40275 1295.73936
450.0000 -36.77614 -33.76686 3.00928 2.43305 -34.06390 1107.00455
455.0000 -37.02370 -35.09802 1.92568 2.41514 -34.18233 1276.70197
460.0000 -37.35339 -35.03129 2.32209 2.29374 -34.98494 1143.57625
465.0000 -36.36530 -33.89872 2.46658 2.34725 -34.63120 1218.95543
470.0000 -37.42894 -34.90172 2.52722 2.36718 -34.49943 1109.22089
475.0000 -35.55422 -33.78991 1.76431 2.42197 -34.13717 1236.67997
480.0000 -36.50489 -33.69499 2.80990 2.51377 -33.53023 1315.92985
485.0000 -36.73496 -33.72911 3.00584 2.52091 -33.48301 1333.09319
490.0000 -37.00412 -34.35716 2.64697 2.41900 -34.15681 1200.99418
495.0000 -38.07787 -35.28797 2.78991 2.36151 -34.53689 1103.40636
500.0000 -36.53618 -33.30765 3.22853 2.37310 -34.46028 1080.22084
FREEZING PROCESS: loop number 3 T-loop= 1216.0000000000000
main_MD> interactions number 3 at Temperature= 1216.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.15741 0.54401 -3.33813
force_rgl> df(natom) -2.62373 1.87138 3.93664
505.0000 -36.89054 -33.82950 3.06103 2.45463 -33.92124 1347.62698
510.0000 -36.23206 -33.52595 2.70611 2.55984 -33.22566 1406.28016
515.0000 -37.45430 -33.78200 3.67230 2.58309 -33.07191 1462.86541
520.0000 -36.70319 -33.33785 3.36534 2.54002 -33.35671 1310.54428
525.0000 -37.29937 -34.54723 2.75215 2.55412 -33.26346 1351.33653
530.0000 -38.06922 -35.56614 2.50308 2.26425 -35.17994 995.68883
535.0000 -36.49047 -33.89401 2.59647 2.29289 -34.99061 1003.58364
540.0000 -37.11474 -33.94714 3.16761 2.42776 -34.09891 1235.89395
545.0000 -37.69052 -34.89159 2.79893 2.33498 -34.71233 1092.72121
550.0000 -37.28998 -35.26342 2.02656 2.24113 -35.33282 1137.22527
555.0000 -36.81045 -34.60574 2.20471 2.30329 -34.92180 1083.22831
560.0000 -36.92105 -33.96258 2.95847 2.39813 -34.29478 1195.48303
565.0000 -36.48955 -34.14995 2.33961 2.43017 -34.08297 1312.89673
570.0000 -36.33629 -33.87941 2.45688 2.45517 -33.91770 1202.69519
575.0000 -36.79714 -34.54342 2.25373 2.44940 -33.95581 1177.25048
580.0000 -36.80073 -34.53580 2.26493 2.39158 -34.33807 1081.61305
585.0000 -36.89000 -33.66315 3.22685 2.38235 -34.39914 1195.49053
590.0000 -35.75293 -32.29574 3.45719 2.62457 -32.79768 1513.97194
595.0000 -36.02785 -33.12892 2.89893 2.67078 -32.49215 1464.63147
600.0000 -36.13121 -32.44455 3.68666 2.61483 -32.86210 1442.04013
605.0000 -37.20762 -34.90144 2.30619 2.43566 -34.04667 1214.86444
610.0000 -36.90214 -33.56222 3.33992 2.44195 -34.00507 1201.62920
615.0000 -35.60416 -33.09292 2.51125 2.49938 -33.62541 1289.55035
620.0000 -35.43467 -32.71940 2.71526 2.54094 -33.35060 1333.40541
625.0000 -36.22288 -34.05832 2.16456 2.60377 -32.93517 1360.82634
630.0000 -36.87547 -34.69603 2.17944 2.37416 -34.45324 1115.01658
635.0000 -36.69748 -33.67187 3.02561 2.45465 -33.92111 1130.99858
640.0000 -36.88533 -34.85824 2.02709 2.38023 -34.41317 1161.80851
645.0000 -37.32924 -34.54148 2.78776 2.34034 -34.67688 1136.14862
650.0000 -37.36492 -34.53645 2.82847 2.34217 -34.66479 1172.05379
655.0000 -36.43662 -33.61902 2.81760 2.39722 -34.30083 1167.83165
660.0000 -37.01219 -34.95235 2.05984 2.37600 -34.44112 1124.27116
665.0000 -36.94600 -34.26076 2.68524 2.33471 -34.71411 1116.12076
670.0000 -36.78138 -34.53758 2.24380 2.37340 -34.45827 1044.69410
675.0000 -37.15421 -34.72838 2.42582 2.34477 -34.64760 1133.53694
680.0000 -37.06281 -34.68670 2.37611 2.39368 -34.32420 1233.25180
685.0000 -36.99004 -33.00282 3.98723 2.50828 -33.56657 1301.42009
690.0000 -36.95776 -34.02205 2.93572 2.50354 -33.59789 1368.28279
695.0000 -36.42299 -33.93914 2.48385 2.45542 -33.91605 1126.83808
700.0000 -35.21929 -31.35678 3.86251 2.68231 -32.41591 1582.37766
705.0000 -35.84872 -31.76608 4.08265 2.84811 -31.31977 1779.25413
710.0000 -35.60871 -31.75609 3.85262 2.77221 -31.82154 1606.28927
715.0000 -36.09067 -33.37969 2.71098 2.72500 -32.13371 1531.01775
720.0000 -37.46884 -35.34246 2.12638 2.37368 -34.45641 1149.15200
725.0000 -36.58978 -34.76491 1.82487 2.28624 -35.03458 1110.62996
730.0000 -35.67691 -33.54242 2.13450 2.39072 -34.34376 1058.69664
735.0000 -36.06202 -33.57764 2.48437 2.48997 -33.68760 1256.28641
740.0000 -36.38458 -33.58676 2.79783 2.53670 -33.37860 1383.32999
745.0000 -36.29020 -33.01197 3.27823 2.58470 -33.06126 1398.36951
750.0000 -35.97602 -34.37209 1.60393 2.52634 -33.44716 1145.41442
FREEZING PROCESS: loop number 4 T-loop= 1191.0000000000000
main_MD> interactions number 4 at Temperature= 1191.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.42616 -3.37284 -1.81718
force_rgl> df(natom) 3.09469 3.39311 11.57434
755.0000 -38.37404 -35.45018 2.92386 2.36999 -34.48086 1155.57643
760.0000 -37.24884 -34.34185 2.90700 2.32882 -34.75302 1146.44023
765.0000 -36.96468 -34.57958 2.38510 2.32130 -34.80274 1078.32309
770.0000 -38.09326 -34.88054 3.21272 2.31886 -34.81886 1132.57187
775.0000 -35.92630 -34.26794 1.65836 2.34589 -34.64014 1188.46245
780.0000 -37.20535 -34.62523 2.58012 2.35769 -34.56217 1048.11987
785.0000 -37.72348 -35.27558 2.44790 2.34992 -34.61354 1181.47451
790.0000 -37.57959 -35.11666 2.46292 2.33145 -34.73564 1122.61372
795.0000 -37.40363 -35.18611 2.21751 2.27733 -35.09347 1129.32933
800.0000 -36.10266 -33.52183 2.58083 2.42485 -34.11815 1232.69149
805.0000 -36.69407 -33.96042 2.73365 2.50538 -33.58573 1344.47863
810.0000 -37.40843 -34.71339 2.69504 2.40101 -34.27577 1161.95818
815.0000 -37.27743 -34.58010 2.69733 2.29022 -35.00823 1102.26173
820.0000 -36.13518 -33.23828 2.89690 2.40371 -34.25793 1180.80554
825.0000 -36.56069 -34.33548 2.22520 2.36613 -34.50636 1067.51768
830.0000 -36.76325 -33.17641 3.58685 2.46040 -33.88310 1304.30298
835.0000 -36.01391 -32.99678 3.01712 2.56827 -33.16988 1519.65688
840.0000 -37.79211 -34.48170 3.31041 2.55474 -33.25937 1300.72552
845.0000 -38.22507 -35.49204 2.73303 2.26814 -35.15424 1059.72118
850.0000 -37.34329 -34.51639 2.82690 2.35292 -34.59372 1134.57933
855.0000 -36.20048 -34.25601 1.94447 2.34518 -34.64485 1114.01688
860.0000 -36.63740 -33.71251 2.92490 2.47384 -33.79425 1268.21361
865.0000 -36.06669 -34.14732 1.91937 2.46279 -33.86729 1245.35455
870.0000 -36.14520 -34.05123 2.09396 2.43000 -34.08407 1142.01350
875.0000 -35.77950 -32.50566 3.27384 2.50806 -33.56796 1336.73892
880.0000 -35.83490 -33.18000 2.65491 2.58159 -33.08185 1385.71684
885.0000 -36.51452 -33.42329 3.09123 2.59433 -32.99760 1402.08167
890.0000 -36.90497 -33.77107 3.13390 2.53671 -33.37856 1322.21709
895.0000 -36.45599 -33.82543 2.63057 2.51120 -33.54726 1361.93281
900.0000 -37.04912 -34.31906 2.73006 2.49135 -33.67849 1357.04431
905.0000 -35.51187 -31.90495 3.60692 2.55598 -33.25114 1421.09399
910.0000 -36.68770 -33.70158 2.98612 2.50748 -33.57184 1337.81788
915.0000 -37.35793 -34.89931 2.45863 2.46208 -33.87196 1268.53697
920.0000 -36.46632 -33.82883 2.63749 2.35473 -34.58176 1085.82704
925.0000 -36.28244 -33.78024 2.50220 2.47517 -33.78545 1253.67158
930.0000 -35.42821 -32.62387 2.80434 2.60185 -32.94791 1390.34460
935.0000 -36.49137 -34.20007 2.29130 2.48541 -33.71775 1395.43077
940.0000 -36.50531 -33.79773 2.70758 2.43478 -34.05251 1173.05518
945.0000 -37.65003 -35.33594 2.31410 2.36611 -34.50650 1163.57810
950.0000 -38.02664 -35.17302 2.85362 2.18184 -35.72478 1013.71879
955.0000 -36.76062 -33.85874 2.90187 2.44189 -34.00547 1348.81059
960.0000 -37.97990 -35.09571 2.88419 2.37115 -34.47314 1161.45455
965.0000 -35.73398 -33.93200 1.80198 2.46669 -33.84150 1204.78293
970.0000 -36.77502 -34.13550 2.63952 2.41698 -34.17018 1189.30421
975.0000 -36.61251 -34.61164 2.00087 2.39213 -34.33446 1078.41090
980.0000 -36.95098 -34.07120 2.87978 2.36515 -34.51282 1086.71356
985.0000 -37.27386 -35.72806 1.54580 2.34291 -34.65988 1098.41721
990.0000 -37.56471 -34.27331 3.29140 2.33263 -34.72783 1144.86957
995.0000 -35.69469 -32.52818 3.16651 2.60013 -32.95927 1404.93624
1000.0000 -37.35743 -34.78850 2.56893 2.54023 -33.35527 1302.08250
FREEZING PROCESS: loop number 5 T-loop= 1166.0000000000000
main_MD> interactions number 5 at Temperature= 1166.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.03443 -0.68694 -1.97516
force_rgl> df(natom) -2.10981 -5.44855 2.30540
1005.0000 -37.40464 -35.62156 1.78308 2.22191 -35.45984 1005.93251
1010.0000 -37.79831 -35.89238 1.90594 2.11347 -36.17680 896.64473
1015.0000 -37.46137 -35.10053 2.36084 2.20171 -35.59343 994.54968
1020.0000 -36.78228 -35.02199 1.76029 2.30926 -34.88238 1055.55445
1025.0000 -37.23250 -35.14681 2.08569 2.36243 -34.53084 1165.00664
1030.0000 -37.30252 -34.08205 3.22047 2.35415 -34.58556 1199.16299
1035.0000 -38.22821 -35.50688 2.72133 2.22487 -35.44030 1072.55528
1040.0000 -37.69715 -35.54312 2.15403 2.29651 -34.96668 1104.94151
1045.0000 -37.20431 -34.98218 2.22212 2.20316 -35.58381 934.98503
1050.0000 -37.65965 -35.42462 2.23504 2.23860 -35.34951 971.46539
1055.0000 -36.94477 -34.67394 2.27083 2.26898 -35.14865 1080.28763
1060.0000 -36.69412 -33.59899 3.09513 2.43928 -34.02271 1210.43994
1065.0000 -36.59455 -35.07381 1.52073 2.34015 -34.67813 1108.66434
1070.0000 -37.12375 -34.04625 3.07750 2.34594 -34.63981 1130.97330
1075.0000 -35.90992 -33.62051 2.28942 2.45431 -33.92336 1307.43184
1080.0000 -36.68470 -34.42475 2.25995 2.46252 -33.86911 1289.11867
1085.0000 -37.71722 -33.98488 3.73234 2.37108 -34.47360 1156.77989
1090.0000 -36.58133 -33.50784 3.07349 2.49538 -33.65185 1438.93841
1095.0000 -36.77092 -34.79857 1.97235 2.40445 -34.25298 1128.66134
1100.0000 -36.13364 -33.84052 2.29313 2.45330 -33.93006 1272.82883
1105.0000 -36.37613 -34.62526 1.75086 2.37991 -34.41525 1234.30189
1110.0000 -37.34786 -34.78412 2.56373 2.41540 -34.18063 1229.67260
1115.0000 -37.74629 -34.48047 3.26582 2.29200 -34.99645 1053.16554
1120.0000 -37.89603 -34.81648 3.07955 2.30322 -34.92231 1133.58925
1125.0000 -35.88948 -32.64024 3.24923 2.42081 -34.14487 1222.21240
1130.0000 -36.66913 -33.52650 3.14262 2.56929 -33.16318 1284.60507
1135.0000 -36.77932 -34.31274 2.46658 2.44068 -34.01350 1167.19146
1140.0000 -37.30161 -34.29189 3.00973 2.44677 -33.97323 1263.63319
1145.0000 -36.42910 -33.64762 2.78148 2.50186 -33.60898 1258.07789
1150.0000 -36.90111 -34.21907 2.68204 2.44621 -33.97693 1155.44583
1155.0000 -36.83664 -33.78957 3.04708 2.39561 -34.31143 1203.02802
1160.0000 -37.05928 -33.83024 3.22904 2.49879 -33.62925 1326.39345
1165.0000 -37.12936 -34.36324 2.76612 2.44490 -33.98559 1223.43589
1170.0000 -36.58348 -34.06831 2.51517 2.40155 -34.27220 1216.19176
1175.0000 -36.63851 -34.47040 2.16811 2.37251 -34.46419 1081.05614
1180.0000 -37.60784 -34.95907 2.64877 2.28790 -35.02354 1103.13243
1185.0000 -36.11283 -34.52763 1.58520 2.30829 -34.88878 1036.49524
1190.0000 -37.27059 -34.99606 2.27454 2.36919 -34.48611 1206.67166
1195.0000 -36.94703 -34.13657 2.81047 2.37167 -34.46974 1092.28605
1200.0000 -38.14731 -34.41773 3.72958 2.41252 -34.19962 1251.86946
1205.0000 -37.31029 -34.56691 2.74338 2.28113 -35.06832 1035.93303
1210.0000 -38.58278 -36.09729 2.48549 2.15043 -35.93245 944.92105
1215.0000 -37.60136 -36.07433 1.52703 2.15261 -35.91804 880.34280
1220.0000 -37.39702 -34.62900 2.76802 2.19441 -35.64165 931.66613
1225.0000 -37.35337 -34.38925 2.96411 2.33569 -34.70759 1111.27183
1230.0000 -36.35952 -34.40900 1.95052 2.36039 -34.54434 1114.82608
1235.0000 -37.15470 -34.38098 2.77371 2.32843 -34.75558 1083.37223
1240.0000 -37.13752 -34.88844 2.24908 2.32429 -34.78300 1128.60772
1245.0000 -37.34179 -34.06829 3.27349 2.36288 -34.52785 1194.81186
1250.0000 -36.37638 -33.33038 3.04600 2.45381 -33.92669 1221.74327
FREEZING PROCESS: loop number 6 T-loop= 1141.0000000000000
main_MD> interactions number 6 at Temperature= 1141.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.57440 1.90306 3.39897
force_rgl> df(natom) -1.54900 -9.98063 -6.43880
1255.0000 -36.31649 -32.85450 3.46200 2.56599 -33.18501 1350.87364
1260.0000 -37.21522 -34.89292 2.32231 2.38013 -34.41379 1108.21081
1265.0000 -36.89278 -34.76602 2.12676 2.33837 -34.68991 1135.28660
1270.0000 -37.51997 -35.10828 2.41169 2.25237 -35.25848 1068.33791
1275.0000 -36.08243 -33.71012 2.37231 2.35793 -34.56057 1131.11942
1280.0000 -37.37632 -35.05029 2.32603 2.39398 -34.32221 1149.70375
1285.0000 -37.66315 -35.21172 2.45143 2.22575 -35.43445 1014.15499
1290.0000 -37.28230 -35.26690 2.01540 2.17513 -35.76916 1024.38390
1295.0000 -37.71404 -34.95941 2.75463 2.29582 -34.97119 1080.62244
1300.0000 -36.59819 -33.88529 2.71290 2.44949 -33.95525 1309.19033
1305.0000 -36.17061 -34.12500 2.04560 2.44022 -34.01654 1215.84501
1310.0000 -36.83243 -34.86861 1.96382 2.42244 -34.13403 1292.71446
1315.0000 -37.30572 -35.34093 1.96479 2.28549 -35.03950 1037.35293
1320.0000 -37.12023 -33.90593 3.21431 2.42006 -34.14979 1251.34190
1325.0000 -37.06522 -34.59683 2.46840 2.41043 -34.21345 1247.38456
1330.0000 -37.43011 -34.46705 2.96306 2.32310 -34.79082 1150.61459
1335.0000 -36.20266 -33.81993 2.38273 2.41684 -34.17107 1175.42051
1340.0000 -37.91566 -35.20436 2.71130 2.32522 -34.77682 1073.56669
1345.0000 -37.25890 -34.25293 3.00598 2.22309 -35.45210 1097.52631
1350.0000 -35.51967 -32.81275 2.70692 2.54309 -33.33636 1270.90278
1355.0000 -36.07663 -33.91245 2.16419 2.46708 -33.83895 1231.67141
1360.0000 -37.21088 -34.65924 2.55163 2.42050 -34.14687 1142.16935
1365.0000 -37.04212 -34.39453 2.64760 2.42229 -34.13507 1201.79165
1370.0000 -37.49527 -34.57606 2.91921 2.37879 -34.42263 1105.26326
1375.0000 -37.11448 -33.94228 3.17220 2.32881 -34.75307 1170.59940
1380.0000 -38.03717 -35.03703 3.00015 2.35849 -34.55689 1149.65748
1385.0000 -36.98706 -34.42222 2.56484 2.31871 -34.81987 1142.96664
1390.0000 -37.42782 -35.30749 2.12033 2.30208 -34.92979 1044.48517
1395.0000 -36.49620 -33.58693 2.90927 2.34608 -34.63890 1059.59048
1400.0000 -37.88581 -34.19011 3.69570 2.42827 -34.09555 1157.30335
1405.0000 -38.51132 -34.96622 3.54510 2.40170 -34.27116 1277.69175
1410.0000 -37.34814 -34.21953 3.12861 2.36308 -34.52652 1071.75876
1415.0000 -36.83570 -33.52361 3.31208 2.44301 -33.99810 1210.04617
1420.0000 -36.54824 -33.92223 2.62601 2.41763 -34.16588 1243.35044
1425.0000 -36.89585 -34.80208 2.09377 2.39490 -34.31617 1216.16280
1430.0000 -37.20940 -35.26173 1.94767 2.40096 -34.27608 1156.08596
1435.0000 -37.63743 -35.54419 2.09324 2.26055 -35.20438 1009.00259
1440.0000 -36.35494 -34.13777 2.21717 2.33917 -34.68464 1097.51386
1445.0000 -37.37644 -35.35361 2.02283 2.35690 -34.56738 1068.92979
1450.0000 -38.40751 -35.50737 2.90014 2.23651 -35.36331 995.66433
1455.0000 -37.85729 -35.87217 1.98513 2.20668 -35.56054 996.55511
1460.0000 -37.93445 -35.66030 2.27416 2.11842 -36.14411 882.28465
1465.0000 -37.89933 -35.93852 1.96080 2.25670 -35.22986 1023.76974
1470.0000 -37.83112 -35.11239 2.71873 2.21783 -35.48684 1026.75990
1475.0000 -37.61786 -35.64973 1.96813 2.21508 -35.50501 1076.21391
1480.0000 -36.28199 -34.20348 2.07851 2.30594 -34.90430 1029.34966
1485.0000 -37.20220 -34.77315 2.42906 2.39983 -34.28353 1276.95713
1490.0000 -37.78128 -35.42677 2.35451 2.21768 -35.48784 1017.97513
1495.0000 -38.60707 -36.12841 2.47866 2.21981 -35.47372 1024.71883
1500.0000 -37.48054 -34.47090 3.00964 2.25373 -35.24950 1127.74204
FREEZING PROCESS: loop number 7 T-loop= 1116.0000000000000
main_MD> interactions number 7 at Temperature= 1116.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.48021 -0.40606 0.16798
force_rgl> df(natom) 2.10165 3.28128 0.07307
1505.0000 -35.30984 -32.69797 2.61187 2.49374 -33.66268 1379.80120
1510.0000 -36.01636 -33.93207 2.08429 2.52229 -33.47391 1214.90802
1515.0000 -37.40679 -33.45263 3.95415 2.45043 -33.94900 1260.70241
1520.0000 -37.34277 -34.61079 2.73198 2.51532 -33.51999 1403.70558
1525.0000 -37.04619 -35.17027 1.87592 2.26217 -35.19371 998.28377
1530.0000 -37.54351 -35.50995 2.03356 2.23533 -35.37111 1016.72779
1535.0000 -38.09679 -36.10795 1.98884 2.16432 -35.84065 883.80997
1540.0000 -38.07100 -36.31203 1.75896 2.16025 -35.86753 871.01287
1545.0000 -36.49451 -33.88393 2.61058 2.33816 -34.69127 1043.38165
1550.0000 -37.11043 -34.31610 2.79433 2.39669 -34.30428 1124.00124
1555.0000 -37.12298 -34.78347 2.33951 2.35656 -34.56966 1046.15347
1560.0000 -37.73343 -34.93719 2.79624 2.33890 -34.68637 1125.10463
1565.0000 -37.37117 -34.58428 2.78689 2.32173 -34.79991 1089.23475
1570.0000 -36.22328 -33.54525 2.67803 2.36948 -34.48419 1233.46062
1575.0000 -37.14588 -33.82849 3.31738 2.49259 -33.67024 1228.81452
1580.0000 -37.24177 -34.83964 2.40214 2.34770 -34.62824 1083.05212
1585.0000 -38.06042 -36.49605 1.56436 2.16168 -35.85811 914.09072
1590.0000 -37.26721 -35.19501 2.07220 2.13876 -36.00963 921.31505
1595.0000 -37.94624 -34.30829 3.63795 2.28665 -35.03182 1076.38365
1600.0000 -37.28944 -34.85090 2.43854 2.36082 -34.54150 1058.18646
1605.0000 -37.66936 -34.48923 3.18014 2.38383 -34.38932 1140.26098
1610.0000 -37.08584 -35.21324 1.87261 2.33631 -34.70353 1083.06025
1615.0000 -37.08896 -34.81371 2.27525 2.33209 -34.73144 1168.63997
1620.0000 -38.37125 -35.69252 2.67873 2.28933 -35.01412 1072.59598
1625.0000 -37.46952 -34.97079 2.49873 2.32291 -34.79208 1142.90965
1630.0000 -37.51753 -35.69310 1.82443 2.25737 -35.22543 1052.11712
1635.0000 -37.89462 -35.40729 2.48733 2.25238 -35.25843 1048.43815
1640.0000 -37.09823 -34.94859 2.14965 2.31671 -34.83312 1045.88485
1645.0000 -36.82729 -34.55167 2.27562 2.29584 -34.97106 1044.70016
1650.0000 -37.11996 -34.75782 2.36213 2.30049 -34.94034 1037.32788
1655.0000 -37.68057 -35.22564 2.45493 2.28566 -35.03841 1027.47764
1660.0000 -37.88732 -35.54309 2.34422 2.15837 -35.87998 981.45747
1665.0000 -38.11483 -36.22028 1.89455 2.14605 -35.96143 984.47003
1670.0000 -37.48593 -36.05872 1.42720 2.17428 -35.77480 955.65603
1675.0000 -37.29946 -34.39685 2.90261 2.29295 -34.99016 1139.25586
1680.0000 -37.02624 -34.99734 2.02890 2.35007 -34.61253 1124.57794
1685.0000 -38.32653 -36.72105 1.60549 2.12628 -36.09214 876.52072
1690.0000 -38.27294 -36.46167 1.81127 2.03909 -36.66857 796.64720
1695.0000 -37.55206 -35.74030 1.81176 2.10243 -36.24980 819.67008
1700.0000 -36.89283 -34.65958 2.23325 2.29015 -35.00871 1089.51030
1705.0000 -36.84523 -34.59700 2.24824 2.31942 -34.81520 1031.47741
1710.0000 -37.58441 -34.73408 2.85034 2.37217 -34.46643 1203.36209
1715.0000 -37.19440 -34.23848 2.95592 2.38724 -34.36679 1193.95685
1720.0000 -37.56518 -34.50321 3.06197 2.33746 -34.69590 1109.97917
1725.0000 -36.93576 -34.55541 2.38035 2.29447 -34.98015 1121.39201
1730.0000 -37.70695 -35.75624 1.95071 2.31236 -34.86188 1063.58315
1735.0000 -36.56150 -34.52172 2.03978 2.25098 -35.26769 1070.96739
1740.0000 -36.83605 -34.80463 2.03142 2.33796 -34.69258 1193.72025
1745.0000 -36.58781 -34.29288 2.29493 2.35068 -34.60850 1125.84115
1750.0000 -38.15324 -36.02710 2.12613 2.23431 -35.37785 986.85931
FREEZING PROCESS: loop number 8 T-loop= 1091.0000000000000
main_MD> interactions number 8 at Temperature= 1091.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.78246 2.22301 1.29605
force_rgl> df(natom) -2.93334 2.25500 3.28703
1755.0000 -37.73982 -35.28842 2.45140 2.18703 -35.69047 1037.18909
1760.0000 -38.00887 -35.63226 2.37661 2.16565 -35.83180 980.09511
1765.0000 -37.28286 -34.61961 2.66325 2.26338 -35.18571 1037.94437
1770.0000 -37.19890 -34.47661 2.72229 2.30451 -34.91377 1128.44485
1775.0000 -37.18688 -34.84612 2.34076 2.29503 -34.97645 1097.19938
1780.0000 -37.09475 -33.59469 3.50006 2.43236 -34.06845 1275.84667
1785.0000 -36.54423 -35.09165 1.45259 2.36045 -34.54393 1232.14563
1790.0000 -38.00632 -34.97449 3.03183 2.25906 -35.21423 998.62457
1795.0000 -37.22618 -35.78336 1.44282 2.18139 -35.72778 963.79781
1800.0000 -37.29595 -34.96001 2.33594 2.21576 -35.50052 995.29631
1805.0000 -37.29742 -34.75606 2.54135 2.28271 -35.05787 1123.26035
1810.0000 -38.64167 -36.36968 2.27199 2.22808 -35.41910 1076.39615
1815.0000 -38.09130 -35.69167 2.39963 2.07803 -36.41115 865.50255
1820.0000 -38.17710 -36.13585 2.04125 2.19872 -35.61320 1041.37259
1825.0000 -36.94497 -35.06026 1.88471 2.17291 -35.78383 948.26800
1830.0000 -37.51596 -35.37935 2.13661 2.31000 -34.87744 1064.18595
1835.0000 -38.10865 -35.71023 2.39842 2.22008 -35.47195 1026.45238
1840.0000 -38.24102 -35.24288 2.99813 2.23795 -35.35379 1137.81795
1845.0000 -37.85927 -35.24349 2.61578 2.25042 -35.27138 1019.86015
1850.0000 -36.55453 -34.17380 2.38073 2.34643 -34.63661 1104.65969
1855.0000 -37.46502 -34.46737 2.99765 2.43605 -34.04409 1222.49935
1860.0000 -37.84070 -35.08171 2.75899 2.27215 -35.12768 1123.71928
1865.0000 -37.73090 -35.19924 2.53166 2.28864 -35.01866 1163.94793
1870.0000 -37.84656 -35.13708 2.70948 2.28472 -35.04460 1077.38814
1875.0000 -37.74706 -34.72491 3.02215 2.25629 -35.23258 1053.04523
1880.0000 -36.80193 -34.85676 1.94517 2.30828 -34.88886 1085.41775
1885.0000 -37.34812 -34.76404 2.58409 2.33674 -34.70065 1109.18856
1890.0000 -37.09722 -34.73875 2.35846 2.31917 -34.81683 1155.46026
1895.0000 -36.96709 -35.02031 1.94678 2.32107 -34.80426 1093.67653
1900.0000 -37.44339 -35.64306 1.80033 2.22390 -35.44673 999.26021
1905.0000 -37.67314 -34.65130 3.02184 2.37011 -34.48005 1130.87695
1910.0000 -37.58460 -35.07629 2.50831 2.27176 -35.13029 957.87286
1915.0000 -37.07702 -34.57255 2.50447 2.31608 -34.83723 1050.87762
1920.0000 -37.14336 -35.46168 1.68168 2.31034 -34.87520 1074.70410
1925.0000 -38.60901 -36.25433 2.35468 2.12702 -36.08724 912.17819
1930.0000 -37.05472 -34.16637 2.88835 2.28956 -35.01258 1054.46558
1935.0000 -37.01301 -34.37875 2.63426 2.36282 -34.52824 1148.41948
1940.0000 -36.86703 -34.68482 2.18221 2.32064 -34.80710 1102.87243
1945.0000 -36.70061 -34.62143 2.07917 2.30409 -34.91653 1060.91353
1950.0000 -37.99176 -35.76315 2.22862 2.28040 -35.07316 1085.92285
1955.0000 -37.59182 -35.03314 2.55868 2.18628 -35.69546 982.73799
1960.0000 -36.54467 -34.08560 2.45907 2.34110 -34.67182 1146.93593
1965.0000 -36.51223 -34.65700 1.85523 2.37617 -34.43998 1118.52691
1970.0000 -36.92596 -34.57724 2.34872 2.36986 -34.48170 1126.66973
1975.0000 -37.59864 -35.30044 2.29820 2.30743 -34.89447 1123.69038
1980.0000 -37.78707 -35.63881 2.14826 2.25163 -35.26338 1073.42712
1985.0000 -37.51089 -35.15219 2.35870 2.19807 -35.61751 1004.42967
1990.0000 -37.69251 -35.44215 2.25036 2.24616 -35.29956 1035.81573
1995.0000 -37.65923 -35.03053 2.62870 2.26462 -35.17749 1031.64574
2000.0000 -38.58729 -35.71935 2.86794 2.22949 -35.40976 1101.17872
FREEZING PROCESS: loop number 9 T-loop= 1066.0000000000000
main_MD> interactions number 9 at Temperature= 1066.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.56362 -0.89339 -3.36422
force_rgl> df(natom) -0.73905 1.95099 0.18197
2005.0000 -36.05998 -32.93976 3.12022 2.45593 -33.91266 1291.43325
2010.0000 -36.85737 -34.61768 2.23969 2.43856 -34.02748 1244.45417
2015.0000 -37.89785 -36.18146 1.71640 2.23901 -35.34683 992.46019
2020.0000 -36.98941 -35.24693 1.74248 2.26871 -35.15044 1089.96805
2025.0000 -37.62601 -34.05523 3.57079 2.39601 -34.30879 1222.17739
2030.0000 -37.57956 -35.57997 1.99958 2.28875 -35.01797 1113.93054
2035.0000 -37.70880 -35.97471 1.73409 2.17924 -35.74198 902.00109
2040.0000 -36.30010 -34.76719 1.53291 2.19289 -35.65173 925.35714
2045.0000 -37.64927 -35.60405 2.04522 2.28188 -35.06339 1081.06969
2050.0000 -37.63347 -35.51893 2.11453 2.23381 -35.38119 1062.71321
2055.0000 -38.19787 -36.31317 1.88470 2.14240 -35.98556 902.14505
2060.0000 -37.06720 -34.75175 2.31545 2.17035 -35.80073 894.80921
2065.0000 -36.92501 -34.81318 2.11183 2.31806 -34.82416 1102.09277
2070.0000 -36.85895 -34.54719 2.31176 2.32635 -34.76939 1121.91172
2075.0000 -36.65961 -34.43897 2.22065 2.31506 -34.84399 1026.68014
2080.0000 -37.51243 -34.98621 2.52622 2.24117 -35.33251 1066.00152
2085.0000 -37.61324 -35.14413 2.46911 2.30413 -34.91628 1061.00227
2090.0000 -37.22430 -35.04567 2.17863 2.33868 -34.68785 1159.76847
2095.0000 -37.32678 -35.49790 1.82888 2.24395 -35.31414 978.51743
2100.0000 -37.79299 -35.31608 2.47691 2.22740 -35.42354 1015.48587
2105.0000 -38.38253 -35.72582 2.65671 2.23736 -35.35773 1117.91941
2110.0000 -37.56844 -35.03654 2.53190 2.28574 -35.03788 1112.03429
2115.0000 -36.36702 -34.74376 1.62326 2.33897 -34.68595 1089.76016
2120.0000 -36.97093 -34.61532 2.35561 2.36163 -34.53614 1193.27673
2125.0000 -37.66836 -34.57719 3.09116 2.35668 -34.56882 1202.36572
2130.0000 -37.76992 -36.10647 1.66345 2.25652 -35.23106 1038.96165
2135.0000 -38.19978 -36.72048 1.47930 2.09180 -36.32010 844.54077
2140.0000 -37.12725 -35.64243 1.48483 2.13187 -36.05519 870.81898
2145.0000 -36.45057 -33.47810 2.97247 2.33021 -34.74384 1049.04587
2150.0000 -35.69429 -33.53646 2.15783 2.53880 -33.36478 1272.07106
2155.0000 -37.02786 -33.90089 3.12697 2.45485 -33.91977 1197.60880
2160.0000 -36.94152 -34.07926 2.86226 2.45988 -33.88656 1289.73173
2165.0000 -37.35005 -34.47373 2.87632 2.37120 -34.47282 1198.51433
2170.0000 -36.84326 -34.46216 2.38109 2.38770 -34.36372 1133.67407
2175.0000 -37.23657 -34.25087 2.98570 2.35373 -34.58836 1054.75693
2180.0000 -37.20148 -34.89288 2.30860 2.32297 -34.79170 1086.09440
2185.0000 -37.29992 -35.78964 1.51027 2.26844 -35.15225 946.44444
2190.0000 -37.16404 -34.97756 2.18647 2.25901 -35.21459 913.89562
2195.0000 -37.13853 -35.38065 1.75787 2.26180 -35.19612 955.20642
2200.0000 -37.29794 -34.92726 2.37068 2.26174 -35.19655 1088.17541
2205.0000 -37.70620 -35.43740 2.26880 2.32729 -34.76313 1093.67602
2210.0000 -37.84473 -35.29550 2.54923 2.22801 -35.41956 1021.59465
2215.0000 -37.43438 -35.24907 2.18530 2.29430 -34.98127 1101.83466
2220.0000 -37.82144 -36.11115 1.71029 2.18188 -35.72452 920.21891
2225.0000 -36.68133 -34.22545 2.45588 2.21464 -35.50795 936.92015
2230.0000 -36.68375 -33.30283 3.38091 2.44095 -34.01168 1320.72519
2235.0000 -37.52395 -35.75531 1.76863 2.31862 -34.82046 1112.48856
2240.0000 -37.54078 -34.56318 2.97760 2.24266 -35.32269 1083.05666
2245.0000 -36.82987 -34.30812 2.52175 2.43782 -34.03238 1157.42796
2250.0000 -37.18784 -34.41618 2.77166 2.36558 -34.50999 1152.50995
FREEZING PROCESS: loop number 10 T-loop= 1041.0000000000000
main_MD> interactions number 10 at Temperature= 1041.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.69366 0.50474 0.78794
force_rgl> df(natom) -1.78164 -0.22612 -0.66549
2255.0000 -37.82200 -35.63836 2.18364 2.29998 -34.94370 1138.44250
2260.0000 -38.01802 -35.26261 2.75541 2.22918 -35.41181 1070.50537
2265.0000 -37.29606 -34.96764 2.32842 2.24608 -35.30005 1039.84740
2270.0000 -37.50957 -34.65813 2.85144 2.36124 -34.53866 1185.36704
2275.0000 -38.03286 -36.04641 1.98645 2.28311 -35.05527 1075.78488
2280.0000 -38.19196 -36.71026 1.48169 2.09012 -36.33120 839.73891
2285.0000 -38.34653 -36.64905 1.69748 2.05507 -36.56293 883.50970
2290.0000 -37.49948 -35.47375 2.02573 2.12140 -36.12436 850.92078
2295.0000 -37.62624 -35.23413 2.39211 2.22177 -35.46082 969.38130
2300.0000 -37.37561 -35.00741 2.36820 2.30204 -34.93010 1064.30655
2305.0000 -37.76351 -35.73087 2.03263 2.23748 -35.35693 1054.98405
2310.0000 -37.42438 -35.13565 2.28873 2.23091 -35.40035 1016.05166
2315.0000 -37.55610 -35.28199 2.27411 2.25012 -35.27336 1056.32458
2320.0000 -37.98687 -35.11080 2.87607 2.43110 -34.07680 1311.03424
2325.0000 -37.22688 -35.05367 2.17321 2.24033 -35.33808 989.00436
2330.0000 -37.21837 -34.83786 2.38051 2.33594 -34.70598 1072.74534
2335.0000 -36.82344 -34.17411 2.64933 2.31976 -34.81295 1095.45833
2340.0000 -37.19173 -34.42483 2.76690 2.33644 -34.70264 1114.64781
2345.0000 -37.07311 -34.68058 2.39252 2.29237 -34.99405 1016.37970
2350.0000 -36.68399 -34.41254 2.27145 2.45858 -33.89513 1238.59984
2355.0000 -36.39561 -33.76788 2.62773 2.47810 -33.76605 1282.10697
2360.0000 -37.00831 -34.45187 2.55644 2.38794 -34.36214 1187.09811
2365.0000 -36.37905 -33.53384 2.84521 2.40544 -34.24644 1157.49820
2370.0000 -37.80510 -35.82496 1.98014 2.42391 -34.12433 1130.70013
2375.0000 -37.87629 -36.18834 1.68795 2.20328 -35.58302 901.67377
2380.0000 -37.43177 -35.81462 1.61716 2.16264 -35.85170 853.99036
2385.0000 -37.32384 -35.10191 2.22193 2.19373 -35.64619 843.71143
2390.0000 -37.68774 -35.31505 2.37269 2.28528 -35.04091 1015.57839
2395.0000 -38.69463 -36.72792 1.96671 2.11844 -36.14393 912.36566
2400.0000 -37.57709 -35.38265 2.19445 2.15019 -35.93407 948.54351
2405.0000 -37.53021 -35.25757 2.27264 2.32680 -34.76637 1113.49091
2410.0000 -37.28621 -35.02644 2.25978 2.27934 -35.08018 1071.98883
2415.0000 -37.11545 -34.11677 2.99868 2.37960 -34.41729 1181.37367
2420.0000 -37.17443 -34.99212 2.18230 2.31621 -34.83639 1096.42784
2425.0000 -38.24979 -36.24035 2.00944 2.19812 -35.61719 867.73129
2430.0000 -37.91813 -35.88967 2.02846 2.10077 -36.26075 868.80684
2435.0000 -37.30950 -34.71619 2.59331 2.29558 -34.97279 1113.31480
2440.0000 -36.64141 -34.62285 2.01856 2.41658 -34.17281 1153.61422
2445.0000 -35.86872 -33.49633 2.37238 2.41947 -34.15372 1181.03378
2450.0000 -37.19172 -35.20459 1.98712 2.31424 -34.84944 1113.44989
2455.0000 -37.62243 -35.13492 2.48751 2.21660 -35.49495 997.65944
2460.0000 -36.72157 -34.32365 2.39793 2.35189 -34.60051 1118.88850
2465.0000 -35.95399 -33.36552 2.58847 2.45765 -33.90126 1220.38413
2470.0000 -38.46439 -35.97054 2.49385 2.33200 -34.73203 1156.52822
2475.0000 -38.63971 -35.78285 2.85686 2.09907 -36.27200 928.26616
2480.0000 -36.41508 -33.69340 2.72168 2.27637 -35.09981 1118.41959
2485.0000 -37.30789 -34.92293 2.38495 2.37309 -34.46034 1215.47199
2490.0000 -38.04284 -35.78425 2.25860 2.30862 -34.88659 1078.96653
2495.0000 -38.51242 -36.84878 1.66363 2.03253 -36.71196 804.33158
2500.0000 -37.86826 -36.32901 1.53924 2.10603 -36.22601 882.80734
FREEZING PROCESS: loop number 11 T-loop= 1016.0000000000000
main_MD> interactions number 11 at Temperature= 1016.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.18397 0.51275 -2.79611
force_rgl> df(natom) 0.92700 1.64319 0.68281
2505.0000 -37.94797 -35.61632 2.33164 2.08805 -36.34491 859.42176
2510.0000 -38.06473 -35.75154 2.31319 2.18144 -35.72740 966.08712
2515.0000 -36.60676 -35.03994 1.56682 2.23436 -35.37757 1093.70889
2520.0000 -36.94373 -34.88230 2.06143 2.27218 -35.12749 994.96553
2525.0000 -37.02433 -35.37318 1.65115 2.25029 -35.27225 965.34297
2530.0000 -37.31653 -35.60705 1.70948 2.18331 -35.71508 839.09983
2535.0000 -37.21321 -35.43573 1.77749 2.20994 -35.53899 999.54142
2540.0000 -37.08540 -34.57391 2.51149 2.27154 -35.13175 1079.22098
2545.0000 -37.70567 -35.38453 2.32114 2.27581 -35.10352 1145.65577
2550.0000 -37.77021 -35.86154 1.90868 2.18045 -35.73396 990.88560
2555.0000 -37.54025 -35.45453 2.08572 2.19476 -35.63934 1009.14754
2560.0000 -38.01387 -36.05134 1.96252 2.19970 -35.60669 979.67608
2565.0000 -38.27305 -36.01512 2.25793 2.11320 -36.17858 890.98281
2570.0000 -38.90763 -37.32396 1.58367 2.01982 -36.79596 820.43933
2575.0000 -37.16318 -35.02539 2.13779 2.06830 -36.47545 865.06665
2580.0000 -36.67673 -35.05759 1.61915 2.33016 -34.74414 1054.84795
2585.0000 -37.55960 -34.91026 2.64934 2.24436 -35.31146 976.29219
2590.0000 -37.37863 -35.29400 2.08463 2.32319 -34.79023 1053.63071
2595.0000 -37.82224 -35.73411 2.08813 2.15752 -35.88560 872.51030
2600.0000 -38.17722 -35.78562 2.39159 2.13435 -36.03880 921.85852
2605.0000 -37.31456 -35.37078 1.94379 2.25675 -35.22950 1011.27984
2610.0000 -37.47618 -35.24317 2.23301 2.26906 -35.14813 1052.19395
2615.0000 -37.95973 -36.19981 1.75992 2.18822 -35.68264 1020.96698
2620.0000 -37.31816 -34.94588 2.37228 2.18880 -35.67877 931.66640
2625.0000 -38.30581 -34.87332 3.43249 2.32385 -34.78591 1098.50588
2630.0000 -37.65939 -35.01386 2.64554 2.33791 -34.69292 1168.25360
2635.0000 -37.14800 -35.13389 2.01411 2.24464 -35.30959 1003.77850
2640.0000 -37.63608 -35.40905 2.22703 2.28894 -35.01667 956.50183
2645.0000 -37.44367 -35.56283 1.88085 2.18576 -35.69886 968.32840
2650.0000 -37.33745 -35.74908 1.58838 2.16484 -35.83716 895.90108
2655.0000 -38.28335 -36.44583 1.83752 2.10886 -36.20730 936.70732
2660.0000 -38.09196 -35.74193 2.35003 2.09587 -36.29319 912.35330
2665.0000 -37.56556 -34.96717 2.59839 2.23457 -35.37618 1006.76374
2670.0000 -36.48845 -35.02774 1.46070 2.26120 -35.20013 1073.41408
2675.0000 -37.38311 -35.19603 2.18709 2.37064 -34.47652 1199.76304
2680.0000 -37.61111 -35.33628 2.27483 2.26651 -35.16497 1099.10964
2685.0000 -37.53068 -35.26809 2.26258 2.21252 -35.52198 981.45895
2690.0000 -37.38225 -35.54249 1.83976 2.17173 -35.79166 973.58775
2695.0000 -36.83972 -33.52168 3.31804 2.33202 -34.73188 1171.92341
2700.0000 -37.26353 -34.49118 2.77235 2.38534 -34.37934 1126.04920
2705.0000 -37.20859 -34.44022 2.76837 2.35719 -34.56547 1169.92605
2710.0000 -37.79761 -36.34779 1.44982 2.22527 -35.43766 1072.46551
2715.0000 -37.67636 -36.05009 1.62626 2.14493 -35.96882 946.63468
2720.0000 -37.38978 -35.19481 2.19498 2.28748 -35.02633 1115.61555
2725.0000 -37.65431 -35.82769 1.82662 2.21665 -35.49465 1018.20675
2730.0000 -37.65478 -35.37113 2.28365 2.17898 -35.74367 1016.74788
2735.0000 -38.00620 -35.97329 2.03291 2.16350 -35.84603 933.73092
2740.0000 -37.73578 -36.31319 1.42259 2.07578 -36.42597 885.00154
2745.0000 -37.92934 -35.27398 2.65536 2.13166 -36.05654 936.00330
2750.0000 -37.62688 -34.63166 2.99522 2.24205 -35.32668 1012.50778
FREEZING PROCESS: loop number 12 T-loop= 991.00000000000000
main_MD> interactions number 12 at Temperature= 991.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.46716 -0.88801 -1.42029
force_rgl> df(natom) -3.98903 -2.04623 -1.02351
2755.0000 -37.83867 -35.66786 2.17081 2.29018 -35.00847 1036.51029
2760.0000 -38.20657 -35.71743 2.48913 2.18122 -35.72892 1047.80979
2765.0000 -37.66522 -35.98788 1.67734 2.18073 -35.73214 1000.66493
2770.0000 -37.83984 -34.87850 2.96134 2.16685 -35.82391 1012.12872
2775.0000 -37.59131 -35.93861 1.65270 2.29208 -34.99595 1158.59859
2780.0000 -37.30534 -35.01084 2.29450 2.19709 -35.62400 982.00167
2785.0000 -37.52873 -35.91967 1.60905 2.21448 -35.50897 1012.60703
2790.0000 -38.39076 -36.72549 1.66527 2.12846 -36.07770 918.76747
2795.0000 -37.99425 -36.14529 1.84896 2.05535 -36.56107 817.90597
2800.0000 -37.13633 -35.16266 1.97367 2.21478 -35.50699 960.27302
2805.0000 -38.19505 -35.45061 2.74444 2.27873 -35.08422 1023.47376
2810.0000 -37.99799 -35.30451 2.69347 2.21904 -35.47887 1023.86754
2815.0000 -36.84672 -34.16215 2.68457 2.22465 -35.44174 1063.17053
2820.0000 -37.08875 -34.57537 2.51338 2.46178 -33.87394 1327.61404
2825.0000 -37.07709 -34.80100 2.27609 2.36226 -34.53192 1135.54395
2830.0000 -37.98818 -35.78218 2.20601 2.19712 -35.62378 963.45439
2835.0000 -37.10317 -34.82737 2.27580 2.32421 -34.78353 1177.65653
2840.0000 -37.08636 -35.30297 1.78338 2.23443 -35.37707 1086.49037
2845.0000 -38.00003 -36.14667 1.85336 2.19085 -35.66523 929.42575
2850.0000 -38.44349 -36.72650 1.71699 2.05011 -36.59571 780.45672
2855.0000 -38.28562 -36.26879 2.01682 2.04867 -36.60522 769.29172
2860.0000 -37.07695 -34.36849 2.70846 2.22814 -35.41865 1085.43915
2865.0000 -38.66800 -36.43187 2.23613 2.20204 -35.59126 1052.55732
2870.0000 -37.79917 -35.81811 1.98106 2.14551 -35.96499 954.20699
2875.0000 -37.00700 -34.73314 2.27385 2.27600 -35.10225 1092.10208
2880.0000 -37.29990 -34.52130 2.77861 2.28286 -35.05691 1041.65728
2885.0000 -37.43828 -35.03425 2.40403 2.38966 -34.35081 1186.26144
2890.0000 -37.60858 -34.73943 2.86915 2.31094 -34.87125 1157.15294
2895.0000 -36.59705 -34.71573 1.88132 2.30476 -34.91210 1032.15756
2900.0000 -37.03264 -35.26518 1.76746 2.26059 -35.20412 1038.52643
2905.0000 -38.76049 -36.52922 2.23127 2.19584 -35.63222 1010.71483
2910.0000 -37.92773 -35.73658 2.19115 2.12062 -36.12956 906.62901
2915.0000 -39.05599 -37.23770 1.81829 2.02285 -36.77596 828.28018
2920.0000 -38.93184 -37.04035 1.89149 1.97364 -37.10133 745.24604
2925.0000 -38.32838 -36.20838 2.12001 2.03713 -36.68153 814.89822
2930.0000 -36.65697 -35.02393 1.63304 2.17469 -35.77207 942.42496
2935.0000 -35.92243 -34.00407 1.91836 2.41904 -34.15657 1135.56195
2940.0000 -37.20135 -35.07130 2.13005 2.30643 -34.90107 1063.10574
2945.0000 -37.01001 -34.53464 2.47538 2.37194 -34.46796 1157.75320
2950.0000 -37.54683 -34.65958 2.88726 2.35502 -34.57982 1139.38852
2955.0000 -37.21340 -34.53039 2.68300 2.38444 -34.38532 1179.90436
2960.0000 -38.31214 -35.44849 2.86365 2.25550 -35.23779 1069.34909
2965.0000 -38.05107 -35.70078 2.35029 2.15071 -35.93064 927.81923
2970.0000 -37.82278 -35.26884 2.55393 2.21480 -35.50685 986.48325
2975.0000 -37.54612 -35.06861 2.47752 2.19119 -35.66299 978.74206
2980.0000 -37.74483 -35.19622 2.54860 2.26172 -35.19666 1088.49919
2985.0000 -38.24417 -35.45362 2.79055 2.20755 -35.55480 999.54481
2990.0000 -38.35883 -36.23379 2.12504 2.14841 -35.94578 952.97568
2995.0000 -37.81221 -34.71669 3.09552 2.21551 -35.50218 1002.13618
3000.0000 -38.46019 -35.80443 2.65577 2.24107 -35.33321 1059.83514
FREEZING PROCESS: loop number 13 T-loop= 966.00000000000000
main_MD> interactions number 13 at Temperature= 966.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.77211 0.08117 -0.35971
force_rgl> df(natom) -1.66398 3.33497 0.19266
3005.0000 -38.06002 -36.34587 1.71415 2.12977 -36.06907 967.81375
3010.0000 -37.99574 -35.40680 2.58895 2.17928 -35.74174 970.18879
3015.0000 -38.14428 -35.85736 2.28692 2.15624 -35.89407 963.31409
3020.0000 -37.22371 -34.78954 2.43417 2.16929 -35.80778 1028.03811
3025.0000 -37.73006 -35.36098 2.36908 2.21009 -35.53803 1025.40601
3030.0000 -38.26831 -36.17366 2.09465 2.13165 -36.05660 918.95090
3035.0000 -37.99373 -36.21427 1.77947 2.11688 -36.15425 911.91452
3040.0000 -38.51619 -36.73760 1.77859 2.04783 -36.61078 839.15167
3045.0000 -37.48787 -35.60720 1.88067 2.14573 -35.96355 1017.73257
3050.0000 -37.05630 -34.92993 2.12637 2.28025 -35.07415 1078.87035
3055.0000 -36.55600 -35.03429 1.52172 2.30827 -34.88893 1092.92689
3060.0000 -37.73720 -35.72514 2.01206 2.22736 -35.42384 1012.67307
3065.0000 -37.98101 -36.06770 1.91331 2.20071 -35.60006 1024.52249
3070.0000 -36.64779 -35.56941 1.07837 2.15408 -35.90831 906.47950
3075.0000 -37.89848 -35.19368 2.70479 2.20703 -35.55822 874.34958
3080.0000 -38.89669 -35.88003 3.01666 2.22626 -35.43111 1029.99125
3085.0000 -38.01186 -36.24059 1.77127 2.12449 -36.10394 906.48267
3090.0000 -38.32938 -36.34157 1.98781 2.07246 -36.44795 832.72156
3095.0000 -38.15658 -36.09259 2.06399 2.13650 -36.02454 907.48925
3100.0000 -37.79710 -36.02951 1.76759 2.20333 -35.58273 1062.49822
3105.0000 -37.17804 -35.98387 1.19417 2.14710 -35.95445 925.16194
3110.0000 -38.23087 -36.01146 2.21941 2.22196 -35.45955 972.62429
3115.0000 -38.82389 -36.56662 2.25727 2.08560 -36.36106 900.65195
3120.0000 -37.52094 -35.76329 1.75766 2.11151 -36.18980 836.66613
3125.0000 -37.42993 -35.63919 1.79074 2.23241 -35.39047 985.57961
3130.0000 -37.93587 -36.27872 1.65715 2.19172 -35.65948 969.19115
3135.0000 -37.95089 -35.91043 2.04046 2.12836 -36.07838 921.83934
3140.0000 -38.22694 -36.60089 1.62605 2.12987 -36.06841 927.54256
3145.0000 -38.82033 -36.15207 2.66826 2.05013 -36.59561 886.23410
3150.0000 -37.37023 -35.03328 2.33695 2.21408 -35.51165 1052.78875
3155.0000 -36.84644 -34.70340 2.14304 2.32780 -34.75979 1177.77396
3160.0000 -37.49689 -34.18247 3.31442 2.33596 -34.70582 1178.46874
3165.0000 -37.85754 -33.77311 4.08443 2.42764 -34.09968 1186.36294
3170.0000 -36.43891 -34.58537 1.85354 2.48043 -33.75068 1231.73666
3175.0000 -38.19135 -36.19468 1.99667 2.26974 -35.14361 1070.19755
3180.0000 -38.37391 -36.14086 2.23305 2.06747 -36.48094 881.77514
3185.0000 -38.63775 -36.33542 2.30233 2.09680 -36.28705 863.85296
3190.0000 -37.31050 -34.85165 2.45885 2.20490 -35.57230 945.73859
3195.0000 -37.58178 -35.14985 2.43193 2.28008 -35.07527 1122.92272
3200.0000 -38.27690 -36.17534 2.10156 2.16527 -35.83434 975.94833
3205.0000 -37.75212 -35.70238 2.04974 2.14573 -35.96355 974.35581
3210.0000 -37.85053 -35.31317 2.53736 2.25796 -35.22151 1111.78597
3215.0000 -37.68907 -34.42327 3.26580 2.33103 -34.73840 1100.71704
3220.0000 -37.59635 -35.21477 2.38158 2.29755 -34.95975 1109.89112
3225.0000 -37.40744 -34.95476 2.45268 2.32998 -34.74534 1132.15544
3230.0000 -38.07487 -36.55923 1.51564 2.19058 -35.66703 1002.31614
3235.0000 -37.75642 -35.56300 2.19341 2.09862 -36.27501 871.34521
3240.0000 -37.69312 -36.03434 1.65878 2.24069 -35.33573 1121.20488
3245.0000 -38.62491 -35.95626 2.66865 2.17132 -35.79432 951.78023
3250.0000 -38.44267 -36.40033 2.04234 2.11614 -36.15915 908.38625
FREEZING PROCESS: loop number 14 T-loop= 941.00000000000000
main_MD> interactions number 14 at Temperature= 941.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.46040 -0.92021 1.05861
force_rgl> df(natom) 0.40739 -1.41178 -0.29555
3255.0000 -38.20640 -36.40379 1.80261 2.16246 -35.85291 935.87630
3260.0000 -37.96753 -36.26572 1.70181 2.09043 -36.32916 888.27390
3265.0000 -37.89217 -36.11103 1.78114 2.15180 -35.92342 889.36391
3270.0000 -38.05572 -36.56934 1.48638 2.07096 -36.45784 803.08455
3275.0000 -38.43272 -36.53408 1.89864 2.09424 -36.30399 853.98061
3280.0000 -38.11206 -35.76985 2.34222 2.14685 -35.95611 842.74773
3285.0000 -37.55486 -35.54568 2.00918 2.21421 -35.51078 966.17649
3290.0000 -36.59818 -34.29833 2.29985 2.34375 -34.65434 1159.48377
3295.0000 -36.14372 -33.18590 2.95782 2.44246 -34.00168 1212.00446
3300.0000 -37.09653 -33.88197 3.21456 2.46951 -33.82289 1304.48130
3305.0000 -36.84573 -34.99080 1.85493 2.35115 -34.60543 1070.50094
3310.0000 -36.56338 -34.76809 1.79529 2.31855 -34.82096 1063.88404
3315.0000 -37.64862 -34.99058 2.65804 2.27318 -35.12092 1073.70374
3320.0000 -38.41786 -35.85753 2.56033 2.15007 -35.93485 972.60194
3325.0000 -38.78777 -35.99139 2.79638 2.16383 -35.84387 1004.61950
3330.0000 -37.81876 -36.22780 1.59096 2.14926 -35.94022 913.95977
3335.0000 -37.74551 -35.69106 2.05445 2.07489 -36.43191 864.66352
3340.0000 -37.49121 -35.67364 1.81757 2.17536 -35.76763 927.99509
3345.0000 -37.47706 -35.42503 2.05203 2.21436 -35.50979 986.78262
3350.0000 -37.49152 -34.17736 3.31415 2.26790 -35.15579 1081.29741
3355.0000 -37.99313 -35.01205 2.98108 2.32629 -34.76973 1167.81147
3360.0000 -37.73242 -36.09004 1.64238 2.22449 -35.44281 994.06037
3365.0000 -38.25277 -36.53472 1.71805 2.09553 -36.29543 847.70036
3370.0000 -38.46570 -36.39133 2.07437 2.04155 -36.65232 826.65833
3375.0000 -37.48114 -35.10759 2.37355 2.14275 -35.98320 960.74572
3380.0000 -36.63333 -34.45278 2.18054 2.26648 -35.16516 1031.04172
3385.0000 -36.75672 -34.06901 2.68770 2.40011 -34.28170 1136.84914
3390.0000 -37.66114 -35.04963 2.61151 2.30614 -34.90296 1086.24649
3395.0000 -38.58020 -36.30167 2.27853 2.18002 -35.73681 965.51920
3400.0000 -38.73956 -36.31592 2.42364 2.14626 -35.96001 979.39998
3405.0000 -38.12942 -35.25798 2.87144 2.23293 -35.38701 1021.43723
3410.0000 -37.65206 -35.49871 2.15335 2.25717 -35.22677 990.62271
3415.0000 -37.73557 -35.66113 2.07444 2.19587 -35.63206 984.77521
3420.0000 -37.55818 -35.11049 2.44768 2.27077 -35.13683 990.52334
3425.0000 -38.45972 -35.58860 2.87112 2.22842 -35.41684 1065.84343
3430.0000 -37.59882 -35.02504 2.57378 2.22002 -35.47234 1084.26536
3435.0000 -37.63084 -35.51302 2.11782 2.20309 -35.58431 964.37045
3440.0000 -37.62043 -36.00779 1.61263 2.18804 -35.68380 905.99700
3445.0000 -37.94362 -35.92727 2.01636 2.14447 -35.97186 903.47457
3450.0000 -38.49839 -36.89768 1.60071 1.98608 -37.01905 731.93058
3455.0000 -38.46529 -36.56279 1.90250 1.98382 -37.03400 764.75444
3460.0000 -38.45401 -36.71478 1.73923 2.13638 -36.02537 861.41019
3465.0000 -38.67651 -36.69175 1.98476 2.07872 -36.40658 840.97158
3470.0000 -37.44356 -35.71091 1.73265 2.17402 -35.77647 946.11764
3475.0000 -37.08894 -34.82247 2.26646 2.23237 -35.39072 997.04750
3480.0000 -37.70840 -35.80368 1.90472 2.23638 -35.36418 1046.96628
3485.0000 -37.72386 -35.14835 2.57552 2.12382 -36.10840 914.69078
3490.0000 -37.54961 -35.86799 1.68162 2.21869 -35.48117 1008.52524
3495.0000 -38.15859 -36.20762 1.95097 2.08872 -36.34047 897.26093
3500.0000 -38.26292 -36.05452 2.20841 2.07255 -36.44735 819.59274
FREEZING PROCESS: loop number 15 T-loop= 916.00000000000000
main_MD> interactions number 15 at Temperature= 916.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.82631 3.10338 -4.51772
force_rgl> df(natom) -0.96030 0.52872 -5.71582
3505.0000 -37.74898 -35.54184 2.20714 2.11335 -36.17763 877.96286
3510.0000 -38.28951 -35.59091 2.69860 2.20003 -35.60455 1028.40562
3515.0000 -37.64821 -35.62546 2.02276 2.20977 -35.54014 1045.54025
3520.0000 -38.02873 -36.00817 2.02056 2.14168 -35.99034 963.80165
3525.0000 -38.02565 -35.54537 2.48027 2.16353 -35.84584 930.81145
3530.0000 -37.57424 -35.30584 2.26840 2.21866 -35.48137 1006.42851
3535.0000 -38.22390 -35.96392 2.25998 2.20473 -35.57344 936.43778
3540.0000 -37.57434 -35.29034 2.28400 2.20132 -35.59599 1035.60240
3545.0000 -37.64188 -35.60521 2.03667 2.25233 -35.25872 1067.74976
3550.0000 -37.39348 -35.73326 1.66022 2.20154 -35.59453 993.18515
3555.0000 -36.79262 -35.11668 1.67594 2.27826 -35.08730 1019.67576
3560.0000 -37.40789 -35.60720 1.80069 2.28317 -35.05485 1067.93417
3565.0000 -38.30089 -36.68320 1.61769 2.15601 -35.89557 897.60062
3570.0000 -38.07108 -36.14867 1.92241 2.13389 -36.04179 878.36023
3575.0000 -38.57779 -36.36472 2.21307 2.10731 -36.21754 840.90058
3580.0000 -38.35208 -36.50911 1.84298 2.12035 -36.13136 904.52471
3585.0000 -38.87621 -37.24748 1.62873 2.00744 -36.87781 799.12889
3590.0000 -38.89126 -37.09796 1.79330 1.98542 -37.02340 792.43177
3595.0000 -38.81385 -36.28421 2.52963 2.05607 -36.55632 804.02695
3600.0000 -37.58645 -36.05319 1.53325 2.13886 -36.00897 937.50573
3605.0000 -37.93936 -36.04519 1.89418 2.14018 -36.00024 896.62306
3610.0000 -37.18113 -34.98967 2.19145 2.19876 -35.61289 956.88255
3615.0000 -38.03438 -35.67645 2.35793 2.24488 -35.30803 991.38974
3620.0000 -37.97267 -36.33195 1.64071 2.17100 -35.79648 923.84305
3625.0000 -37.93002 -36.05782 1.87221 2.08753 -36.34831 816.49008
3630.0000 -38.77869 -36.46114 2.31756 2.11046 -36.19673 901.20398
3635.0000 -38.32126 -36.53942 1.78184 2.02340 -36.77234 829.11966
3640.0000 -37.74663 -35.52642 2.22021 2.11238 -36.18401 884.59576
3645.0000 -37.98889 -35.42412 2.56477 2.21102 -35.53188 1058.39154
3650.0000 -37.81371 -35.51329 2.30042 2.23811 -35.35278 990.70328
3655.0000 -37.85116 -35.27509 2.57606 2.27878 -35.08387 999.40269
3660.0000 -37.70015 -34.78750 2.91264 2.27589 -35.10297 999.43682
3665.0000 -38.37164 -36.36377 2.00787 2.21260 -35.52143 975.69648
3670.0000 -37.30254 -35.71340 1.58914 2.10340 -36.24337 833.53163
3675.0000 -37.50529 -35.49919 2.00609 2.21994 -35.47288 877.40565
3680.0000 -37.24563 -35.34683 1.89880 2.24552 -35.30375 948.05204
3685.0000 -37.39325 -34.78047 2.61277 2.22329 -35.45075 925.04900
3690.0000 -37.05412 -35.12121 1.93291 2.30297 -34.92396 1058.87981
3695.0000 -36.97030 -34.88765 2.08265 2.30448 -34.91397 987.82833
3700.0000 -37.28477 -35.65627 1.62851 2.22871 -35.41489 947.03729
3705.0000 -37.11992 -35.15367 1.96625 2.23158 -35.39593 1043.96328
3710.0000 -37.24679 -34.39638 2.85041 2.32376 -34.78647 1122.27314
3715.0000 -37.35979 -34.98539 2.37440 2.39201 -34.33527 1142.73652
3720.0000 -37.28426 -35.41540 1.86887 2.28646 -35.03310 1053.32314
3725.0000 -37.81123 -35.43322 2.37801 2.21339 -35.51622 915.17975
3730.0000 -37.81389 -35.57183 2.24205 2.17116 -35.79542 967.59004
3735.0000 -38.43957 -36.99379 1.44578 2.13744 -36.01833 906.79715
3740.0000 -38.55544 -37.14243 1.41301 1.97779 -37.07388 756.34677
3745.0000 -38.21479 -36.64812 1.56667 2.03906 -36.66879 824.87217
3750.0000 -37.93818 -35.69358 2.24459 2.11896 -36.14051 878.55291
FREEZING PROCESS: loop number 16 T-loop= 891.00000000000000
main_MD> interactions number 16 at Temperature= 891.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.91326 -0.44782 0.56177
force_rgl> df(natom) 2.36413 -1.67021 -0.93323
3755.0000 -37.64858 -36.16862 1.47996 2.11893 -36.14073 886.84816
3760.0000 -38.76280 -36.60079 2.16202 2.07581 -36.42582 862.87782
3765.0000 -38.21814 -36.80659 1.41155 2.00543 -36.89109 810.62918
3770.0000 -37.94302 -35.85331 2.08971 2.10632 -36.22408 838.24540
3775.0000 -38.36370 -35.87494 2.48876 2.14532 -35.96624 949.96563
3780.0000 -38.59378 -36.84586 1.74792 2.08736 -36.34943 861.07587
3785.0000 -38.04457 -36.32671 1.71786 2.11792 -36.14738 881.08602
3790.0000 -38.42467 -36.84991 1.57476 2.06149 -36.52047 892.06741
3795.0000 -38.01329 -36.60226 1.41103 2.05276 -36.57822 754.67488
3800.0000 -38.64047 -36.44396 2.19651 2.09431 -36.30349 826.25928
3805.0000 -38.31749 -36.69958 1.61791 2.10885 -36.20739 918.82099
3810.0000 -38.26805 -35.91869 2.34936 2.07900 -36.40471 861.45633
3815.0000 -38.76517 -36.81942 1.94575 2.12331 -36.11178 956.91429
3820.0000 -37.73863 -36.28710 1.45153 2.08526 -36.36331 854.76327
3825.0000 -38.74139 -37.12188 1.61951 1.99180 -36.98126 760.99788
3830.0000 -38.46211 -36.68483 1.77728 2.05413 -36.56911 837.74330
3835.0000 -38.57797 -36.71048 1.86749 2.07911 -36.40401 841.08359
3840.0000 -38.85992 -36.97254 1.88738 2.02232 -36.77947 791.65596
3845.0000 -38.83462 -36.98316 1.85146 2.01726 -36.81291 831.56462
3850.0000 -37.89757 -36.19692 1.70064 2.02943 -36.73241 791.84587
3855.0000 -38.72337 -36.64779 2.07558 2.09250 -36.31544 884.34306
3860.0000 -38.34041 -36.15316 2.18725 2.05639 -36.55419 842.69855
3865.0000 -38.16063 -36.59195 1.56868 2.07036 -36.46181 851.75232
3870.0000 -38.71772 -36.62839 2.08933 2.03256 -36.71178 833.24273
3875.0000 -38.28900 -36.07074 2.21825 2.06030 -36.52833 851.09722
3880.0000 -38.40403 -36.78434 1.61968 2.04922 -36.60160 843.04362
3885.0000 -38.07469 -36.24266 1.83203 2.09125 -36.32369 828.53476
3890.0000 -38.43714 -36.30901 2.12813 2.10312 -36.24524 934.46185
3895.0000 -38.59861 -36.54012 2.05850 2.12596 -36.09423 919.99936
3900.0000 -38.68451 -36.80365 1.88086 2.04418 -36.63495 782.18176
3905.0000 -38.96711 -37.12821 1.83891 2.00852 -36.87070 812.03118
3910.0000 -38.40893 -36.58246 1.82646 2.02047 -36.79169 747.01019
3915.0000 -38.39093 -36.10954 2.28139 2.09498 -36.29909 894.96235
3920.0000 -37.93011 -35.97157 1.95855 2.16131 -35.86049 1019.72189
3925.0000 -38.55682 -36.66521 1.89161 2.07733 -36.41573 865.18743
3930.0000 -38.47361 -36.79540 1.67821 1.99726 -36.94516 738.08257
3935.0000 -38.34529 -36.59731 1.74798 2.07940 -36.40206 861.42508
3940.0000 -38.38038 -36.84306 1.53731 2.03393 -36.70270 836.52410
3945.0000 -38.52945 -36.61105 1.91841 2.13674 -36.02294 917.54494
3950.0000 -38.70166 -36.88053 1.82112 1.99709 -36.94629 779.47420
3955.0000 -38.93308 -37.53680 1.39628 1.94409 -37.29669 733.81687
3960.0000 -38.78370 -37.74557 1.03813 1.93481 -37.35805 677.51645
3965.0000 -38.82167 -37.25418 1.56748 2.00934 -36.86525 812.27445
3970.0000 -38.45030 -37.08707 1.36322 1.94086 -37.31800 718.01067
3975.0000 -38.50951 -37.11735 1.39216 1.92892 -37.39695 656.48855
3980.0000 -38.49846 -36.30166 2.19680 2.06191 -36.51769 861.89078
3985.0000 -37.67645 -35.75353 1.92292 2.10007 -36.26540 918.51859
3990.0000 -37.75754 -35.99655 1.76098 2.14896 -35.94215 962.97894
3995.0000 -37.71578 -35.38684 2.32894 2.18172 -35.72557 931.64977
4000.0000 -38.17955 -36.08882 2.09073 2.21423 -35.51065 1040.09977
FREEZING PROCESS: loop number 17 T-loop= 866.00000000000000
main_MD> interactions number 17 at Temperature= 866.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.41470 -0.77531 -0.36633
force_rgl> df(natom) -1.24179 -0.78341 0.83074
4005.0000 -38.16823 -36.50618 1.66205 2.13124 -36.05934 921.40591
4010.0000 -38.29585 -36.72134 1.57450 2.04932 -36.60093 808.83272
4015.0000 -38.74924 -36.53953 2.20971 2.05942 -36.53416 858.58542
4020.0000 -37.60652 -35.97460 1.63192 2.09769 -36.28117 859.77216
4025.0000 -37.18340 -35.48662 1.69678 2.19301 -35.65096 936.42087
4030.0000 -37.26718 -35.21122 2.05596 2.31543 -34.84155 1048.23962
4035.0000 -38.34416 -35.80621 2.53795 2.23844 -35.35057 989.82881
4040.0000 -37.26866 -35.29511 1.97355 2.16512 -35.83532 1014.19690
4045.0000 -37.81032 -34.97057 2.83975 2.20044 -35.60181 936.94814
4050.0000 -37.75299 -35.66020 2.09279 2.27843 -35.08617 1007.60281
4055.0000 -38.21461 -37.02283 1.19178 2.11773 -36.14866 913.46901
4060.0000 -38.88259 -36.48768 2.39491 2.07947 -36.40163 873.55558
4065.0000 -37.85606 -36.26263 1.59343 2.11074 -36.19486 895.77830
4070.0000 -37.40493 -34.92754 2.47739 2.12286 -36.11471 847.24027
4075.0000 -37.93014 -36.14675 1.78339 2.24880 -35.28206 1052.36555
4080.0000 -38.17280 -35.88493 2.28787 2.06548 -36.49412 831.09348
4085.0000 -38.21958 -36.29025 1.92933 2.13239 -36.05171 980.73006
4090.0000 -38.28918 -36.60352 1.68566 2.07024 -36.46261 912.53786
4095.0000 -37.41939 -35.52521 1.89418 2.09312 -36.31136 922.72066
4100.0000 -38.28471 -35.39919 2.88552 2.23718 -35.35889 962.23574
4105.0000 -37.57560 -36.06085 1.51476 2.12040 -36.13098 917.56837
4110.0000 -37.76170 -35.76896 1.99274 2.12848 -36.07758 888.96507
4115.0000 -38.32765 -35.61041 2.71724 2.20489 -35.57239 1036.68699
4120.0000 -38.01010 -36.05932 1.95079 2.21370 -35.51418 1009.55652
4125.0000 -37.43240 -35.26161 2.17080 2.23836 -35.35109 1032.49101
4130.0000 -38.59881 -35.89184 2.70696 2.19935 -35.60901 994.40843
4135.0000 -38.87654 -37.25132 1.62522 2.06381 -36.50516 818.36376
4140.0000 -37.77521 -36.28882 1.48639 2.04170 -36.65135 829.55932
4145.0000 -38.88253 -36.81816 2.06437 2.03095 -36.72238 817.65880
4150.0000 -38.26307 -36.46193 1.80114 2.06152 -36.52030 865.17190
4155.0000 -38.83799 -36.85431 1.98368 1.96792 -37.13909 721.01055
4160.0000 -38.25805 -36.67829 1.57977 1.97658 -37.08183 714.20760
4165.0000 -37.39415 -35.80700 1.58714 2.06741 -36.48132 850.04443
4170.0000 -38.04408 -35.75941 2.28467 2.21336 -35.51641 1044.57766
4175.0000 -37.39623 -35.48532 1.91091 2.20619 -35.56381 957.02982
4180.0000 -37.72730 -35.78479 1.94251 2.15619 -35.89437 953.23574
4185.0000 -37.65508 -34.67514 2.97994 2.22084 -35.46691 984.31638
4190.0000 -37.85494 -34.81721 3.03773 2.30736 -34.89489 1130.02778
4195.0000 -37.79121 -35.61861 2.17260 2.31692 -34.83172 1056.24547
4200.0000 -37.53189 -35.41563 2.11627 2.11124 -36.19155 904.90854
4205.0000 -37.70273 -35.91046 1.79227 2.20655 -35.56141 925.71114
4210.0000 -38.70654 -37.20221 1.50433 2.04187 -36.65018 804.04413
4215.0000 -38.77948 -36.97011 1.80937 1.97375 -37.10055 728.14181
4220.0000 -38.13217 -35.96152 2.17065 2.10336 -36.24363 887.61510
4225.0000 -37.83079 -35.69372 2.13707 2.22435 -35.44373 1042.29862
4230.0000 -38.67818 -37.21279 1.46539 2.09474 -36.30066 901.37490
4235.0000 -38.61339 -36.85406 1.75933 2.01431 -36.83243 828.09058
4240.0000 -38.29357 -36.95877 1.33480 2.04507 -36.62904 828.56652
4245.0000 -37.89112 -36.05654 1.83457 2.05670 -36.55216 815.78893
4250.0000 -37.55595 -35.74152 1.81443 2.14608 -35.96124 902.86571
FREEZING PROCESS: loop number 18 T-loop= 841.00000000000000
main_MD> interactions number 18 at Temperature= 841.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.00957 2.37564 0.47399
force_rgl> df(natom) 2.05097 0.60344 -1.61972
4255.0000 -37.40686 -35.24742 2.15944 2.22216 -35.45824 954.38151
4260.0000 -37.69564 -36.03508 1.66056 2.23184 -35.39421 954.42978
4265.0000 -37.93341 -36.64346 1.28995 2.04708 -36.61577 692.29692
4270.0000 -38.48387 -36.32165 2.16221 2.07933 -36.40251 812.81398
4275.0000 -38.06624 -36.27374 1.79250 2.08737 -36.34936 899.94742
4280.0000 -38.39100 -36.78422 1.60678 2.04063 -36.65837 782.92747
4285.0000 -38.82927 -36.94279 1.88648 1.98695 -37.01329 773.29866
4290.0000 -39.19834 -37.60915 1.58919 1.96692 -37.14574 741.48370
4295.0000 -38.47125 -36.59735 1.87390 1.97524 -37.09070 715.54362
4300.0000 -37.85503 -36.35303 1.50200 2.09282 -36.31333 917.76667
4305.0000 -38.35742 -36.15226 2.20516 2.08919 -36.33733 881.33897
4310.0000 -37.41772 -36.17401 1.24371 2.10041 -36.26315 881.13134
4315.0000 -38.43587 -36.73726 1.69862 2.10756 -36.21587 812.27741
4320.0000 -38.51099 -37.40161 1.10938 1.98162 -37.04852 767.00543
4325.0000 -38.97596 -37.13055 1.84540 1.97286 -37.10644 729.60123
4330.0000 -38.52982 -36.84751 1.68231 1.96253 -37.17475 727.78911
4335.0000 -39.21997 -36.66577 2.55421 2.04277 -36.64428 789.78336
4340.0000 -38.23482 -36.24583 1.98900 2.09230 -36.31675 892.33066
4345.0000 -37.53549 -35.63830 1.89720 2.16437 -35.84027 941.82556
4350.0000 -38.28130 -36.50849 1.77281 2.18605 -35.69697 959.74942
4355.0000 -37.64127 -35.64488 1.99639 2.09718 -36.28451 863.66956
4360.0000 -37.38765 -35.38900 1.99866 2.19458 -35.64059 971.71429
4365.0000 -37.87681 -35.64808 2.22873 2.23144 -35.39684 1029.42066
4370.0000 -38.60453 -36.22202 2.38251 2.09348 -36.30895 925.62728
4375.0000 -37.87131 -35.99110 1.88021 2.16362 -35.84522 966.04486
4380.0000 -38.43652 -36.41635 2.02018 2.09063 -36.32779 822.93159
4385.0000 -38.47023 -36.59704 1.87319 2.08357 -36.37453 905.36902
4390.0000 -37.62911 -35.41781 2.21130 2.19117 -35.66309 886.20961
4395.0000 -37.88231 -35.45428 2.42803 2.24737 -35.29153 1044.15981
4400.0000 -38.88529 -36.97478 1.91051 2.05141 -36.58714 843.29342
4405.0000 -39.34918 -37.15852 2.19066 1.98552 -37.02276 748.23698
4410.0000 -38.43486 -36.60950 1.82536 1.95285 -37.23872 664.30461
4415.0000 -38.59866 -36.58346 2.01520 2.07262 -36.44691 873.83163
4420.0000 -38.18208 -35.91130 2.27077 2.07025 -36.46254 870.25163
4425.0000 -38.57170 -35.94618 2.62552 2.16416 -35.84167 1006.50885
4430.0000 -38.02161 -36.15547 1.86614 2.03665 -36.68470 838.03342
4435.0000 -37.84583 -35.69470 2.15113 2.14043 -35.99857 946.78727
4440.0000 -38.42627 -36.08312 2.34315 2.15346 -35.91239 946.34574
4445.0000 -38.31263 -36.75189 1.56074 2.08930 -36.33660 893.26987
4450.0000 -38.56909 -36.64648 1.92262 2.07035 -36.46190 865.26569
4455.0000 -38.90640 -37.38257 1.52383 1.98509 -37.02558 703.66600
4460.0000 -38.70037 -36.65557 2.04481 2.00877 -36.86903 802.89561
4465.0000 -38.84990 -37.66907 1.18083 1.96425 -37.16341 744.92223
4470.0000 -38.97914 -37.51868 1.46046 1.92995 -37.39014 699.71847
4475.0000 -39.02267 -36.61001 2.41266 1.95797 -37.20491 733.31813
4480.0000 -38.46081 -36.76662 1.69419 2.01094 -36.85468 776.79284
4485.0000 -38.16122 -36.23671 1.92451 2.08092 -36.39202 833.13119
4490.0000 -37.95202 -35.59710 2.35492 2.15092 -35.92919 910.33164
4495.0000 -38.18522 -36.42209 1.76313 2.14944 -35.93902 947.02317
4500.0000 -37.94585 -36.46376 1.48209 2.05591 -36.55740 867.67598
FREEZING PROCESS: loop number 19 T-loop= 816.00000000000000
main_MD> interactions number 19 at Temperature= 816.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.15667 0.46551 0.64879
force_rgl> df(natom) -0.79849 0.58098 -0.20841
4505.0000 -38.71948 -36.40354 2.31594 2.05366 -36.57222 851.08411
4510.0000 -37.68432 -35.54504 2.13928 2.14584 -35.96281 898.28385
4515.0000 -37.27853 -35.01377 2.26476 2.27239 -35.12610 1006.63587
4520.0000 -38.28069 -35.96031 2.32038 2.18374 -35.71220 976.06863
4525.0000 -38.31193 -36.82620 1.48572 2.14342 -35.97880 906.38981
4530.0000 -38.66596 -37.17250 1.49346 2.02441 -36.76562 785.84444
4535.0000 -38.58383 -37.11387 1.46996 1.99507 -36.95961 749.54742
4540.0000 -38.53539 -36.86857 1.66682 1.95107 -37.25052 720.82752
4545.0000 -37.87697 -36.19342 1.68355 2.09520 -36.29762 871.97870
4550.0000 -38.57334 -36.20292 2.37042 2.10066 -36.26153 896.77075
4555.0000 -38.35309 -37.02004 1.33305 2.01726 -36.81293 779.89879
4560.0000 -38.82371 -37.08510 1.73861 2.00282 -36.90837 706.55175
4565.0000 -37.71537 -35.72512 1.99025 2.06399 -36.50398 760.78428
4570.0000 -37.93906 -35.88097 2.05809 2.18782 -35.68526 995.63951
4575.0000 -38.15422 -36.82800 1.32622 2.03652 -36.68555 785.67846
4580.0000 -38.23502 -36.81060 1.42442 2.01089 -36.85502 745.77074
4585.0000 -39.10676 -37.12262 1.98415 1.98977 -36.99463 741.02100
4590.0000 -39.04792 -37.46020 1.58772 1.96097 -37.18504 714.14851
4595.0000 -38.30587 -36.63222 1.67365 2.00717 -36.87964 813.56561
4600.0000 -39.15239 -36.70517 2.44722 2.02974 -36.73040 825.85479
4605.0000 -38.33326 -36.50174 1.83151 2.07541 -36.42847 876.75606
4610.0000 -39.10841 -36.97649 2.13192 2.06420 -36.50258 829.61366
4615.0000 -37.83627 -36.39811 1.43816 2.07526 -36.42944 862.18370
4620.0000 -38.36656 -35.89051 2.47606 2.09612 -36.29151 779.82418
4625.0000 -38.75948 -37.25417 1.50531 2.07097 -36.45778 789.46708
4630.0000 -38.10658 -36.65479 1.45179 2.00024 -36.92543 792.23035
4635.0000 -38.85405 -37.55320 1.30086 2.00598 -36.88749 792.35934
4640.0000 -38.68067 -37.44460 1.23607 1.94597 -37.28422 673.21834
4645.0000 -37.87657 -35.80099 2.07558 1.96538 -37.15588 718.34245
4650.0000 -38.02191 -35.95362 2.06829 2.13627 -36.02607 894.31131
4655.0000 -38.18854 -36.01529 2.17325 2.10364 -36.24182 901.29659
4660.0000 -38.33475 -36.19362 2.14114 2.11545 -36.16370 868.57575
4665.0000 -37.97504 -36.11590 1.85914 2.09670 -36.28768 867.94824
4670.0000 -37.87161 -35.57807 2.29354 2.09198 -36.31892 872.10450
4675.0000 -36.78969 -34.00543 2.78426 2.27818 -35.08783 995.66264
4680.0000 -38.19940 -36.08086 2.11854 2.27667 -35.09782 1098.68922
4685.0000 -38.09183 -36.62839 1.46344 2.12829 -36.07882 902.16662
4690.0000 -39.00256 -37.00978 1.99278 1.98943 -36.99691 748.40502
4695.0000 -38.73641 -36.80010 1.93632 2.01348 -36.83791 761.85484
4700.0000 -37.94673 -35.54041 2.40631 2.15632 -35.89351 968.85468
4705.0000 -38.03403 -35.91604 2.11798 2.11461 -36.16926 835.42043
4710.0000 -38.14014 -35.90818 2.23196 2.12527 -36.09881 926.29858
4715.0000 -37.98557 -36.13620 1.84938 2.08476 -36.36662 837.89440
4720.0000 -38.82791 -37.13886 1.68906 2.03200 -36.71543 853.11462
4725.0000 -38.13881 -36.78942 1.34939 1.99415 -36.96572 796.72482
4730.0000 -38.12037 -36.39375 1.72662 2.01661 -36.81720 787.21849
4735.0000 -38.75500 -37.47997 1.27502 2.01464 -36.83020 761.32645
4740.0000 -38.42295 -37.19177 1.23118 1.94318 -37.30270 668.80608
4745.0000 -38.63777 -36.52044 2.11732 2.03911 -36.66842 835.20254
4750.0000 -39.04252 -37.01035 2.03217 2.07938 -36.40221 837.91331
FREEZING PROCESS: loop number 20 T-loop= 791.00000000000000
main_MD> interactions number 20 at Temperature= 791.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.44235 -0.38521 -0.70707
force_rgl> df(natom) 0.17731 -1.50499 0.13401
4755.0000 -38.32356 -36.80565 1.51791 2.00887 -36.86835 818.28384
4760.0000 -38.28540 -36.39274 1.89266 2.06119 -36.52248 801.27199
4765.0000 -38.53040 -36.34052 2.18987 2.06244 -36.51422 860.05210
4770.0000 -37.94795 -36.56509 1.38286 2.00669 -36.88277 759.56128
4775.0000 -38.52216 -36.92692 1.59523 2.02286 -36.77590 797.63450
4780.0000 -38.17134 -36.99038 1.18096 2.03532 -36.69350 821.39771
4785.0000 -38.18783 -36.42424 1.76360 2.03091 -36.72265 802.86402
4790.0000 -38.08234 -36.55245 1.52989 2.01547 -36.82476 753.12754
4795.0000 -38.94121 -37.78875 1.15246 1.94431 -37.29525 663.76285
4800.0000 -38.29337 -36.65539 1.63798 1.91400 -37.49559 636.36542
4805.0000 -38.61730 -37.22599 1.39131 1.99721 -36.94547 765.17465
4810.0000 -38.50947 -37.51124 0.99823 1.92663 -37.41211 655.26366
4815.0000 -38.54277 -36.83333 1.70944 1.92933 -37.39425 693.51151
4820.0000 -38.18691 -36.19186 1.99506 2.05297 -36.57678 854.82059
4825.0000 -38.58563 -36.82896 1.75667 2.08745 -36.34884 866.88872
4830.0000 -38.91214 -37.40268 1.50946 2.00404 -36.90032 809.51346
4835.0000 -38.88905 -37.50867 1.38038 1.92704 -37.40938 685.31937
4840.0000 -38.40536 -36.24620 2.15916 2.01813 -36.80713 769.71337
4845.0000 -38.47507 -37.01869 1.45638 2.04290 -36.64342 808.43743
4850.0000 -38.06560 -36.16632 1.89928 2.09661 -36.28829 830.86216
4855.0000 -38.36576 -36.77315 1.59261 2.03706 -36.68201 809.46266
4860.0000 -38.91886 -37.37994 1.53893 1.99515 -36.95908 753.62232
4865.0000 -38.92846 -38.02544 0.90301 1.86690 -37.80702 623.25429
4870.0000 -39.10261 -37.50831 1.59430 1.89563 -37.61706 665.10436
4875.0000 -38.89912 -37.47181 1.42731 1.93281 -37.37123 656.64500
4880.0000 -38.90390 -37.68548 1.21841 1.88332 -37.69845 601.95183
4885.0000 -38.87278 -37.51593 1.35685 1.88184 -37.70824 596.98778
4890.0000 -39.15583 -37.96633 1.18950 1.94006 -37.32335 717.38554
4895.0000 -39.13237 -37.80750 1.32487 1.86811 -37.79903 594.93269
4900.0000 -39.39039 -37.46967 1.92072 1.86804 -37.79945 599.80453
4905.0000 -39.17068 -38.18002 0.99065 1.86483 -37.82071 621.81276
4910.0000 -39.17890 -37.67276 1.50614 1.85330 -37.89691 584.79914
4915.0000 -38.82498 -37.57847 1.24650 1.94042 -37.32093 690.72316
4920.0000 -38.81297 -37.82297 0.99000 1.96519 -37.15715 754.38940
4925.0000 -39.50083 -37.51365 1.98719 1.88642 -37.67792 606.47491
4930.0000 -38.83812 -36.63708 2.20105 1.93853 -37.33341 727.57333
4935.0000 -38.43646 -36.82061 1.61585 2.04616 -36.62182 793.86541
4940.0000 -38.57480 -36.70284 1.87196 2.01137 -36.85183 771.64976
4945.0000 -38.67918 -36.90731 1.77187 2.06782 -36.47863 814.19470
4950.0000 -39.34105 -37.73973 1.60132 1.90410 -37.56108 673.95888
4955.0000 -38.58687 -36.26127 2.32561 1.94162 -37.31301 724.45741
4960.0000 -38.10399 -36.01968 2.08431 2.14627 -35.95998 942.03084
4965.0000 -38.64828 -36.79758 1.85070 2.02153 -36.78469 753.46068
4970.0000 -38.26399 -35.79484 2.46915 2.08316 -36.37719 911.10013
4975.0000 -37.30685 -34.84606 2.46079 2.21404 -35.51191 1084.79278
4980.0000 -37.73378 -35.88463 1.84914 2.25804 -35.22101 1027.64885
4985.0000 -39.05218 -36.76527 2.28691 2.09633 -36.29016 856.54746
4990.0000 -38.61965 -36.67489 1.94476 2.00526 -36.89224 759.42915
4995.0000 -38.03383 -36.75511 1.27872 2.02956 -36.73159 791.27643
5000.0000 -38.69798 -36.90215 1.79582 2.01723 -36.81311 792.09386
FREEZING PROCESS: loop number 21 T-loop= 766.00000000000000
main_MD> interactions number 21 at Temperature= 766.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.13942 1.29601 0.32232
force_rgl> df(natom) 0.37738 -0.73470 0.87616
5005.0000 -38.42533 -37.05248 1.37285 2.00470 -36.89593 731.23689
5010.0000 -38.30735 -36.43728 1.87007 1.96956 -37.12824 674.15475
5015.0000 -38.22885 -36.45740 1.77145 2.09084 -36.32642 866.88223
5020.0000 -38.86520 -36.91130 1.95390 2.02525 -36.76008 755.45791
5025.0000 -38.08047 -36.49838 1.58209 2.03185 -36.71642 771.52982
5030.0000 -38.45509 -36.43441 2.02068 2.07841 -36.40863 871.84958
5035.0000 -37.94214 -36.45729 1.48485 2.08530 -36.36304 827.06142
5040.0000 -38.73548 -37.13006 1.60542 2.01145 -36.85132 786.28143
5045.0000 -38.76254 -37.39299 1.36955 1.99488 -36.96086 728.05355
5050.0000 -39.10144 -37.94204 1.15939 1.88385 -37.69494 618.58095
5055.0000 -39.56146 -38.09692 1.46454 1.83603 -38.01108 529.22390
5060.0000 -38.88508 -37.17022 1.71486 1.89584 -37.61567 597.63141
5065.0000 -38.82940 -37.36566 1.46374 1.95165 -37.24669 670.71192
5070.0000 -39.01599 -37.52065 1.49534 1.95621 -37.21653 691.79938
5075.0000 -39.48278 -38.09479 1.38799 1.91530 -37.48700 692.03353
5080.0000 -39.03056 -36.93222 2.09834 1.90569 -37.55055 670.11213
5085.0000 -38.58833 -37.15328 1.43505 1.94509 -37.29006 709.51001
5090.0000 -38.65072 -36.42813 2.22258 1.98958 -36.99591 746.99469
5095.0000 -38.51145 -37.29570 1.21575 2.05017 -36.59534 823.47234
5100.0000 -38.76824 -37.31616 1.45208 1.97155 -37.11513 726.31382
5105.0000 -39.29471 -37.81466 1.48006 1.90528 -37.55323 630.69486
5110.0000 -38.52151 -37.48775 1.03377 1.87545 -37.75050 601.21445
5115.0000 -38.60551 -36.25592 2.34958 2.01031 -36.85885 797.61613
5120.0000 -38.18662 -36.64567 1.54095 2.06454 -36.50029 822.41506
5125.0000 -38.35412 -36.73192 1.62220 2.05353 -36.57310 843.23732
5130.0000 -38.68467 -37.18855 1.49611 2.02764 -36.74425 790.87600
5135.0000 -38.94942 -37.18820 1.76122 1.98181 -37.04731 700.28393
5140.0000 -38.74443 -37.45213 1.29230 1.99951 -36.93027 838.06235
5145.0000 -39.45538 -38.02089 1.43449 1.86999 -37.78658 640.61933
5150.0000 -38.74861 -37.38151 1.36709 1.91918 -37.46138 658.87842
5155.0000 -39.10731 -37.94376 1.16354 1.90787 -37.53616 639.85042
5160.0000 -39.25568 -38.23429 1.02139 1.85966 -37.85489 571.48633
5165.0000 -39.11132 -37.51069 1.60063 1.92050 -37.45263 699.51670
5170.0000 -38.69502 -37.28415 1.41087 1.98732 -37.01087 764.35132
5175.0000 -38.99470 -37.60344 1.39126 1.93701 -37.34350 692.07691
5180.0000 -38.02580 -37.02648 0.99931 1.88943 -37.65802 649.64802
5185.0000 -37.85516 -36.66578 1.18938 2.05201 -36.58315 799.12222
5190.0000 -38.48818 -37.05873 1.42945 2.03534 -36.69337 799.71977
5195.0000 -39.06246 -36.81460 2.24786 1.99134 -36.98425 766.27854
5200.0000 -38.38779 -36.35440 2.03339 2.03295 -36.70921 830.00043
5205.0000 -37.15081 -35.55716 1.59365 2.09937 -36.27003 840.48062
5210.0000 -37.72362 -35.33349 2.39013 2.18281 -35.71839 899.87389
5215.0000 -37.77153 -36.05899 1.71254 2.19752 -35.62110 944.31762
5220.0000 -37.49732 -35.49403 2.00328 2.19023 -35.66930 1000.84693
5225.0000 -38.42717 -36.50395 1.92322 2.11949 -36.13703 919.39730
5230.0000 -39.46072 -38.28024 1.18048 1.89779 -37.60276 619.34417
5235.0000 -39.01775 -37.54200 1.47575 1.82893 -38.05804 583.95231
5240.0000 -39.19418 -37.81908 1.37510 1.90495 -37.55547 683.74622
5245.0000 -39.01034 -37.56107 1.44927 1.89704 -37.60774 660.61534
5250.0000 -39.04865 -37.74932 1.29932 1.90943 -37.52584 691.69678
FREEZING PROCESS: loop number 22 T-loop= 741.00000000000000
main_MD> interactions number 22 at Temperature= 741.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.79812 1.77813 2.97868
force_rgl> df(natom) -0.03470 -1.67910 0.43390
5255.0000 -39.47289 -38.13828 1.33462 1.86256 -37.83572 609.33596
5260.0000 -38.91058 -37.41005 1.50053 1.86484 -37.82066 620.56037
5265.0000 -38.94947 -37.62656 1.32291 1.91632 -37.48024 663.86968
5270.0000 -38.55613 -37.28630 1.26983 1.92693 -37.41011 699.67178
5275.0000 -39.13263 -37.11543 2.01720 2.01527 -36.82606 840.91701
5280.0000 -38.74609 -36.76620 1.97990 1.96582 -37.15297 734.85895
5285.0000 -38.75555 -37.34264 1.41292 2.00890 -36.86819 809.35201
5290.0000 -39.01598 -37.21632 1.79966 1.97691 -37.07969 774.40922
5295.0000 -38.92032 -37.33688 1.58344 1.97456 -37.09525 765.97237
5300.0000 -37.93005 -36.41847 1.51157 1.98296 -37.03969 708.34887
5305.0000 -37.79284 -35.47895 2.31389 2.18626 -35.69554 886.50794
5310.0000 -38.64943 -36.60000 2.04943 2.12532 -36.09847 875.94180
5315.0000 -38.39715 -36.50104 1.89611 2.03673 -36.68419 799.20409
5320.0000 -38.50412 -37.24791 1.25621 1.99145 -36.98354 729.31819
5325.0000 -38.47957 -37.12591 1.35366 1.94393 -37.29774 691.76530
5330.0000 -38.78297 -37.47781 1.30517 1.98696 -37.01327 756.38395
5335.0000 -39.82122 -37.66467 2.15655 1.92817 -37.40196 685.44048
5340.0000 -38.97366 -37.50310 1.47056 1.91680 -37.47713 691.62471
5345.0000 -38.07720 -36.60253 1.47468 2.04370 -36.63811 807.90122
5350.0000 -38.87713 -36.42604 2.45109 2.06521 -36.49588 828.48441
5355.0000 -38.13609 -36.64374 1.49235 2.09519 -36.29766 868.43937
5360.0000 -38.22052 -36.65821 1.56232 2.05583 -36.55788 799.68021
5365.0000 -38.71968 -37.01672 1.70296 2.03987 -36.66340 777.89230
5370.0000 -38.72207 -37.01918 1.70289 1.95195 -37.24470 692.93122
5375.0000 -37.97306 -36.00939 1.96367 2.04703 -36.61607 863.25980
5380.0000 -38.32742 -36.45964 1.86779 2.11126 -36.19140 904.33572
5385.0000 -38.24779 -36.43799 1.80981 2.12882 -36.07536 901.24089
5390.0000 -38.89018 -37.16008 1.73010 2.02936 -36.73291 811.26428
5395.0000 -38.44851 -37.13986 1.30865 1.98643 -37.01673 786.06811
5400.0000 -39.15219 -37.75979 1.39240 1.96447 -37.16192 749.23150
5405.0000 -38.60946 -36.91897 1.69049 1.98693 -37.01341 756.34076
5410.0000 -38.24832 -36.60726 1.64106 1.96602 -37.15166 739.73558
5415.0000 -38.69821 -37.28374 1.41447 2.04774 -36.61139 837.03593
5420.0000 -39.06011 -37.03079 2.02933 2.06525 -36.49562 875.31174
5425.0000 -38.60950 -37.09841 1.51109 1.94588 -37.28482 723.40921
5430.0000 -38.50203 -37.42474 1.07729 1.94960 -37.26024 664.54080
5435.0000 -39.07916 -37.88141 1.19775 1.91301 -37.50213 682.45378
5440.0000 -39.37190 -37.75080 1.62110 1.87361 -37.76267 638.37964
5445.0000 -38.77619 -36.65898 2.11722 1.93654 -37.34658 709.97604
5450.0000 -38.47984 -36.77127 1.70857 2.03595 -36.68933 838.02111
5455.0000 -38.60557 -36.66517 1.94041 2.01961 -36.79737 773.74497
5460.0000 -38.26154 -36.67257 1.58897 2.01590 -36.82191 789.42422
5465.0000 -38.59065 -36.91416 1.67649 1.98413 -37.03197 742.68787
5470.0000 -38.74184 -37.24361 1.49824 1.99029 -36.99119 796.52450
5475.0000 -38.73369 -36.95293 1.78076 1.97745 -37.07613 755.78775
5480.0000 -39.28005 -37.49843 1.78163 1.92843 -37.40022 711.77849
5485.0000 -38.78077 -37.23942 1.54136 1.95696 -37.21160 678.41113
5490.0000 -38.64304 -37.40511 1.23793 1.97247 -37.10906 703.30209
5495.0000 -38.50670 -37.08110 1.42559 1.94978 -37.25902 662.18534
5500.0000 -38.47595 -36.44224 2.03370 2.03970 -36.66454 827.03629
FREEZING PROCESS: loop number 23 T-loop= 716.00000000000000
main_MD> interactions number 23 at Temperature= 716.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.13669 -2.81626 0.57614
force_rgl> df(natom) -1.02960 -1.44310 -1.33731
5505.0000 -38.80419 -36.37514 2.42905 2.07719 -36.41666 862.62093
5510.0000 -38.89988 -37.20107 1.69881 1.98527 -37.02439 755.15962
5515.0000 -39.10390 -36.91850 2.18540 1.95911 -37.19734 753.00196
5520.0000 -38.56511 -36.98158 1.58354 1.99389 -36.96745 763.29504
5525.0000 -39.04842 -37.31824 1.73018 1.95975 -37.19312 724.05632
5530.0000 -39.06778 -36.81717 2.25061 1.99818 -36.93907 811.12456
5535.0000 -38.41440 -37.21601 1.19839 1.95390 -37.23182 752.24836
5540.0000 -38.53639 -37.56310 0.97329 1.97573 -37.08746 717.19766
5545.0000 -38.89508 -36.95514 1.93995 1.96765 -37.14091 729.62403
5550.0000 -39.09030 -37.58535 1.50496 1.95523 -37.22303 683.37626
5555.0000 -38.62154 -37.57303 1.04851 1.91737 -37.47332 666.62335
5560.0000 -38.76047 -37.04581 1.71466 1.91981 -37.45721 651.14614
5565.0000 -39.18834 -37.27224 1.91610 1.99187 -36.98077 773.88553
5570.0000 -38.80692 -37.33156 1.47536 1.94417 -37.29611 697.08852
5575.0000 -38.46839 -36.88716 1.58123 1.97026 -37.12363 739.82324
5580.0000 -38.61300 -37.06912 1.54388 1.97380 -37.10025 678.20144
5585.0000 -38.78326 -37.29362 1.48964 1.93979 -37.32513 649.61423
5590.0000 -39.38277 -37.64920 1.73357 1.92930 -37.39446 669.22976
5595.0000 -38.83604 -37.56949 1.26655 1.91180 -37.51017 647.26274
5600.0000 -39.12893 -37.59352 1.53541 1.90879 -37.53003 636.51346
5605.0000 -38.57037 -37.06017 1.51020 1.93324 -37.36843 678.78186
5610.0000 -38.42489 -36.89001 1.53488 1.97598 -37.08580 762.29177
5615.0000 -38.14322 -36.47831 1.66491 2.04025 -36.66092 825.46075
5620.0000 -38.33836 -36.68219 1.65618 2.01501 -36.82777 775.55373
5625.0000 -38.04453 -36.86975 1.17478 2.03599 -36.68909 816.06926
5630.0000 -38.18998 -36.51790 1.67208 2.01401 -36.83436 776.27106
5635.0000 -38.76053 -37.11011 1.65043 1.97788 -37.07329 725.73302
5640.0000 -38.89217 -37.41382 1.47836 1.88924 -37.65932 577.67655
5645.0000 -38.49053 -36.72229 1.76825 1.99871 -36.93553 810.27463
5650.0000 -38.41083 -36.43930 1.97153 2.06003 -36.53012 846.67488
5655.0000 -39.06843 -37.18819 1.88024 2.04374 -36.63787 832.14091
5660.0000 -38.64668 -37.56013 1.08655 1.91373 -37.49740 606.06949
5665.0000 -39.25831 -37.96920 1.28912 1.88164 -37.70953 600.81085
5670.0000 -38.76384 -37.52327 1.24057 1.87080 -37.78124 621.51028
5675.0000 -38.75215 -37.59977 1.15239 1.90606 -37.54814 654.47604
5680.0000 -39.40931 -38.23129 1.17803 1.83190 -38.03840 579.61244
5685.0000 -38.99844 -37.70772 1.29072 1.87782 -37.73482 613.12842
5690.0000 -38.69047 -37.51967 1.17080 1.88939 -37.65833 657.03109
5695.0000 -38.87432 -37.44372 1.43060 1.89125 -37.64600 633.45948
5700.0000 -39.06563 -37.77915 1.28647 1.87369 -37.76215 629.04086
5705.0000 -38.69223 -37.10012 1.59211 1.93464 -37.35915 754.11249
5710.0000 -38.80722 -36.91810 1.88913 2.01609 -36.82065 818.50042
5715.0000 -39.16963 -37.36747 1.80216 1.94310 -37.30322 692.50153
5720.0000 -38.61118 -37.14249 1.46870 1.89791 -37.60198 672.62090
5725.0000 -38.57056 -36.79471 1.77584 2.02021 -36.79341 772.59930
5730.0000 -38.97680 -37.09414 1.88265 1.95139 -37.24843 718.34876
5735.0000 -38.16781 -36.81113 1.35668 2.02408 -36.76779 785.14282
5740.0000 -38.50565 -36.62810 1.87754 2.03890 -36.66984 784.09991
5745.0000 -39.24756 -37.29392 1.95364 1.93470 -37.35874 715.75960
5750.0000 -39.33761 -37.87169 1.46592 1.92758 -37.40586 690.83635
FREEZING PROCESS: loop number 24 T-loop= 691.00000000000000
main_MD> interactions number 24 at Temperature= 691.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.39781 -1.26445 -5.23347
force_rgl> df(natom) 1.63498 -1.82111 0.50763
5755.0000 -39.16082 -37.59247 1.56835 1.86074 -37.84774 584.49830
5760.0000 -38.84633 -37.37419 1.47214 1.92275 -37.43775 664.94011
5765.0000 -38.42683 -36.55521 1.87162 2.00952 -36.86411 774.00044
5770.0000 -39.06633 -36.84379 2.22253 2.07379 -36.43918 783.87401
5775.0000 -38.64798 -36.85828 1.78970 1.98844 -37.00347 727.21002
5780.0000 -38.92316 -37.39586 1.52730 1.95453 -37.22761 716.31128
5785.0000 -38.89234 -37.65041 1.24193 1.90421 -37.56032 675.41602
5790.0000 -38.70936 -37.65031 1.05905 1.90579 -37.54986 664.75943
5795.0000 -38.76646 -37.07757 1.68889 1.87538 -37.75092 594.92007
5800.0000 -38.81356 -37.27502 1.53854 1.92978 -37.39128 695.70625
5805.0000 -38.99215 -36.72798 2.26416 2.00117 -36.91927 770.48747
5810.0000 -38.75837 -37.19790 1.56047 2.02464 -36.76410 797.99236
5815.0000 -38.54402 -37.10127 1.44275 1.94943 -37.26135 655.31373
5820.0000 -38.84475 -36.86275 1.98200 2.03689 -36.68315 818.96341
5825.0000 -38.19317 -36.48606 1.70710 2.00381 -36.90183 807.03562
5830.0000 -38.42999 -36.98807 1.44192 2.01205 -36.84732 784.33810
5835.0000 -38.98453 -37.62771 1.35682 1.92701 -37.40960 702.87963
5840.0000 -39.38369 -38.09116 1.29253 1.84115 -37.97727 587.33729
5845.0000 -39.07043 -37.95969 1.11074 1.82296 -38.09752 547.57271
5850.0000 -39.23878 -37.73222 1.50656 1.86293 -37.83325 611.12005
5855.0000 -39.50394 -37.79074 1.71320 1.88502 -37.68719 652.21670
5860.0000 -38.21846 -36.52555 1.69292 2.00814 -36.87318 773.71374
5865.0000 -39.14869 -37.53017 1.61853 2.01224 -36.84613 770.48037
5870.0000 -38.60227 -37.17467 1.42761 1.93086 -37.38417 676.50154
5875.0000 -38.54255 -37.36179 1.18076 1.93649 -37.34691 672.77699
5880.0000 -39.45568 -38.13173 1.32395 1.86990 -37.78719 633.18374
5885.0000 -39.11718 -37.47624 1.64094 1.90767 -37.53749 686.03369
5890.0000 -39.34780 -38.17524 1.17256 1.90511 -37.55440 646.17053
5895.0000 -39.42120 -38.13635 1.28485 1.77995 -38.38188 492.04651
5900.0000 -39.16728 -37.83553 1.33174 1.84293 -37.96546 596.93607
5905.0000 -38.93720 -37.98242 0.95478 1.83908 -37.99092 621.91595
5910.0000 -39.16925 -37.69254 1.47671 1.90163 -37.57737 671.10639
5915.0000 -39.00295 -37.93504 1.06791 1.93209 -37.37603 690.73996
5920.0000 -39.55156 -38.32531 1.22625 1.85751 -37.86908 569.84961
5925.0000 -39.51023 -38.03288 1.47735 1.82232 -38.10174 563.90704
5930.0000 -38.80067 -37.09607 1.70460 1.94829 -37.26892 740.64199
5935.0000 -38.24207 -36.78861 1.45347 1.99920 -36.93229 753.94891
5940.0000 -38.95623 -36.45103 2.50521 2.00818 -36.87294 803.43131
5945.0000 -38.55089 -36.99192 1.55897 1.98663 -37.01539 728.03548
5950.0000 -38.62675 -36.23289 2.39385 2.07218 -36.44977 836.63677
5955.0000 -37.97366 -36.02808 1.94558 2.13460 -36.03710 891.15957
5960.0000 -38.58286 -37.00825 1.57461 2.03348 -36.70569 801.20558
5965.0000 -39.00367 -37.36349 1.64018 1.92320 -37.43480 643.11484
5970.0000 -39.08072 -37.94962 1.13110 1.89908 -37.59423 648.31075
5975.0000 -39.39444 -37.99643 1.39801 1.84277 -37.96655 596.58121
5980.0000 -38.60051 -36.82167 1.77884 1.93415 -37.36239 672.48849
5985.0000 -38.24050 -36.76970 1.47079 2.01026 -36.85917 747.39934
5990.0000 -38.91835 -37.36562 1.55273 2.00116 -36.91933 739.44467
5995.0000 -39.31541 -37.75803 1.55738 1.88375 -37.69564 691.47554
6000.0000 -39.58158 -38.54695 1.03463 1.79571 -38.27771 509.70235
FREEZING PROCESS: loop number 25 T-loop= 666.00000000000000
main_MD> interactions number 25 at Temperature= 666.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.72224 -3.19993 1.60632
force_rgl> df(natom) -0.87400 -1.22586 1.88235
6005.0000 -39.09143 -37.74963 1.34181 1.86158 -37.84216 579.80488
6010.0000 -38.74889 -37.14525 1.60364 1.96238 -37.17575 715.67547
6015.0000 -39.64429 -37.89150 1.75279 1.91796 -37.46941 677.78741
6020.0000 -38.42614 -37.19141 1.23473 1.91046 -37.51898 628.60993
6025.0000 -38.86596 -37.06609 1.79987 1.96665 -37.14750 696.85882
6030.0000 -38.66295 -37.33947 1.32348 2.02919 -36.73405 799.11955
6035.0000 -38.98320 -37.25499 1.72821 1.96289 -37.17238 621.64499
6040.0000 -39.19392 -37.96153 1.23239 1.89567 -37.61679 653.67633
6045.0000 -38.52660 -37.11017 1.41642 1.91521 -37.48760 663.69214
6050.0000 -38.47433 -37.16075 1.31358 1.93048 -37.38665 654.73889
6055.0000 -38.70494 -37.33084 1.37410 1.97454 -37.09534 768.88350
6060.0000 -39.03792 -37.67911 1.35881 1.90538 -37.55257 680.00237
6065.0000 -39.17181 -37.44797 1.72385 1.90021 -37.58675 627.31853
6070.0000 -38.70258 -37.41357 1.28901 1.91565 -37.48468 674.70544
6075.0000 -38.90800 -36.88664 2.02136 1.96902 -37.13187 745.98454
6080.0000 -38.52745 -36.45338 2.07406 2.03520 -36.69431 843.43273
6085.0000 -38.23219 -36.74657 1.48562 2.09407 -36.30507 895.16233
6090.0000 -38.90071 -37.44845 1.45226 1.92238 -37.44021 660.94668
6095.0000 -38.68493 -36.89667 1.78826 1.92181 -37.44398 701.17808
6100.0000 -38.52097 -36.65491 1.86606 1.98390 -37.03349 748.64283
6105.0000 -38.74867 -37.30536 1.44331 1.98158 -37.04880 739.40934
6110.0000 -38.94112 -37.77452 1.16661 1.94495 -37.29099 708.87237
6115.0000 -38.80658 -37.68794 1.11864 1.88195 -37.70750 648.53483
6120.0000 -38.84264 -37.92547 0.91717 1.86822 -37.79829 590.18208
6125.0000 -38.88579 -37.12957 1.75622 1.90575 -37.55015 648.91565
6130.0000 -39.07628 -37.06923 2.00705 1.92364 -37.43188 695.43421
6135.0000 -39.11319 -37.59220 1.52099 1.97415 -37.09793 686.12546
6140.0000 -39.59004 -37.74224 1.84780 1.88832 -37.66540 636.44750
6145.0000 -38.90358 -37.43113 1.47246 1.90410 -37.56105 666.21342
6150.0000 -39.07356 -37.57662 1.49693 1.85154 -37.90858 615.26723
6155.0000 -39.46171 -37.76326 1.69845 1.84245 -37.96866 594.59442
6160.0000 -39.00028 -37.82908 1.17120 1.87587 -37.74773 609.06609
6165.0000 -39.09041 -37.47996 1.61044 1.88821 -37.66615 620.50207
6170.0000 -38.85844 -37.44949 1.40895 1.83783 -37.99919 619.41097
6175.0000 -39.30111 -37.77238 1.52874 1.83993 -37.98533 580.93873
6180.0000 -38.67359 -37.44970 1.22389 1.89423 -37.62633 635.62152
6185.0000 -39.07122 -38.04895 1.02227 1.85715 -37.87146 561.40462
6190.0000 -39.07474 -37.29884 1.77591 1.88876 -37.66246 619.02474
6195.0000 -39.54768 -38.08290 1.46478 1.89172 -37.64289 645.05127
6200.0000 -39.46565 -37.95439 1.51126 1.83439 -38.02192 555.65093
6205.0000 -39.70079 -38.04119 1.65959 1.83532 -38.01578 569.81822
6210.0000 -39.49552 -38.42640 1.06912 1.83939 -37.98890 559.78993
6215.0000 -39.31053 -38.26099 1.04954 1.80066 -38.24493 535.34588
6220.0000 -38.82269 -36.87140 1.95129 1.87553 -37.74993 587.21686
6225.0000 -38.29533 -36.53582 1.75952 2.07208 -36.45044 875.82734
6230.0000 -38.73983 -37.37303 1.36681 1.97607 -37.08521 721.70797
6235.0000 -38.80128 -36.98238 1.81890 1.95252 -37.24094 723.85814
6240.0000 -39.14359 -37.73782 1.40577 1.92379 -37.43088 688.10875
6245.0000 -38.49584 -36.99142 1.50442 1.87190 -37.77394 607.11656
6250.0000 -39.12517 -36.95108 2.17409 2.00684 -36.88178 801.47137
FREEZING PROCESS: loop number 26 T-loop= 641.00000000000000
main_MD> interactions number 26 at Temperature= 641.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.61635 0.78360 -0.62005
force_rgl> df(natom) 0.28582 -3.91978 0.25992
6255.0000 -39.07932 -37.83376 1.24556 1.94339 -37.30128 733.79633
6260.0000 -39.14234 -37.54882 1.59352 1.90629 -37.54661 681.08493
6265.0000 -38.90846 -37.48332 1.42514 1.92446 -37.42642 679.34021
6270.0000 -39.23533 -37.76441 1.47091 1.89127 -37.64588 679.58198
6275.0000 -39.03193 -37.92722 1.10470 1.84895 -37.92567 598.16819
6280.0000 -39.30546 -37.87325 1.43221 1.84435 -37.95610 581.56737
6285.0000 -39.04708 -37.49025 1.55683 1.90167 -37.57714 643.14934
6290.0000 -38.77576 -37.25237 1.52339 1.96054 -37.18789 748.52763
6295.0000 -39.44936 -37.38109 2.06827 1.96029 -37.18958 764.55182
6300.0000 -38.27541 -36.98482 1.29058 1.92031 -37.45391 669.47805
6305.0000 -38.60197 -37.21687 1.38510 1.98595 -37.01990 724.50677
6310.0000 -38.71679 -37.39076 1.32603 1.94814 -37.26988 712.09555
6315.0000 -38.99761 -37.21792 1.77969 1.94800 -37.27084 699.61047
6320.0000 -39.19823 -37.36829 1.82995 1.92320 -37.43479 697.23055
6325.0000 -39.02778 -37.55864 1.46914 1.85537 -37.88321 600.36186
6330.0000 -38.64456 -37.67241 0.97215 1.92099 -37.44940 707.04190
6335.0000 -39.13119 -37.77676 1.35443 1.88194 -37.70759 668.60843
6340.0000 -39.07771 -37.79203 1.28567 1.90372 -37.56357 641.02456
6345.0000 -38.85167 -37.77630 1.07537 1.91640 -37.47976 673.19796
6350.0000 -39.09553 -37.90706 1.18847 1.88573 -37.68251 607.12835
6355.0000 -39.41256 -37.85503 1.55753 1.87725 -37.73860 605.09163
6360.0000 -39.42024 -38.37511 1.04513 1.81832 -38.12820 522.93393
6365.0000 -38.86698 -37.56312 1.30387 1.84711 -37.93783 589.60395
6370.0000 -38.85297 -37.51890 1.33408 1.91343 -37.49936 632.42833
6375.0000 -39.24276 -37.73417 1.50859 1.92181 -37.44395 678.31326
6380.0000 -39.25858 -37.71043 1.54815 1.88174 -37.70893 667.02786
6385.0000 -39.18016 -37.73259 1.44757 1.86081 -37.84724 580.40861
6390.0000 -39.20425 -38.03282 1.17143 1.87850 -37.73030 619.05084
6395.0000 -39.31372 -38.23163 1.08209 1.80067 -38.24491 529.75332
6400.0000 -39.63753 -38.67893 0.95860 1.80248 -38.23292 520.90511
6405.0000 -39.56115 -38.37605 1.18509 1.79907 -38.25547 537.07978
6410.0000 -39.49310 -38.35589 1.13721 1.79272 -38.29744 513.59059
6415.0000 -38.59561 -37.31953 1.27608 1.88620 -37.67944 634.73943
6420.0000 -39.15171 -37.46823 1.68349 1.91879 -37.46391 689.34367
6425.0000 -38.96558 -37.22200 1.74358 1.94647 -37.28094 709.44537
6430.0000 -39.34674 -37.82373 1.52301 1.90583 -37.54964 692.79475
6435.0000 -39.52056 -38.34720 1.17337 1.81415 -38.15577 535.87363
6440.0000 -39.18215 -37.69644 1.48571 1.86233 -37.83721 581.75634
6445.0000 -39.62442 -37.96121 1.66321 1.87938 -37.72449 613.45219
6450.0000 -39.14133 -37.57675 1.56458 1.84662 -37.94108 584.20186
6455.0000 -39.49607 -37.78918 1.70689 1.92913 -37.39556 696.23115
6460.0000 -38.98482 -37.95655 1.02827 1.82853 -38.06067 546.78994
6465.0000 -39.04321 -37.36675 1.67646 1.90150 -37.57826 631.85791
6470.0000 -38.79349 -37.43363 1.35986 1.92433 -37.42730 685.60129
6475.0000 -38.65962 -37.36408 1.29554 1.91820 -37.46781 642.04415
6480.0000 -39.18269 -37.72998 1.45271 1.90747 -37.53881 643.22163
6485.0000 -38.74066 -37.64780 1.09285 1.92622 -37.41484 715.16008
6490.0000 -39.47656 -38.43407 1.04249 1.89911 -37.59408 649.22895
6495.0000 -39.40639 -38.21548 1.19092 1.79353 -38.29212 526.84047
6500.0000 -39.09867 -37.95033 1.14835 1.80571 -38.21155 526.92116
FREEZING PROCESS: loop number 27 T-loop= 616.00000000000000
main_MD> interactions number 27 at Temperature= 616.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.29862 1.23949 -0.16458
force_rgl> df(natom) 1.40523 -2.30573 2.08564
6505.0000 -38.91667 -37.75651 1.16017 1.89949 -37.59156 647.11403
6510.0000 -38.91861 -37.68460 1.23400 1.85954 -37.85568 608.80140
6515.0000 -39.40796 -37.78316 1.62480 1.86322 -37.83137 628.36614
6520.0000 -39.26208 -37.85123 1.41085 1.88139 -37.71121 597.06726
6525.0000 -38.77157 -37.26203 1.50955 1.94056 -37.31998 695.08397
6530.0000 -39.01913 -37.48520 1.53393 1.95182 -37.24554 764.23732
6535.0000 -39.19556 -37.80715 1.38841 1.86731 -37.80429 627.90967
6540.0000 -39.47436 -38.02420 1.45016 1.85613 -37.87819 584.27564
6545.0000 -38.71565 -37.37376 1.34188 1.86871 -37.79504 618.84112
6550.0000 -39.02356 -37.68233 1.34122 1.94004 -37.32343 667.74223
6555.0000 -39.01971 -37.49901 1.52070 1.96775 -37.14027 785.87907
6560.0000 -38.83018 -37.66750 1.16268 1.85179 -37.90688 597.94801
6565.0000 -38.99373 -37.62221 1.37153 1.88963 -37.65672 617.99774
6570.0000 -39.39993 -37.77952 1.62040 1.88391 -37.69457 610.40733
6575.0000 -39.15708 -37.86449 1.29259 1.89915 -37.59382 668.06432
6580.0000 -39.07001 -37.93638 1.13362 1.88485 -37.68831 621.80276
6585.0000 -39.12120 -37.71558 1.40562 1.83341 -38.02846 546.40629
6590.0000 -38.53289 -37.23506 1.29783 1.93250 -37.37328 648.84409
6595.0000 -39.18876 -37.70782 1.48094 1.84296 -37.96529 570.03026
6600.0000 -39.04700 -38.01028 1.03672 1.84530 -37.94980 570.99560
6605.0000 -39.26148 -38.19149 1.06999 1.83767 -38.00030 570.27347
6610.0000 -39.25943 -38.34836 0.91107 1.78974 -38.31715 512.91969
6615.0000 -39.57782 -38.62080 0.95702 1.76823 -38.45936 478.46942
6620.0000 -39.38194 -37.74718 1.63476 1.80858 -38.19262 477.62736
6625.0000 -38.73954 -37.69716 1.04238 1.88411 -37.69325 600.99502
6630.0000 -38.82292 -37.57690 1.24602 1.91660 -37.47840 625.75382
6635.0000 -38.73357 -37.17336 1.56021 1.93739 -37.34094 687.94199
6640.0000 -39.01819 -38.20674 0.81145 1.89925 -37.59311 671.26065
6645.0000 -38.96239 -37.48882 1.47357 1.91793 -37.46964 644.90070
6650.0000 -39.29238 -37.83471 1.45767 1.91251 -37.50549 690.73165
6655.0000 -38.98672 -37.88015 1.10657 1.85717 -37.87136 630.08084
6660.0000 -39.10865 -37.43756 1.67109 1.89550 -37.61795 645.42169
6665.0000 -39.24743 -38.03982 1.20761 1.86592 -37.81352 638.58885
6670.0000 -39.24006 -38.24702 0.99304 1.87242 -37.77052 605.95202
6675.0000 -39.31049 -38.18025 1.13024 1.84433 -37.95626 556.64106
6680.0000 -39.51920 -37.88100 1.63820 1.81690 -38.13756 541.08766
6685.0000 -38.93299 -37.67848 1.25450 1.87361 -37.76262 615.32082
6690.0000 -38.97056 -37.68813 1.28243 1.87815 -37.73264 604.38945
6695.0000 -39.07515 -38.05979 1.01536 1.85880 -37.86055 600.17707
6700.0000 -39.42594 -38.01688 1.40906 1.82389 -38.09137 519.80501
6705.0000 -39.25446 -37.46586 1.78860 1.87714 -37.73929 641.18964
6710.0000 -38.27564 -36.91951 1.35614 1.92522 -37.42141 637.90962
6715.0000 -38.56707 -36.78664 1.78043 2.01454 -36.83089 756.26653
6720.0000 -38.71575 -37.19514 1.52061 2.02975 -36.73031 765.39921
6725.0000 -39.40232 -37.80393 1.59839 1.90434 -37.55945 659.26697
6730.0000 -39.15061 -37.86628 1.28432 1.89028 -37.65242 657.00064
6735.0000 -39.12609 -37.74897 1.37711 1.83905 -37.99117 570.27988
6740.0000 -39.38040 -37.75031 1.63008 1.86595 -37.81327 572.58981
6745.0000 -39.40203 -38.08267 1.31935 1.84400 -37.95839 568.91748
6750.0000 -38.98139 -38.13498 0.84640 1.80535 -38.21398 513.07092
FREEZING PROCESS: loop number 28 T-loop= 591.00000000000000
main_MD> interactions number 28 at Temperature= 591.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.97301 1.06674 -1.34906
force_rgl> df(natom) 0.91435 2.75699 -3.08372
6755.0000 -39.01574 -37.96243 1.05331 1.82402 -38.09052 528.55546
6760.0000 -38.89877 -37.63005 1.26872 1.85512 -37.88491 589.67580
6765.0000 -39.24813 -37.70039 1.54774 1.88132 -37.71166 637.12975
6770.0000 -38.97061 -37.81041 1.16019 1.89997 -37.58835 648.72992
6775.0000 -38.86000 -37.75963 1.10037 1.85189 -37.90627 541.24032
6780.0000 -39.07424 -37.65706 1.41718 1.90447 -37.55863 588.39611
6785.0000 -38.67181 -37.35414 1.31767 1.89593 -37.61511 620.23496
6790.0000 -39.20946 -37.79145 1.41801 1.87987 -37.72127 602.74786
6795.0000 -39.23228 -38.12235 1.10993 1.88366 -37.69619 612.37848
6800.0000 -38.99338 -37.96093 1.03245 1.79080 -38.31012 492.08697
6805.0000 -39.48861 -38.32147 1.16713 1.82644 -38.07451 570.16266
6810.0000 -39.23490 -38.22554 1.00937 1.81675 -38.13859 573.58175
6815.0000 -39.04774 -37.70729 1.34045 1.86055 -37.84898 538.41994
6820.0000 -38.99543 -37.52085 1.47458 1.89011 -37.65355 645.98328
6825.0000 -39.19315 -37.51649 1.67666 1.89285 -37.63545 633.29050
6830.0000 -38.88527 -37.47995 1.40532 1.88805 -37.66719 639.64742
6835.0000 -38.64484 -37.30321 1.34163 1.88405 -37.69365 646.53412
6840.0000 -39.35869 -38.16869 1.19000 1.89860 -37.59744 662.53713
6845.0000 -39.24565 -38.11052 1.13513 1.85265 -37.90125 583.29604
6850.0000 -39.59653 -38.09318 1.50335 1.79602 -38.27560 512.95255
6855.0000 -39.46615 -38.17184 1.29431 1.82642 -38.07465 569.25344
6860.0000 -39.23036 -37.87555 1.35481 1.83808 -37.99753 596.11273
6865.0000 -38.61055 -37.43991 1.17064 1.85553 -37.88216 626.22844
6870.0000 -39.00185 -37.67138 1.33047 1.91815 -37.46820 663.94421
6875.0000 -39.41989 -37.44015 1.97973 1.90651 -37.54513 719.63884
6880.0000 -39.33548 -38.04457 1.29091 1.85451 -37.88892 613.17009
6885.0000 -38.81422 -37.72323 1.09098 1.87749 -37.73702 624.49433
6890.0000 -39.47667 -38.33759 1.13909 1.80980 -38.18450 530.65844
6895.0000 -39.63303 -38.37306 1.25997 1.77564 -38.41038 499.69181
6900.0000 -39.62554 -38.26108 1.36446 1.80988 -38.18403 553.73438
6905.0000 -39.17264 -38.42271 0.74993 1.76956 -38.45056 448.52312
6910.0000 -39.35446 -38.06576 1.28870 1.83659 -38.00739 587.92058
6915.0000 -39.54903 -38.12792 1.42111 1.85809 -37.86527 598.80814
6920.0000 -38.81690 -37.30597 1.51093 1.85578 -37.88054 580.21780
6925.0000 -38.27987 -36.99813 1.28174 1.94156 -37.31340 652.12242
6930.0000 -38.99954 -37.64492 1.35462 1.94058 -37.31985 672.94900
6935.0000 -38.99491 -37.73425 1.26066 1.87408 -37.75954 582.09767
6940.0000 -39.16404 -37.76268 1.40136 1.84058 -37.98103 575.87308
6945.0000 -38.97398 -37.51075 1.46323 1.91074 -37.51716 669.81964
6950.0000 -38.92991 -37.41780 1.51211 1.94802 -37.27072 697.09512
6955.0000 -39.55949 -38.07085 1.48864 1.84025 -37.98320 629.55165
6960.0000 -39.51626 -37.91798 1.59828 1.80520 -38.21497 498.33070
6965.0000 -39.19662 -37.78967 1.40694 1.85088 -37.91293 611.75133
6970.0000 -38.79044 -37.65884 1.13161 1.91107 -37.51497 665.46444
6975.0000 -38.80363 -37.14238 1.66126 1.95873 -37.19987 724.34212
6980.0000 -39.22746 -37.90454 1.32292 1.88297 -37.70079 604.47521
6985.0000 -38.96605 -37.85763 1.10842 1.87270 -37.76864 602.09638
6990.0000 -39.09722 -37.82719 1.27003 1.84307 -37.96456 570.28757
6995.0000 -39.13923 -37.88985 1.24938 1.87958 -37.72319 616.94046
7000.0000 -38.87529 -37.26365 1.61164 1.89263 -37.63688 641.59801
FREEZING PROCESS: loop number 29 T-loop= 566.00000000000000
main_MD> interactions number 29 at Temperature= 566.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.75545 0.14654 -0.39298
force_rgl> df(natom) -1.34885 -4.56273 2.06795
7005.0000 -39.35090 -37.45340 1.89750 1.90436 -37.55936 657.74322
7010.0000 -38.97670 -37.60615 1.37055 1.87030 -37.78456 639.92684
7015.0000 -39.74654 -38.48315 1.26339 1.80886 -38.19076 514.42211
7020.0000 -39.07012 -37.93207 1.13805 1.82927 -38.05583 552.63166
7025.0000 -39.45542 -37.97072 1.48470 1.87770 -37.73560 646.46137
7030.0000 -39.39609 -38.39840 0.99769 1.82260 -38.09990 541.08205
7035.0000 -39.78642 -38.32388 1.46254 1.79813 -38.26169 507.41481
7040.0000 -39.26734 -37.82782 1.43952 1.86447 -37.82309 568.80721
7045.0000 -39.07518 -37.49433 1.58085 1.88087 -37.71463 635.59894
7050.0000 -39.16548 -38.15205 1.01344 1.84150 -37.97497 590.93293
7055.0000 -39.57158 -38.47131 1.10027 1.79988 -38.25008 499.54168
7060.0000 -39.45324 -38.20942 1.24383 1.79804 -38.26226 515.31665
7065.0000 -39.35035 -38.02319 1.32716 1.81151 -38.17325 534.81917
7070.0000 -39.01938 -37.77812 1.24126 1.84620 -37.94390 594.52708
7075.0000 -38.78603 -37.71081 1.07522 1.86629 -37.81105 602.97721
7080.0000 -39.20125 -37.77299 1.42826 1.85533 -37.88353 609.68590
7085.0000 -39.25998 -38.18540 1.07458 1.80331 -38.22745 530.00837
7090.0000 -39.25014 -37.80438 1.44576 1.84178 -37.97308 534.29340
7095.0000 -39.19394 -37.73045 1.46350 1.92134 -37.44708 651.21554
7100.0000 -39.21447 -37.97652 1.23795 1.84401 -37.95837 581.98425
7105.0000 -38.89368 -38.14132 0.75236 1.85305 -37.89859 577.12446
7110.0000 -39.19999 -37.95718 1.24281 1.82647 -38.07430 554.48609
7115.0000 -39.23622 -37.88682 1.34939 1.83948 -37.98832 579.68860
7120.0000 -39.15105 -37.77122 1.37983 1.84381 -37.95964 578.82234
7125.0000 -39.00850 -37.85331 1.15519 1.83623 -38.00979 601.13620
7130.0000 -39.55063 -38.62362 0.92701 1.78649 -38.33867 527.54563
7135.0000 -39.53296 -38.23725 1.29572 1.79089 -38.30952 507.97085
7140.0000 -39.73707 -38.61594 1.12112 1.73958 -38.64880 453.41440
7145.0000 -39.58101 -38.40350 1.17751 1.78497 -38.34867 502.70872
7150.0000 -38.49416 -37.42219 1.07197 1.86559 -37.81568 622.24802
7155.0000 -39.48606 -38.03555 1.45051 1.88410 -37.69328 613.35358
7160.0000 -39.35701 -38.30666 1.05035 1.80621 -38.20828 517.53757
7165.0000 -39.06003 -37.86633 1.19369 1.81603 -38.14331 542.61407
7170.0000 -38.96451 -37.55795 1.40656 1.87687 -37.74111 600.98278
7175.0000 -39.13632 -37.66605 1.47027 1.88796 -37.66775 581.13740
7180.0000 -39.38410 -37.93246 1.45164 1.85216 -37.90447 595.00742
7185.0000 -38.85312 -37.59506 1.25806 1.85436 -37.88992 594.21341
7190.0000 -39.32171 -37.83033 1.49138 1.89005 -37.65394 621.25701
7195.0000 -39.62641 -38.33681 1.28960 1.86175 -37.84109 585.57071
7200.0000 -39.07828 -38.02375 1.05454 1.80864 -38.19218 520.04417
7205.0000 -39.30457 -38.22140 1.08317 1.79992 -38.24983 520.39280
7210.0000 -39.04796 -37.86016 1.18780 1.86022 -37.85116 597.73388
7215.0000 -39.26338 -37.95818 1.30520 1.87160 -37.77595 618.40371
7220.0000 -39.38912 -38.14502 1.24409 1.83025 -38.04935 562.06408
7225.0000 -39.38328 -37.73957 1.64371 1.83088 -38.04513 564.72254
7230.0000 -39.20772 -36.71638 2.49134 1.93189 -37.37735 634.89369
7235.0000 -39.36243 -37.82257 1.53987 1.88667 -37.67630 657.61906
7240.0000 -39.34818 -37.96677 1.38141 1.81816 -38.12923 556.87662
7245.0000 -39.38858 -38.31221 1.07637 1.80957 -38.18607 532.35981
7250.0000 -39.21994 -38.30571 0.91423 1.82401 -38.09057 572.12257
FREEZING PROCESS: loop number 30 T-loop= 541.00000000000000
main_MD> interactions number 30 at Temperature= 541.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.39298 0.38250 1.27853
force_rgl> df(natom) 0.75839 -0.59640 1.19217
7255.0000 -38.98845 -37.54451 1.44394 1.84353 -37.96150 556.75767
7260.0000 -39.13869 -37.85095 1.28774 1.89508 -37.62067 626.83964
7265.0000 -39.46767 -37.67474 1.79293 1.86386 -37.82710 626.86781
7270.0000 -39.26138 -38.24258 1.01880 1.82586 -38.07837 564.67617
7275.0000 -39.32560 -38.27634 1.04926 1.80648 -38.20647 512.25442
7280.0000 -39.00600 -37.51430 1.49170 1.82314 -38.09632 554.89209
7285.0000 -39.29074 -38.16684 1.12389 1.85286 -37.89985 606.90704
7290.0000 -39.30575 -38.28527 1.02048 1.80959 -38.18595 545.42622
7295.0000 -39.61385 -38.36590 1.24795 1.82386 -38.09158 563.04764
7300.0000 -39.27117 -38.31319 0.95798 1.80663 -38.20550 539.95815
7305.0000 -38.97134 -37.95242 1.01892 1.85957 -37.85548 622.34096
7310.0000 -39.22566 -38.03897 1.18669 1.78658 -38.33805 509.81018
7315.0000 -39.57443 -38.37689 1.19754 1.77730 -38.39938 495.54217
7320.0000 -39.34424 -38.04387 1.30037 1.81960 -38.11975 565.60998
7325.0000 -39.03500 -38.11788 0.91712 1.85528 -37.88385 553.04942
7330.0000 -39.52048 -38.69766 0.82282 1.81126 -38.17486 519.93113
7335.0000 -39.47390 -38.46833 1.00557 1.74278 -38.62764 453.09322
7340.0000 -39.51688 -38.45211 1.06478 1.78706 -38.33487 504.98877
7345.0000 -39.41250 -38.28448 1.12803 1.75485 -38.54780 472.27654
7350.0000 -39.57399 -38.33029 1.24370 1.80582 -38.21084 526.75261
7355.0000 -39.33340 -38.30168 1.03173 1.83290 -38.03178 590.27978
7360.0000 -38.93630 -37.98710 0.94920 1.83825 -37.99645 572.54144
7365.0000 -39.13634 -37.68486 1.45148 1.87954 -37.72345 650.02094
7370.0000 -38.70435 -37.28984 1.41452 1.93108 -37.38271 720.65216
7375.0000 -39.54136 -37.94606 1.59530 1.89117 -37.64655 662.85633
7380.0000 -39.19039 -38.06593 1.12447 1.80025 -38.24767 522.48218
7385.0000 -38.89063 -37.84009 1.05054 1.82204 -38.10359 554.22611
7390.0000 -39.17184 -37.69373 1.47812 1.87240 -37.77065 554.63540
7395.0000 -39.43950 -37.82327 1.61622 1.86002 -37.85251 557.61973
7400.0000 -39.10303 -38.46237 0.64066 1.83135 -38.04205 582.08927
7405.0000 -39.00954 -37.78899 1.22055 1.80678 -38.20448 526.35886
7410.0000 -39.64439 -38.30842 1.33597 1.82472 -38.08585 553.14404
7415.0000 -39.05640 -37.38811 1.66829 1.85528 -37.88385 591.47438
7420.0000 -38.81389 -37.49786 1.31604 1.92954 -37.39286 700.37292
7425.0000 -39.41825 -38.24515 1.17311 1.85708 -37.87196 604.02015
7430.0000 -39.59889 -38.14950 1.44939 1.84739 -37.93597 597.18437
7435.0000 -39.15934 -37.40693 1.75241 1.80687 -38.20387 539.78498
7440.0000 -38.53899 -37.36333 1.17566 1.93037 -37.38739 659.12227
7445.0000 -39.50495 -38.29145 1.21350 1.87476 -37.75507 583.05019
7450.0000 -39.58032 -38.34317 1.23715 1.79869 -38.25800 512.31505
7455.0000 -39.51717 -38.39119 1.12597 1.80415 -38.22189 540.67384
7460.0000 -39.67705 -38.72584 0.95121 1.77104 -38.44082 471.95245
7465.0000 -39.63850 -38.70848 0.93002 1.76102 -38.50703 466.86855
7470.0000 -39.22686 -38.21127 1.01559 1.78849 -38.32540 502.61180
7475.0000 -39.37947 -38.14472 1.23475 1.82630 -38.07542 560.61656
7480.0000 -39.41232 -37.74692 1.66540 1.84341 -37.96232 576.67924
7485.0000 -39.49494 -38.04204 1.45290 1.83824 -37.99648 562.53622
7490.0000 -39.61628 -38.80303 0.81325 1.75583 -38.54138 458.00845
7495.0000 -39.74088 -38.48566 1.25521 1.72878 -38.72019 462.37160
7500.0000 -39.35312 -38.39411 0.95901 1.74608 -38.60581 438.91399
FREEZING PROCESS: loop number 31 T-loop= 516.00000000000000
main_MD> interactions number 31 at Temperature= 516.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.27268 -0.81299 1.50307
force_rgl> df(natom) -1.54560 0.17737 -0.62176
7505.0000 -39.29706 -38.17484 1.12221 1.79042 -38.31268 514.21710
7510.0000 -39.33547 -38.42320 0.91228 1.80293 -38.22993 511.88213
7515.0000 -39.57739 -38.53072 1.04667 1.76075 -38.50879 475.54866
7520.0000 -39.65811 -38.61480 1.04331 1.74286 -38.62710 459.82146
7525.0000 -39.86197 -39.01225 0.84972 1.71893 -38.78531 417.38822
7530.0000 -39.57993 -38.67629 0.90365 1.70704 -38.86395 405.81510
7535.0000 -39.54014 -38.55116 0.98898 1.75003 -38.57971 448.37034
7540.0000 -39.80129 -38.68085 1.12043 1.75864 -38.52277 466.97613
7545.0000 -39.30432 -37.69688 1.60745 1.78720 -38.33394 501.67642
7550.0000 -39.13266 -38.15369 0.97897 1.85171 -37.90742 614.50288
7555.0000 -39.71255 -38.16731 1.54525 1.82903 -38.05738 587.84545
7560.0000 -39.55935 -38.57613 0.98322 1.80782 -38.19765 528.73958
7565.0000 -39.79769 -38.48334 1.31435 1.76685 -38.46849 471.07249
7570.0000 -39.27343 -38.56034 0.71309 1.76312 -38.49318 466.31114
7575.0000 -39.29223 -37.96151 1.33072 1.81699 -38.13700 521.57832
7580.0000 -39.11836 -37.79878 1.31957 1.86845 -37.79674 631.34279
7585.0000 -39.25164 -38.11513 1.13651 1.83657 -38.00751 573.44068
7590.0000 -39.52255 -38.49261 1.02995 1.82392 -38.09118 553.03045
7595.0000 -39.44239 -38.44584 0.99655 1.77649 -38.40478 490.84335
7600.0000 -39.26709 -38.48476 0.78232 1.76728 -38.46563 490.68198
7605.0000 -39.33111 -38.41566 0.91544 1.72496 -38.74547 390.38235
7610.0000 -39.46377 -38.56409 0.89969 1.78057 -38.37777 505.93004
7615.0000 -39.47275 -38.43674 1.03601 1.73409 -38.68506 449.25736
7620.0000 -39.19367 -38.25801 0.93566 1.79039 -38.31285 488.50039
7625.0000 -39.16605 -37.99785 1.16820 1.82954 -38.05401 506.88099
7630.0000 -39.46930 -38.19620 1.27310 1.83585 -38.01232 586.70351
7635.0000 -39.63940 -38.64996 0.98944 1.72093 -38.77206 416.55415
7640.0000 -39.53626 -38.85388 0.68238 1.73203 -38.69870 449.10836
7645.0000 -39.35946 -38.48595 0.87351 1.71483 -38.81242 340.88051
7650.0000 -39.44740 -38.39661 1.05079 1.78075 -38.37662 484.61007
7655.0000 -39.55714 -38.26381 1.29333 1.79347 -38.29248 541.10481
7660.0000 -38.98035 -37.95596 1.02439 1.82074 -38.11223 518.66579
7665.0000 -39.14444 -38.25418 0.89026 1.81718 -38.13572 534.28086
7670.0000 -39.08736 -37.96236 1.12500 1.78612 -38.34106 512.48526
7675.0000 -39.29155 -38.31220 0.97934 1.81745 -38.13397 547.42423
7680.0000 -38.96395 -37.88210 1.08185 1.83816 -37.99706 557.04409
7685.0000 -38.98400 -37.51483 1.46917 1.84953 -37.92187 570.35759
7690.0000 -39.17920 -37.69935 1.47985 1.87565 -37.74914 624.45402
7695.0000 -39.53364 -38.40497 1.12868 1.82866 -38.05986 574.84103
7700.0000 -39.55880 -38.69267 0.86613 1.75973 -38.51554 466.07462
7705.0000 -39.35744 -38.47270 0.88474 1.77415 -38.42023 499.72712
7710.0000 -39.43158 -38.08358 1.34800 1.81160 -38.17259 542.58835
7715.0000 -39.59740 -38.09003 1.50737 1.81530 -38.14816 537.01232
7720.0000 -39.51957 -38.48990 1.02967 1.81468 -38.15229 526.23483
7725.0000 -39.49181 -38.19340 1.29842 1.78652 -38.33846 506.54302
7730.0000 -39.39846 -37.67110 1.72736 1.85920 -37.85792 618.22419
7735.0000 -39.35782 -38.04781 1.31000 1.84525 -37.95013 568.28839
7740.0000 -39.38136 -38.35615 1.02522 1.82926 -38.05589 492.43691
7745.0000 -39.23108 -37.74392 1.48715 1.80619 -38.20842 535.82670
7750.0000 -39.51644 -38.19654 1.31990 1.84191 -37.97226 575.79434
FREEZING PROCESS: loop number 32 T-loop= 491.00000000000000
main_MD> interactions number 32 at Temperature= 491.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.90251 -0.30997 0.82375
force_rgl> df(natom) 1.97523 2.50801 2.83412
7755.0000 -39.69998 -38.25590 1.44408 1.79149 -38.30560 505.77121
7760.0000 -39.70781 -38.75062 0.95718 1.78176 -38.36988 508.85214
7765.0000 -39.70208 -38.49118 1.21090 1.76254 -38.49698 473.94582
7770.0000 -39.88172 -38.80711 1.07461 1.74225 -38.63113 458.83393
7775.0000 -39.73456 -38.45289 1.28168 1.73410 -38.68505 465.35936
7780.0000 -39.78895 -38.72631 1.06264 1.75612 -38.53941 469.92332
7785.0000 -39.62059 -38.90547 0.71512 1.68739 -38.99381 367.99942
7790.0000 -39.53135 -38.68927 0.84208 1.73342 -38.68954 433.29665
7795.0000 -39.43505 -38.24358 1.19147 1.73808 -38.65871 462.10369
7800.0000 -39.20978 -38.45364 0.75614 1.76146 -38.50414 469.46709
7805.0000 -39.41547 -38.60379 0.81168 1.73812 -38.65843 445.13574
7810.0000 -39.50760 -38.16056 1.34704 1.76309 -38.49336 443.45859
7815.0000 -38.94397 -38.12779 0.81618 1.84671 -37.94049 564.52820
7820.0000 -39.65449 -38.78454 0.86994 1.74119 -38.63815 449.74708
7825.0000 -39.95262 -38.72998 1.22264 1.71929 -38.78293 421.21372
7830.0000 -39.57439 -38.88447 0.68992 1.69676 -38.93188 367.31971
7835.0000 -39.43848 -38.29524 1.14324 1.71756 -38.79438 426.44869
7840.0000 -39.75636 -38.34531 1.41105 1.76845 -38.45792 488.68969
7845.0000 -39.30028 -38.24590 1.05438 1.76913 -38.45344 491.73118
7850.0000 -39.74033 -38.48974 1.25059 1.76343 -38.49112 474.56537
7855.0000 -39.20957 -37.79127 1.41830 1.82905 -38.05724 570.34219
7860.0000 -38.67948 -37.20028 1.47919 1.88458 -37.69014 646.71277
7865.0000 -39.57144 -38.41402 1.15742 1.88852 -37.66409 636.80489
7870.0000 -39.72548 -39.02200 0.70348 1.72064 -38.77400 403.47997
7875.0000 -39.58102 -38.77073 0.81029 1.68726 -38.99471 353.31905
7880.0000 -39.32482 -38.22604 1.09878 1.75814 -38.52606 480.25179
7885.0000 -39.37157 -38.02293 1.34864 1.84483 -37.95294 564.39712
7890.0000 -39.06953 -37.75595 1.31358 1.84229 -37.96971 565.61873
7895.0000 -39.28315 -37.81063 1.47252 1.85540 -37.88301 603.47800
7900.0000 -39.58521 -38.42795 1.15726 1.80961 -38.18578 519.17253
7905.0000 -39.50514 -38.14806 1.35708 1.82154 -38.10691 537.74424
7910.0000 -39.41560 -38.77960 0.63600 1.76630 -38.47214 474.53724
7915.0000 -39.46157 -38.37363 1.08793 1.74881 -38.58779 437.72825
7920.0000 -39.44057 -38.57365 0.86692 1.74050 -38.64273 431.01159
7925.0000 -39.50238 -38.44259 1.05979 1.75357 -38.55632 465.15422
7930.0000 -39.32693 -38.69438 0.63255 1.72921 -38.71735 421.74371
7935.0000 -39.67404 -38.72165 0.95239 1.71748 -38.79490 419.60934
7940.0000 -39.47355 -38.53344 0.94011 1.76765 -38.46319 470.76903
7945.0000 -39.29335 -37.93407 1.35928 1.80860 -38.19249 537.66863
7950.0000 -39.23376 -38.02264 1.21111 1.84269 -37.96706 570.71874
7955.0000 -39.82476 -38.81228 1.01247 1.74681 -38.60100 443.22414
7960.0000 -39.47415 -38.82415 0.65000 1.74653 -38.60281 453.89164
7965.0000 -39.35745 -38.38180 0.97565 1.74903 -38.58631 457.87627
7970.0000 -39.63345 -38.51394 1.11951 1.79972 -38.25117 531.42052
7975.0000 -39.62282 -38.62329 0.99953 1.74145 -38.63639 462.34219
7980.0000 -39.28890 -37.53847 1.75043 1.80756 -38.19933 515.03064
7985.0000 -38.63006 -37.45143 1.17863 1.89200 -37.64107 583.67057
7990.0000 -39.70274 -38.40329 1.29945 1.83260 -38.03379 570.00148
7995.0000 -39.85449 -39.12503 0.72947 1.73367 -38.68789 446.53083
8000.0000 -39.50500 -38.61428 0.89072 1.72196 -38.76531 417.64937
FREEZING PROCESS: loop number 33 T-loop= 466.00000000000000
main_MD> interactions number 33 at Temperature= 466.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.43159 -2.50123 -0.23852
force_rgl> df(natom) 3.36630 -1.20767 1.71521
8005.0000 -39.40870 -38.72928 0.67942 1.74915 -38.58551 412.33688
8010.0000 -39.39238 -38.34664 1.04574 1.79136 -38.30647 475.96912
8015.0000 -39.36154 -38.33046 1.03108 1.78666 -38.33748 500.62665
8020.0000 -39.66385 -38.63347 1.03038 1.74322 -38.62470 457.57319
8025.0000 -39.48987 -38.57380 0.91607 1.73033 -38.70996 442.74733
8030.0000 -39.77732 -39.08242 0.69490 1.72858 -38.72153 422.19595
8035.0000 -39.57161 -38.58901 0.98260 1.71006 -38.84393 405.56911
8040.0000 -39.84910 -38.66339 1.18571 1.75940 -38.51777 474.20220
8045.0000 -39.57544 -38.69679 0.87865 1.72757 -38.72817 426.61628
8050.0000 -39.44533 -38.71262 0.73271 1.71614 -38.80373 402.66536
8055.0000 -39.63990 -38.60395 1.03595 1.75199 -38.56670 466.18055
8060.0000 -39.78267 -38.89956 0.88311 1.70947 -38.84789 415.12299
8065.0000 -39.41589 -38.41940 0.99648 1.74273 -38.62795 448.85050
8070.0000 -39.28641 -38.23246 1.05395 1.81489 -38.15087 536.24371
8075.0000 -39.11362 -38.05705 1.05657 1.84171 -37.97357 553.08871
8080.0000 -39.55606 -38.24024 1.31582 1.80706 -38.20261 540.81245
8085.0000 -39.49456 -38.54178 0.95278 1.76728 -38.46566 483.43191
8090.0000 -39.63843 -38.60940 1.02903 1.75455 -38.54983 463.66673
8095.0000 -38.95147 -37.84554 1.10593 1.77672 -38.40323 485.41459
8100.0000 -38.84252 -38.00387 0.83866 1.89021 -37.65292 609.16615
8105.0000 -39.37686 -38.28961 1.08724 1.79579 -38.27714 460.35833
8110.0000 -39.45157 -38.43821 1.01336 1.76077 -38.50866 470.93963
8115.0000 -39.18745 -38.34096 0.84649 1.77480 -38.41592 485.14173
8120.0000 -39.52726 -38.40682 1.12045 1.78729 -38.33332 530.15481
8125.0000 -39.54136 -38.29217 1.24918 1.77474 -38.41632 491.11801
8130.0000 -39.81711 -38.74796 1.06916 1.73843 -38.65639 455.81133
8135.0000 -39.60063 -38.52584 1.07479 1.79986 -38.25022 584.34918
8140.0000 -39.36357 -38.26038 1.10320 1.75929 -38.51850 466.75123
8145.0000 -39.60365 -38.29648 1.30717 1.80061 -38.24527 520.87349
8150.0000 -39.15823 -38.33833 0.81990 1.75464 -38.54925 476.38424
8155.0000 -39.34042 -38.27185 1.06857 1.78287 -38.36258 501.69466
8160.0000 -39.56564 -38.60532 0.96032 1.78189 -38.36906 486.82590
8165.0000 -39.77292 -38.68042 1.09251 1.74311 -38.62543 434.35592
8170.0000 -39.65570 -38.47037 1.18534 1.77323 -38.42631 473.18975
8175.0000 -39.50371 -38.42064 1.08306 1.77320 -38.42650 486.20537
8180.0000 -39.29036 -37.56867 1.72169 1.86386 -37.82713 599.10034
8185.0000 -39.55312 -38.14613 1.40699 1.84285 -37.96602 573.59175
8190.0000 -39.75005 -38.91818 0.83187 1.76751 -38.46413 478.63573
8195.0000 -39.37984 -38.58099 0.79885 1.74242 -38.63001 427.58327
8200.0000 -39.78281 -38.22480 1.55801 1.78573 -38.34364 518.28204
8205.0000 -39.08933 -37.82960 1.25974 1.86702 -37.80621 620.74867
8210.0000 -39.12759 -38.33245 0.79514 1.82305 -38.09693 577.89568
8215.0000 -39.69273 -38.86126 0.83147 1.73071 -38.70740 428.08471
8220.0000 -39.58944 -38.65784 0.93160 1.73658 -38.66861 431.12395
8225.0000 -39.83166 -38.83508 0.99658 1.72863 -38.72118 416.72184
8230.0000 -39.28940 -38.11880 1.17060 1.76302 -38.49380 469.52041
8235.0000 -39.69518 -38.71490 0.98027 1.78095 -38.37529 489.37083
8240.0000 -39.66737 -38.60544 1.06193 1.73369 -38.68771 422.44343
8245.0000 -39.39385 -38.43055 0.96331 1.75227 -38.56491 450.35367
8250.0000 -39.82575 -39.06638 0.75937 1.74597 -38.60653 443.34317
FREEZING PROCESS: loop number 34 T-loop= 441.00000000000000
main_MD> interactions number 34 at Temperature= 441.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.20030 0.07725 2.64474
force_rgl> df(natom) 0.42755 -1.01434 -0.17825
8255.0000 -39.70697 -38.86546 0.84151 1.67471 -39.07765 356.42417
8260.0000 -39.62375 -38.89518 0.72858 1.71292 -38.82503 388.23158
8265.0000 -39.50283 -38.65111 0.85173 1.72352 -38.75497 411.57803
8270.0000 -39.43893 -38.53536 0.90357 1.76799 -38.46093 470.50430
8275.0000 -39.83374 -39.12480 0.70893 1.69773 -38.92545 369.98340
8280.0000 -39.71869 -38.95255 0.76613 1.69009 -38.97601 367.46369
8285.0000 -39.77089 -38.93327 0.83763 1.71292 -38.82503 413.30710
8290.0000 -39.67562 -38.85178 0.82384 1.72112 -38.77085 416.69870
8295.0000 -39.80810 -38.80382 1.00428 1.71778 -38.79290 411.97398
8300.0000 -39.56007 -38.37878 1.18129 1.74464 -38.61536 454.80582
8305.0000 -39.72143 -38.59599 1.12543 1.75389 -38.55416 471.18994
8310.0000 -39.24393 -38.51348 0.73045 1.74163 -38.63524 459.64927
8315.0000 -39.47757 -38.35306 1.12451 1.77685 -38.40234 467.58909
8320.0000 -39.11808 -38.15443 0.96365 1.80054 -38.24575 514.15587
8325.0000 -39.63356 -38.23146 1.40210 1.80298 -38.22963 520.92960
8330.0000 -39.41096 -38.39885 1.01211 1.82049 -38.11384 560.17989
8335.0000 -39.31865 -38.37947 0.93917 1.79005 -38.31507 499.13078
8340.0000 -39.45978 -38.39956 1.06022 1.77107 -38.44062 476.73629
8345.0000 -39.47616 -38.27018 1.20598 1.76727 -38.46570 496.19504
8350.0000 -39.62765 -38.63491 0.99274 1.74135 -38.63707 434.84373
8355.0000 -39.91365 -38.92078 0.99287 1.73009 -38.71151 415.43362
8360.0000 -39.85301 -39.00881 0.84420 1.67590 -39.06977 359.47993
8365.0000 -39.77979 -38.66209 1.11770 1.71026 -38.84263 421.07910
8370.0000 -40.03805 -38.92375 1.11430 1.72378 -38.75322 417.32774
8375.0000 -39.75474 -38.99981 0.75493 1.71623 -38.80317 414.22007
8380.0000 -39.58990 -38.52117 1.06873 1.72927 -38.71692 432.61207
8385.0000 -39.97096 -39.00262 0.96834 1.71247 -38.82804 411.53219
8390.0000 -39.73726 -38.92503 0.81223 1.70185 -38.89824 404.71377
8395.0000 -39.51649 -38.93011 0.58638 1.68581 -39.00431 382.58360
8400.0000 -39.72002 -38.71704 1.00298 1.70604 -38.87052 400.63271
8405.0000 -39.80489 -38.28864 1.51625 1.76198 -38.50071 477.76037
8410.0000 -39.75728 -38.50736 1.24992 1.78792 -38.32916 527.57528
8415.0000 -39.87233 -39.09012 0.78221 1.70989 -38.84506 398.44068
8420.0000 -39.79658 -38.99402 0.80256 1.68862 -38.98574 363.47790
8425.0000 -39.71600 -39.05073 0.66527 1.69636 -38.93456 387.53885
8430.0000 -39.71987 -38.97297 0.74690 1.69065 -38.97229 381.16574
8435.0000 -39.66973 -38.65115 1.01858 1.71932 -38.78270 423.71360
8440.0000 -39.89951 -38.94943 0.95007 1.71788 -38.79226 427.07482
8445.0000 -39.80828 -38.88019 0.92809 1.69266 -38.95898 387.22354
8450.0000 -39.56352 -38.61506 0.94846 1.70269 -38.89270 392.14978
8455.0000 -39.60788 -38.81692 0.79096 1.72892 -38.71924 435.56387
8460.0000 -39.43984 -38.40046 1.03939 1.74398 -38.61972 442.73837
8465.0000 -39.82615 -38.73232 1.09383 1.75577 -38.54174 453.18248
8470.0000 -39.48920 -38.56326 0.92595 1.74472 -38.61483 459.65119
8475.0000 -39.35909 -38.46050 0.89860 1.78946 -38.31897 483.32608
8480.0000 -39.01706 -37.63054 1.38652 1.81659 -38.13966 512.81509
8485.0000 -39.27614 -37.72997 1.54617 1.82847 -38.06107 549.43842
8490.0000 -39.38457 -38.41855 0.96602 1.80276 -38.23108 569.30377
8495.0000 -39.61223 -38.89679 0.71544 1.75448 -38.55028 468.99538
8500.0000 -39.52387 -38.70254 0.82132 1.71418 -38.81669 396.04421
FREEZING PROCESS: loop number 35 T-loop= 416.00000000000000
main_MD> interactions number 35 at Temperature= 416.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.39271 1.69379 2.42983
force_rgl> df(natom) -3.66308 -2.96854 0.01853
8505.0000 -39.75849 -38.77641 0.98207 1.73881 -38.65385 443.92058
8510.0000 -39.83685 -39.01008 0.82678 1.68219 -39.02820 358.64127
8515.0000 -39.90703 -39.12786 0.77918 1.67661 -39.06514 353.49027
8520.0000 -39.59232 -38.72010 0.87222 1.71363 -38.82037 403.48857
8525.0000 -39.88493 -38.84762 1.03731 1.72193 -38.76546 411.70789
8530.0000 -39.32956 -38.19064 1.13892 1.77695 -38.40174 470.04461
8535.0000 -39.55288 -38.53811 1.01477 1.74827 -38.59136 447.48103
8540.0000 -39.74546 -38.81726 0.92820 1.75703 -38.53342 463.26542
8545.0000 -39.21535 -38.30845 0.90690 1.75324 -38.55850 461.44436
8550.0000 -39.50296 -38.33447 1.16849 1.75975 -38.51545 450.65399
8555.0000 -39.86634 -38.95381 0.91252 1.74728 -38.59788 461.00034
8560.0000 -39.90234 -39.04629 0.85605 1.69426 -38.94842 389.85470
8565.0000 -39.50580 -38.77061 0.73519 1.71180 -38.83248 403.89224
8570.0000 -39.62696 -38.58789 1.03907 1.73097 -38.70572 413.72725
8575.0000 -39.86310 -38.97207 0.89103 1.71277 -38.82606 401.63569
8580.0000 -39.89324 -39.05479 0.83846 1.68590 -39.00371 363.73316
8585.0000 -39.86529 -39.11734 0.74796 1.68965 -38.97892 369.95486
8590.0000 -39.74463 -38.83754 0.90709 1.70438 -38.88149 380.63016
8595.0000 -39.82071 -39.02822 0.79249 1.71006 -38.84393 405.51686
8600.0000 -39.79218 -39.00996 0.78222 1.65469 -39.21001 325.43283
8605.0000 -40.06298 -39.47074 0.59224 1.64157 -39.29677 302.66721
8610.0000 -39.87030 -39.05877 0.81153 1.67557 -39.07201 360.33268
8615.0000 -39.67144 -39.01366 0.65779 1.68755 -38.99281 362.09648
8620.0000 -39.78512 -38.94936 0.83576 1.68965 -38.97893 372.75344
8625.0000 -39.69241 -38.94056 0.75185 1.71203 -38.83094 410.25491
8630.0000 -39.48164 -38.45996 1.02169 1.70573 -38.87255 403.74645
8635.0000 -39.90979 -38.85903 1.05076 1.70817 -38.85646 407.22716
8640.0000 -39.81060 -38.96206 0.84855 1.68767 -38.99202 366.02670
8645.0000 -39.66228 -38.65867 1.00361 1.71758 -38.79423 411.78345
8650.0000 -39.40563 -38.35762 1.04801 1.76356 -38.49027 494.00795
8655.0000 -39.66487 -38.60607 1.05880 1.73105 -38.70521 426.39567
8660.0000 -39.89619 -39.00152 0.89467 1.72238 -38.76252 411.37976
8665.0000 -39.99503 -39.25277 0.74226 1.68748 -38.99327 370.90789
8670.0000 -39.94957 -38.82913 1.12044 1.65483 -39.20911 320.64210
8675.0000 -39.63844 -38.70723 0.93121 1.73774 -38.66093 442.74115
8680.0000 -39.56607 -39.05613 0.50994 1.71988 -38.77903 436.57969
8685.0000 -40.01337 -39.13942 0.87395 1.66982 -39.11001 350.73183
8690.0000 -40.10410 -39.47212 0.63198 1.64484 -39.27513 327.66180
8695.0000 -39.77502 -39.09937 0.67565 1.64775 -39.25592 327.03534
8700.0000 -39.81275 -38.89958 0.91317 1.69406 -38.94975 348.48533
8705.0000 -39.99278 -39.12349 0.86929 1.65257 -39.22406 322.56976
8710.0000 -39.57147 -38.68983 0.88164 1.71234 -38.82890 411.67119
8715.0000 -39.46020 -38.33791 1.12229 1.76350 -38.49067 476.22254
8720.0000 -39.71688 -38.56139 1.15548 1.76111 -38.50641 469.37461
8725.0000 -39.44663 -38.67936 0.76727 1.74439 -38.61696 454.78153
8730.0000 -39.57457 -38.65400 0.92058 1.71742 -38.79533 425.47230
8735.0000 -39.53838 -38.56407 0.97432 1.77339 -38.42528 490.41098
8740.0000 -39.83761 -38.92653 0.91108 1.74563 -38.60879 458.25520
8745.0000 -39.65567 -38.67041 0.98526 1.68705 -38.99608 381.75353
8750.0000 -39.72707 -38.82520 0.90187 1.72762 -38.72786 426.23587
FREEZING PROCESS: loop number 36 T-loop= 391.00000000000000
main_MD> interactions number 36 at Temperature= 391.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.44865 -0.10867 -1.47755
force_rgl> df(natom) -0.17705 1.11331 0.09597
8755.0000 -39.95731 -39.11877 0.83854 1.70672 -38.86604 401.06686
8760.0000 -39.92365 -39.12743 0.79622 1.67360 -39.08500 360.88899
8765.0000 -39.77588 -39.09156 0.68432 1.65961 -39.17752 328.52329
8770.0000 -39.93346 -39.13883 0.79463 1.67335 -39.08667 348.48970
8775.0000 -39.62474 -38.82248 0.80226 1.69508 -38.94297 399.24400
8780.0000 -39.38055 -38.68099 0.69957 1.72428 -38.74995 411.85963
8785.0000 -39.99487 -39.12089 0.87398 1.68371 -39.01815 356.85014
8790.0000 -39.96696 -39.26670 0.70025 1.66716 -39.12760 349.45615
8795.0000 -39.79173 -39.11601 0.67572 1.64710 -39.26024 315.87537
8800.0000 -40.19634 -39.38347 0.81288 1.64335 -39.28503 311.78001
8805.0000 -39.93285 -39.39741 0.53544 1.65786 -39.18910 329.38462
8810.0000 -39.70895 -38.70408 1.00486 1.67261 -39.09158 343.16303
8815.0000 -39.41311 -38.67604 0.73707 1.76209 -38.49999 455.17792
8820.0000 -39.77762 -39.11437 0.66325 1.73694 -38.66624 421.66790
8825.0000 -39.92259 -39.19450 0.72809 1.67824 -39.05435 358.40714
8830.0000 -39.84543 -39.09481 0.75062 1.66771 -39.12393 352.01365
8835.0000 -39.75841 -39.06173 0.69668 1.66462 -39.14440 354.95587
8840.0000 -39.67022 -38.98180 0.68842 1.69998 -38.91059 379.46826
8845.0000 -39.68047 -38.93200 0.74846 1.67936 -39.04694 359.91014
8850.0000 -39.40982 -38.49047 0.91935 1.73788 -38.66004 452.53318
8855.0000 -39.66227 -38.90498 0.75729 1.74949 -38.58329 462.38411
8860.0000 -39.79088 -38.89522 0.89566 1.70573 -38.87255 389.51900
8865.0000 -39.92587 -38.97071 0.95516 1.70713 -38.86333 390.61423
8870.0000 -39.84708 -38.78510 1.06198 1.70576 -38.87238 405.41175
8875.0000 -39.69196 -38.81102 0.88094 1.68960 -38.97925 363.49224
8880.0000 -39.76157 -39.00669 0.75488 1.68972 -38.97843 366.59548
8885.0000 -39.82203 -39.05298 0.76904 1.67132 -39.10012 353.16381
8890.0000 -39.76352 -38.93215 0.83137 1.69619 -38.93567 381.36796
8895.0000 -40.01483 -38.96607 1.04876 1.71299 -38.82460 416.78658
8900.0000 -39.69180 -38.57538 1.11642 1.73378 -38.68716 426.62433
8905.0000 -40.18786 -39.01045 1.17741 1.72048 -38.77506 423.15030
8910.0000 -39.50189 -38.62770 0.87420 1.67635 -39.06685 367.80874
8915.0000 -39.81144 -38.73610 1.07533 1.72466 -38.74744 426.94957
8920.0000 -39.61786 -38.89617 0.72170 1.71400 -38.81790 394.51353
8925.0000 -39.83393 -39.07166 0.76227 1.69052 -38.97317 380.09307
8930.0000 -40.03860 -38.88576 1.15284 1.68617 -39.00194 364.82147
8935.0000 -39.09523 -38.48865 0.60658 1.74130 -38.63744 425.52812
8940.0000 -39.94564 -39.04924 0.89640 1.70918 -38.84978 403.90978
8945.0000 -39.89870 -39.20893 0.68977 1.68195 -39.02982 362.73494
8950.0000 -39.90037 -38.82196 1.07841 1.66875 -39.11710 363.74486
8955.0000 -39.56719 -38.66772 0.89948 1.74146 -38.63632 454.09763
8960.0000 -39.79884 -38.82420 0.97464 1.70461 -38.88001 391.48161
8965.0000 -39.79358 -38.51871 1.27487 1.75488 -38.54763 468.12278
8970.0000 -39.75491 -39.07533 0.67958 1.71327 -38.82274 413.80197
8975.0000 -39.81224 -38.96473 0.84751 1.66930 -39.11342 353.12001
8980.0000 -39.87500 -38.87484 1.00015 1.70376 -38.88558 392.68986
8985.0000 -39.65047 -39.08314 0.56733 1.68102 -39.03594 365.77310
8990.0000 -39.56031 -38.60899 0.95133 1.69873 -38.91887 387.86535
8995.0000 -39.65768 -38.82950 0.82817 1.72549 -38.74193 422.16085
9000.0000 -39.60429 -38.51648 1.08781 1.72448 -38.74864 418.12247
FREEZING PROCESS: loop number 37 T-loop= 366.00000000000000
main_MD> interactions number 37 at Temperature= 366.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.18318 1.08697 1.08399
force_rgl> df(natom) 2.56494 3.30205 -0.94362
9005.0000 -39.61814 -38.62629 0.99185 1.71988 -38.77903 421.80696
9010.0000 -39.87825 -38.95710 0.92116 1.68434 -39.01401 357.22148
9015.0000 -39.66893 -38.82980 0.83913 1.70623 -38.86928 395.08342
9020.0000 -39.89134 -38.95474 0.93660 1.72061 -38.77424 423.14669
9025.0000 -39.75216 -38.99237 0.75979 1.67381 -39.08364 328.38426
9030.0000 -39.79220 -38.66360 1.12860 1.69832 -38.92158 367.40873
9035.0000 -39.73805 -38.81262 0.92542 1.72256 -38.76132 423.81073
9040.0000 -39.40083 -38.65292 0.74791 1.73722 -38.66436 449.10687
9045.0000 -39.53529 -38.52240 1.01289 1.72636 -38.73619 419.78123
9050.0000 -39.78454 -38.87535 0.90919 1.72311 -38.75770 427.62166
9055.0000 -39.36553 -38.59603 0.76949 1.72779 -38.72675 439.90878
9060.0000 -39.64322 -38.81615 0.82707 1.72578 -38.74000 417.84626
9065.0000 -39.80516 -38.91729 0.88787 1.72134 -38.76936 402.92929
9070.0000 -39.76340 -38.81534 0.94806 1.71163 -38.83355 426.24290
9075.0000 -39.71630 -38.89739 0.81891 1.70128 -38.90199 408.25192
9080.0000 -39.64799 -39.02990 0.61809 1.71337 -38.82210 406.65963
9085.0000 -39.56592 -38.50823 1.05768 1.73814 -38.65832 437.03190
9090.0000 -39.93585 -39.10946 0.82639 1.71795 -38.79180 415.96264
9095.0000 -39.89002 -39.29707 0.59295 1.65731 -39.19269 319.97544
9100.0000 -39.84337 -39.13746 0.70591 1.65210 -39.22716 312.63916
9105.0000 -39.79934 -39.17374 0.62560 1.66040 -39.17226 318.43260
9110.0000 -39.85644 -39.08163 0.77481 1.65776 -39.18974 331.89681
9115.0000 -39.80083 -39.03894 0.76189 1.66476 -39.14346 341.41138
9120.0000 -40.08540 -38.95209 1.13331 1.68147 -39.03301 360.92641
9125.0000 -39.70220 -38.79452 0.90767 1.70569 -38.87287 390.03403
9130.0000 -39.65793 -39.02202 0.63591 1.71536 -38.80894 415.20750
9135.0000 -39.70434 -39.20018 0.50416 1.64139 -39.29797 309.75177
9140.0000 -39.81889 -39.09057 0.72831 1.67736 -39.06013 353.61787
9145.0000 -39.95782 -38.89657 1.06125 1.72067 -38.77384 415.21731
9150.0000 -39.21094 -38.72314 0.48780 1.69106 -38.96957 375.33358
9155.0000 -39.62654 -38.73812 0.88842 1.72696 -38.73220 421.95053
9160.0000 -39.81493 -38.90703 0.90789 1.71055 -38.84070 383.69374
9165.0000 -39.87273 -39.18240 0.69033 1.67650 -39.06587 334.89564
9170.0000 -39.97697 -38.93541 1.04156 1.67506 -39.07534 356.60038
9175.0000 -39.47645 -38.74026 0.73619 1.70532 -38.87532 407.34666
9180.0000 -39.82647 -39.11613 0.71034 1.68290 -39.02353 372.45024
9185.0000 -39.86687 -39.20892 0.65795 1.66039 -39.17235 323.17729
9190.0000 -39.75690 -38.98882 0.76808 1.67966 -39.04494 356.33305
9195.0000 -40.07922 -39.28103 0.79820 1.68595 -39.00337 370.66312
9200.0000 -39.58771 -39.00427 0.58344 1.65550 -39.20466 329.47840
9205.0000 -39.75010 -38.97731 0.77279 1.69609 -38.93630 379.08923
9210.0000 -39.77246 -39.08092 0.69155 1.68135 -39.03376 346.30446
9215.0000 -39.61464 -38.82091 0.79373 1.67682 -39.06373 335.73956
9220.0000 -40.00392 -39.10812 0.89579 1.70189 -38.89800 382.97103
9225.0000 -39.81329 -39.33224 0.48105 1.65830 -39.18620 339.18083
9230.0000 -39.84571 -39.11993 0.72578 1.65386 -39.21552 316.38624
9235.0000 -39.86722 -38.92065 0.94657 1.66472 -39.14370 356.07972
9240.0000 -39.94311 -39.16060 0.78251 1.67700 -39.06252 357.59500
9245.0000 -39.95894 -39.33271 0.62623 1.65131 -39.23238 305.88154
9250.0000 -39.83316 -39.05770 0.77546 1.64968 -39.24317 302.93594
FREEZING PROCESS: loop number 38 T-loop= 341.00000000000000
main_MD> interactions number 38 at Temperature= 341.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.99304 -1.85030 2.60765
force_rgl> df(natom) -0.22507 -1.49255 0.50962
9255.0000 -40.03771 -39.56714 0.47056 1.64568 -39.26959 316.94589
9260.0000 -39.98995 -39.45212 0.53783 1.62125 -39.43115 283.32625
9265.0000 -40.12556 -38.93930 1.18627 1.64234 -39.29170 316.16320
9270.0000 -39.99111 -39.46112 0.52999 1.66036 -39.17253 346.17745
9275.0000 -40.17929 -39.44753 0.73176 1.61918 -39.44484 270.30978
9280.0000 -39.69668 -39.08532 0.61135 1.65737 -39.19233 328.47081
9285.0000 -39.89530 -39.11901 0.77629 1.67054 -39.10527 325.95586
9290.0000 -39.84775 -39.01013 0.83763 1.65741 -39.19207 315.91818
9295.0000 -39.96890 -39.07999 0.88891 1.66533 -39.13968 343.40792
9300.0000 -39.81685 -39.14142 0.67543 1.66488 -39.14266 337.82930
9305.0000 -39.92447 -39.30192 0.62255 1.66387 -39.14936 331.13592
9310.0000 -39.58482 -38.86734 0.71748 1.67314 -39.08805 339.23183
9315.0000 -39.87817 -39.02765 0.85052 1.70921 -38.84959 387.29781
9320.0000 -40.13206 -39.14292 0.98914 1.66555 -39.13821 349.08820
9325.0000 -39.98908 -39.43906 0.55002 1.62346 -39.41653 267.98950
9330.0000 -39.86137 -39.01936 0.84201 1.65134 -39.23220 322.77086
9335.0000 -39.61100 -38.63948 0.97152 1.70507 -38.87694 386.20016
9340.0000 -39.83316 -39.05142 0.78174 1.69831 -38.92165 431.28698
9345.0000 -39.93206 -39.23442 0.69764 1.64353 -39.28381 312.09889
9350.0000 -39.85195 -39.02812 0.82383 1.65953 -39.17803 344.85506
9355.0000 -39.79977 -39.17090 0.62888 1.64461 -39.27666 315.62182
9360.0000 -40.04714 -39.15132 0.89582 1.67109 -39.10164 349.62156
9365.0000 -39.79726 -39.17057 0.62669 1.65020 -39.23971 325.12054
9370.0000 -39.79364 -38.67212 1.12152 1.68115 -39.03512 364.99016
9375.0000 -39.52668 -38.73268 0.79400 1.73204 -38.69864 438.60834
9380.0000 -39.97967 -39.13261 0.84706 1.67517 -39.07460 340.19169
9385.0000 -39.62750 -38.99649 0.63101 1.67180 -39.09691 335.04756
9390.0000 -39.64510 -39.08638 0.55873 1.67148 -39.09900 329.56512
9395.0000 -40.01962 -39.22438 0.79525 1.66311 -39.15439 334.29654
9400.0000 -39.87787 -39.13690 0.74097 1.66289 -39.15585 342.17660
9405.0000 -39.97909 -39.31029 0.66881 1.66411 -39.14777 338.05767
9410.0000 -39.94353 -39.13238 0.81115 1.64584 -39.26852 305.40528
9415.0000 -39.81819 -38.78182 1.03636 1.69645 -38.93397 397.67363
9420.0000 -39.98515 -39.10696 0.87819 1.68711 -38.99568 372.18823
9425.0000 -39.38105 -38.68809 0.69297 1.70404 -38.88378 380.78939
9430.0000 -39.93540 -38.90705 1.02835 1.72497 -38.74540 442.60887
9435.0000 -39.98920 -39.33880 0.65041 1.68438 -39.01374 358.55422
9440.0000 -39.65954 -39.07840 0.58113 1.62957 -39.37608 285.41160
9445.0000 -40.11840 -39.59838 0.52002 1.63539 -39.33762 297.87435
9450.0000 -40.15624 -39.74307 0.41317 1.60987 -39.50638 263.38499
9455.0000 -39.80319 -39.06618 0.73701 1.60552 -39.53509 249.32949
9460.0000 -40.09216 -39.22585 0.86632 1.66141 -39.16558 337.44177
9465.0000 -39.98114 -39.23452 0.74662 1.65266 -39.22347 333.20126
9470.0000 -40.05784 -39.47082 0.58701 1.63593 -39.33405 294.83400
9475.0000 -39.89155 -39.26710 0.62444 1.63799 -39.32045 302.52919
9480.0000 -39.91416 -39.02931 0.88485 1.69063 -38.97239 379.87877
9485.0000 -39.75792 -39.14091 0.61701 1.65393 -39.21504 331.27383
9490.0000 -40.05394 -39.27631 0.77763 1.67298 -39.08908 357.34487
9495.0000 -40.02798 -39.17475 0.85323 1.66203 -39.16148 340.68252
9500.0000 -39.71266 -39.09147 0.62119 1.66537 -39.13945 354.18602
FREEZING PROCESS: loop number 39 T-loop= 316.00000000000000
main_MD> interactions number 39 at Temperature= 316.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.20797 -1.22894 -0.23901
force_rgl> df(natom) -1.54660 0.71767 -2.06477
9505.0000 -39.89025 -39.14491 0.74534 1.67016 -39.10773 361.32304
9510.0000 -39.71545 -38.72104 0.99442 1.67787 -39.05677 359.14446
9515.0000 -39.85832 -39.09344 0.76488 1.70892 -38.85147 413.73313
9520.0000 -39.70947 -39.01824 0.69122 1.69201 -38.96329 384.66152
9525.0000 -40.02588 -39.34785 0.67802 1.65245 -39.22486 332.40636
9530.0000 -39.79372 -39.11330 0.68042 1.62759 -39.38918 289.52393
9535.0000 -39.99701 -39.61231 0.38471 1.64285 -39.28829 304.06979
9540.0000 -40.01536 -39.38971 0.62565 1.60743 -39.52247 250.59589
9545.0000 -39.93351 -39.02884 0.90467 1.66908 -39.11492 351.31125
9550.0000 -40.12846 -39.50772 0.62074 1.64613 -39.26665 307.92769
9555.0000 -39.84192 -39.16523 0.67669 1.62616 -39.39867 275.60307
9560.0000 -40.17473 -39.42458 0.75015 1.65036 -39.23867 317.95667
9565.0000 -39.87201 -39.10724 0.76477 1.65218 -39.22663 322.04241
9570.0000 -39.95034 -39.32527 0.62507 1.63628 -39.33174 294.14520
9575.0000 -39.93817 -39.38856 0.54961 1.65530 -39.20603 327.90867
9580.0000 -39.90973 -39.24134 0.66839 1.62466 -39.40855 266.13354
9585.0000 -39.68193 -38.98976 0.69217 1.68426 -39.01451 351.30579
9590.0000 -40.00204 -39.41453 0.58752 1.69016 -38.97552 342.62957
9595.0000 -39.83087 -39.01248 0.81838 1.66006 -39.17456 310.66978
9600.0000 -39.48235 -38.80149 0.68086 1.69437 -38.94772 360.30820
9605.0000 -39.65832 -38.79206 0.86626 1.71713 -38.79721 388.00424
9610.0000 -39.82169 -39.35899 0.46270 1.67268 -39.09107 331.91470
9615.0000 -40.00534 -39.43742 0.56792 1.62556 -39.40264 264.70711
9620.0000 -39.76880 -39.26612 0.50268 1.61913 -39.44517 259.13940
9625.0000 -39.99864 -39.18569 0.81295 1.62488 -39.40710 266.09523
9630.0000 -39.73313 -38.85382 0.87931 1.66565 -39.13755 338.73313
9635.0000 -39.96712 -39.14601 0.82111 1.68229 -39.02755 348.44850
9640.0000 -39.57119 -38.75749 0.81371 1.69003 -38.97637 361.05014
9645.0000 -39.98788 -39.09378 0.89411 1.70992 -38.84486 404.61562
9650.0000 -39.70789 -38.89043 0.81746 1.68350 -39.01958 363.02438
9655.0000 -39.72590 -39.14931 0.57658 1.68438 -39.01375 363.15800
9660.0000 -39.91254 -39.30359 0.60895 1.65337 -39.21875 329.67161
9665.0000 -40.03635 -39.35510 0.68126 1.63211 -39.35929 295.41745
9670.0000 -39.81448 -39.20414 0.61034 1.66607 -39.13478 328.70375
9675.0000 -40.05106 -39.30377 0.74729 1.65369 -39.21664 319.98657
9680.0000 -40.02681 -39.27439 0.75242 1.64569 -39.26952 303.28836
9685.0000 -40.02041 -39.45141 0.56900 1.64624 -39.26593 322.08168
9690.0000 -40.04051 -39.30010 0.74041 1.62718 -39.39191 275.15537
9695.0000 -39.95548 -39.20168 0.75380 1.65264 -39.22356 319.07803
9700.0000 -39.99418 -39.18663 0.80754 1.65318 -39.22002 313.94313
9705.0000 -40.13700 -39.59729 0.53971 1.60886 -39.51307 250.75373
9710.0000 -40.14228 -39.52848 0.61380 1.59455 -39.60765 232.98161
9715.0000 -40.08589 -39.38410 0.70179 1.62615 -39.39872 281.96057
9720.0000 -39.91365 -39.35043 0.56322 1.63154 -39.36307 302.87487
9725.0000 -40.02777 -39.24310 0.78468 1.64085 -39.30157 311.04063
9730.0000 -39.87576 -39.21034 0.66542 1.66205 -39.16134 333.75662
9735.0000 -39.99329 -39.38161 0.61168 1.66748 -39.12548 345.25586
9740.0000 -40.13583 -39.51561 0.62023 1.61862 -39.44851 281.54432
9745.0000 -39.95745 -39.32070 0.63675 1.64089 -39.30130 308.87936
9750.0000 -40.05651 -39.36801 0.68849 1.63534 -39.33800 298.81304
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 2 [min], 24.4092784 [s].
main_MD> Deallocating global variables
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