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nanoparticlesims/growth_Melting_Silver_ICO_4091/freezeSims/run_26/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_26.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 = 26 ntipo2 = 0
read_input> Finish reading input
main_MD> Allocating global variables
main_MD> Number of outputs that will be created: 1900
main_MD> Size of nv and nvoiz: 26 2600
main_MD> Size of nv and nvoiz: 26 2600
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 = 26
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> 8.2184493626747082E-002 -5.1199704281401089E-002 -0.26498106155616996 initial drift of cluster / NP1 for coalescence
init> 0.44511239494169658 0.36744398610228751 0.25906660408155224 scaling for velocity /for coalescence NP1
init.f90 > facguy = 3.8291834126275353E-003
preparo> IN BIGVOI : LIMIT 1.2247448652052084 1.2247448652052084 1.2247448652052084
preparo> END t=0 TIME STEP
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.09424 -3.28634 -1.28907
force_rgl> df(natom) 0.88967 3.01571 -0.65207
preparo> THERMALIZATION PROCESS AT 1273.7570763038339
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -50.915848620087246 7.2434505949703443 -58.159299215057594 6.5382392540610243E-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 38
FREEZING PROCESS: loop number 1 T-loop= 1247.0000000000000
main_MD> interactions number 1 at Temperature= 1247.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.76029 2.77549 2.01146
force_rgl> df(natom) -0.85417 0.57414 -0.90560
5.0000 -57.04563 -51.19002 5.85561 2.87393 -51.47729 1584.89777
10.0000 -56.23104 -51.44252 4.78852 2.78580 -52.25075 1435.08665
15.0000 -56.55705 -52.50383 4.05323 2.80878 -52.04909 1378.89165
20.0000 -56.64469 -52.08405 4.56063 2.70399 -52.96873 1298.93128
25.0000 -55.70097 -51.76760 3.93337 2.78046 -52.29758 1372.92775
30.0000 -56.39846 -51.77442 4.62404 2.77378 -52.35629 1346.48394
35.0000 -57.95542 -53.25228 4.70314 2.75234 -52.54439 1354.27457
40.0000 -56.47351 -52.35136 4.12215 2.67574 -53.21668 1295.64303
45.0000 -56.85231 -52.56677 4.28554 2.81154 -52.02484 1400.34516
50.0000 -57.81620 -52.27298 5.54322 2.74988 -52.56598 1396.21096
55.0000 -57.17199 -52.27190 4.90009 2.83482 -51.82051 1411.21391
60.0000 -57.05504 -52.82815 4.22688 2.73791 -52.67103 1373.71459
65.0000 -57.43779 -52.79125 4.64654 2.69964 -53.00692 1341.94917
70.0000 -57.81928 -54.28043 3.53885 2.66207 -53.33666 1312.66079
75.0000 -57.42825 -52.71572 4.71253 2.62036 -53.70271 1209.84199
80.0000 -58.63053 -54.38807 4.24245 2.52120 -54.57301 1118.28908
85.0000 -59.11772 -54.72949 4.38824 2.57360 -54.11312 1168.22883
90.0000 -57.69937 -52.67101 5.02836 2.65253 -53.42035 1307.16250
95.0000 -56.11866 -51.62314 4.49552 2.77693 -52.32862 1459.66032
100.0000 -57.13656 -53.00849 4.12807 2.73682 -52.68063 1302.91907
105.0000 -57.31423 -53.03485 4.27939 2.77059 -52.38421 1401.60552
110.0000 -58.05956 -54.63880 3.42076 2.62861 -53.63033 1171.71440
115.0000 -58.84006 -53.71804 5.12202 2.56180 -54.21663 1247.38830
120.0000 -57.82340 -53.47834 4.34506 2.63917 -53.53767 1223.86377
125.0000 -57.92570 -54.06047 3.86522 2.66561 -53.30559 1329.94886
130.0000 -58.03519 -54.23824 3.79695 2.50314 -54.73149 1126.94159
135.0000 -57.73561 -52.27172 5.46389 2.67956 -53.18320 1334.73756
140.0000 -58.35382 -53.97186 4.38196 2.71990 -52.82908 1412.37246
145.0000 -57.42557 -53.39805 4.02752 2.56879 -54.15530 1206.20202
150.0000 -57.11756 -52.43272 4.68484 2.79464 -52.17321 1452.39379
155.0000 -56.68414 -51.92113 4.76301 2.73673 -52.68142 1345.85382
160.0000 -59.30124 -55.34162 3.95961 2.66571 -53.30474 1266.35627
165.0000 -58.36428 -55.45344 2.91083 2.44568 -55.23581 1037.38350
170.0000 -58.73053 -54.73971 3.99082 2.47629 -54.96714 1107.68310
175.0000 -58.20008 -54.50133 3.69875 2.53289 -54.47038 1192.61506
180.0000 -57.43152 -53.87864 3.55289 2.54374 -54.37518 1190.32148
185.0000 -57.66878 -54.54590 3.12288 2.60609 -53.82791 1281.34522
190.0000 -58.44056 -55.67775 2.76281 2.47443 -54.98350 1107.11692
195.0000 -59.59673 -54.54014 5.05659 2.47695 -54.96133 1139.83731
200.0000 -57.19270 -51.39581 5.79689 2.72779 -52.75989 1442.86172
205.0000 -56.13799 -50.87662 5.26137 2.92139 -51.06073 1440.84502
210.0000 -57.57480 -53.21051 4.36429 2.80240 -52.10507 1362.53975
215.0000 -57.40286 -52.24720 5.15566 2.81847 -51.96405 1334.59353
220.0000 -56.80141 -52.75599 4.04541 2.73257 -52.71793 1301.62453
225.0000 -57.75127 -53.80264 3.94864 2.75665 -52.50654 1357.05425
230.0000 -57.93895 -54.21647 3.72248 2.57926 -54.06340 1183.15449
235.0000 -57.27031 -52.74292 4.52739 2.54597 -54.35556 1190.74407
240.0000 -58.10462 -52.74682 5.35780 2.68978 -53.09347 1323.85881
245.0000 -57.37236 -53.76262 3.60974 2.64842 -53.45647 1304.11262
250.0000 -58.26281 -53.50545 4.75736 2.68521 -53.13353 1280.44797
FREEZING PROCESS: loop number 2 T-loop= 1222.0000000000000
main_MD> interactions number 2 at Temperature= 1222.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.96509 0.23980 -1.02880
force_rgl> df(natom) 6.31594 2.71509 -5.60776
255.0000 -57.20716 -53.53820 3.66896 2.70827 -52.93123 1257.48524
260.0000 -58.18382 -53.93662 4.24720 2.55696 -54.25911 1127.72607
265.0000 -57.67238 -53.86298 3.80940 2.62279 -53.68137 1246.69849
270.0000 -55.80327 -51.47848 4.32479 2.83760 -51.79610 1424.30802
275.0000 -56.17160 -51.91844 4.25316 2.84436 -51.73683 1482.73905
280.0000 -56.32347 -51.87187 4.45160 2.78283 -52.27678 1238.99990
285.0000 -58.53345 -53.69359 4.83986 2.78529 -52.25526 1386.96297
290.0000 -58.20565 -54.19755 4.00809 2.58402 -54.02163 1165.46284
295.0000 -57.34491 -54.57590 2.76901 2.60115 -53.87134 1138.93069
300.0000 -58.64648 -55.25733 3.38914 2.41715 -55.48619 1000.17503
305.0000 -57.40454 -54.46850 2.93604 2.51871 -54.59485 1119.17015
310.0000 -57.81699 -52.49773 5.31927 2.62405 -53.67037 1297.50692
315.0000 -56.49865 -51.89112 4.60754 2.70858 -52.92844 1324.54861
320.0000 -57.07023 -53.38362 3.68661 2.79201 -52.19626 1335.19743
325.0000 -57.33664 -54.61749 2.71915 2.55664 -54.26193 1163.53621
330.0000 -57.47603 -54.22763 3.24840 2.55506 -54.27579 1191.00532
335.0000 -58.05497 -52.96661 5.08836 2.59362 -53.93739 1225.04459
340.0000 -58.47245 -55.01359 3.45887 2.60620 -53.82697 1259.05093
345.0000 -57.07282 -53.85275 3.22007 2.59808 -53.89827 1137.23102
350.0000 -57.85088 -54.50371 3.34718 2.52945 -54.50056 1101.52310
355.0000 -59.18153 -55.79476 3.38677 2.45022 -55.19592 1073.24568
360.0000 -57.72122 -54.12786 3.59337 2.42379 -55.42793 1044.55983
365.0000 -57.68579 -52.93656 4.74923 2.67913 -53.18696 1324.26103
370.0000 -57.38537 -53.79269 3.59268 2.71368 -52.88373 1264.07529
375.0000 -57.43267 -53.06726 4.36541 2.64352 -53.49942 1230.76643
380.0000 -56.87825 -53.20124 3.67701 2.71074 -52.90948 1284.15870
385.0000 -58.53293 -54.26888 4.26406 2.60381 -53.84797 1178.75688
390.0000 -56.54523 -52.80686 3.73837 2.74238 -52.63180 1358.91159
395.0000 -58.05753 -52.76175 5.29578 2.68203 -53.16152 1358.32783
400.0000 -59.83584 -54.95577 4.88007 2.55346 -54.28988 1220.31042
405.0000 -58.31311 -54.28470 4.02841 2.49707 -54.78479 1073.78470
410.0000 -57.67562 -54.36890 3.30672 2.52694 -54.52260 1121.58349
415.0000 -57.12180 -52.18526 4.93654 2.65976 -53.35693 1239.93685
420.0000 -58.01645 -52.53281 5.48365 2.81439 -51.99983 1470.46763
425.0000 -56.92710 -52.05867 4.86843 2.80486 -52.08347 1418.76999
430.0000 -58.27808 -54.24985 4.02823 2.59573 -53.91890 1244.40741
435.0000 -57.40074 -52.91693 4.48380 2.60394 -53.84685 1259.60969
440.0000 -57.76917 -52.17379 5.59538 2.72044 -52.82442 1409.72212
445.0000 -57.18598 -53.22929 3.95668 2.65382 -53.40909 1287.07608
450.0000 -57.53115 -53.92209 3.60906 2.59236 -53.94847 1224.08245
455.0000 -58.20090 -52.64438 5.55652 2.73594 -52.68835 1309.23481
460.0000 -58.55067 -54.33378 4.21689 2.57458 -54.10449 1156.81853
465.0000 -57.20940 -54.63101 2.57840 2.55569 -54.27025 1152.46845
470.0000 -57.86890 -53.45319 4.41571 2.60855 -53.80639 1277.46648
475.0000 -58.41569 -55.56088 2.85481 2.49797 -54.77687 1118.80608
480.0000 -59.01484 -55.32696 3.68788 2.46402 -55.07477 1129.95064
485.0000 -58.49358 -55.41227 3.08131 2.37110 -55.89031 1037.68501
490.0000 -58.38973 -54.20195 4.18778 2.46002 -55.10993 1039.89128
495.0000 -59.07866 -54.89464 4.18402 2.48756 -54.86825 1107.74467
500.0000 -59.37181 -54.40803 4.96377 2.43288 -55.34811 1031.92904
FREEZING PROCESS: loop number 3 T-loop= 1197.0000000000000
main_MD> interactions number 3 at Temperature= 1197.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.31600 -2.84827 1.64708
force_rgl> df(natom) 1.42901 -1.75236 -1.79185
505.0000 -57.46155 -52.91421 4.54735 2.56065 -54.22676 1205.82496
510.0000 -57.87809 -54.24100 3.63709 2.65637 -53.38665 1286.53098
515.0000 -59.21391 -54.26480 4.94910 2.53023 -54.49373 1132.23795
520.0000 -57.04137 -52.60709 4.43429 2.62205 -53.68792 1261.34732
525.0000 -58.48313 -53.95139 4.53174 2.62237 -53.68509 1219.31479
530.0000 -58.54397 -53.99999 4.54398 2.63672 -53.55917 1234.06955
535.0000 -58.81190 -55.08940 3.72250 2.56268 -54.20895 1199.86355
540.0000 -57.11676 -52.21935 4.89741 2.66125 -53.34383 1234.02598
545.0000 -57.40968 -52.65108 4.75860 2.75117 -52.55465 1420.34846
550.0000 -57.73950 -54.27692 3.46257 2.67492 -53.22386 1268.50297
555.0000 -58.75243 -54.89351 3.85891 2.60633 -53.82585 1191.98287
560.0000 -59.45990 -55.06757 4.39233 2.55462 -54.27967 1153.97745
565.0000 -57.42756 -52.87445 4.55312 2.61933 -53.71176 1233.63030
570.0000 -56.11000 -50.63794 5.47206 2.76747 -52.41165 1424.18140
575.0000 -57.19936 -53.22970 3.96966 2.86934 -51.51754 1524.89988
580.0000 -58.83331 -53.33863 5.49467 2.61423 -53.75651 1245.60291
585.0000 -56.36014 -52.84966 3.51048 2.69904 -53.01217 1294.98583
590.0000 -58.17135 -53.86753 4.30381 2.63494 -53.57476 1239.23930
595.0000 -57.73500 -53.10324 4.63176 2.66959 -53.27070 1344.89276
600.0000 -56.69996 -51.79406 4.90590 2.75124 -52.55403 1334.86804
605.0000 -56.80014 -52.96131 3.83883 2.83116 -51.85262 1408.46174
610.0000 -57.96101 -52.79085 5.17016 2.71751 -52.85006 1349.68989
615.0000 -57.18638 -52.99638 4.19000 2.70113 -52.99381 1245.99692
620.0000 -57.25848 -52.96719 4.29129 2.69973 -53.00615 1255.30788
625.0000 -57.02373 -52.44601 4.57772 2.65593 -53.39053 1306.16959
630.0000 -57.25799 -52.94977 4.30822 2.70717 -52.94088 1276.26679
635.0000 -56.66211 -53.23747 3.42464 2.72336 -52.79871 1306.07397
640.0000 -58.61504 -53.83832 4.77672 2.64013 -53.52924 1160.33937
645.0000 -58.40930 -54.33527 4.07403 2.50735 -54.69450 1151.52447
650.0000 -57.95703 -53.89635 4.06068 2.49196 -54.82957 1114.00292
655.0000 -59.09099 -54.28844 4.80255 2.54082 -54.40081 1110.74201
660.0000 -56.59704 -52.98269 3.61434 2.56089 -54.22463 1198.94117
665.0000 -56.34249 -52.44619 3.89631 2.65851 -53.36786 1259.05588
670.0000 -57.38518 -52.39945 4.98573 2.72264 -52.80509 1309.92329
675.0000 -57.78728 -52.58438 5.20290 2.80365 -52.09406 1437.41771
680.0000 -58.80299 -55.39423 3.40876 2.67093 -53.25887 1284.85767
685.0000 -56.99501 -53.04548 3.94953 2.60189 -53.86485 1182.64483
690.0000 -57.65985 -53.44637 4.21347 2.68600 -53.12665 1283.77400
695.0000 -58.54533 -54.23086 4.31448 2.57361 -54.11301 1172.33940
700.0000 -58.89084 -55.58837 3.30247 2.47158 -55.00845 1102.20534
705.0000 -59.37282 -55.94963 3.42319 2.44601 -55.23285 1102.07048
710.0000 -58.88629 -54.46864 4.41765 2.48648 -54.87767 1122.71474
715.0000 -58.95119 -54.98625 3.96494 2.53153 -54.48232 1200.61968
720.0000 -58.78394 -54.37299 4.41095 2.47286 -54.99724 1122.68793
725.0000 -58.69990 -54.65462 4.04528 2.58860 -53.98146 1279.59859
730.0000 -57.95531 -53.17345 4.78187 2.60077 -53.87464 1217.33903
735.0000 -57.48055 -53.56535 3.91520 2.59782 -53.90057 1170.60251
740.0000 -58.59741 -54.60977 3.98763 2.59253 -53.94696 1182.31343
745.0000 -58.16334 -53.94309 4.22025 2.62465 -53.66506 1240.96738
750.0000 -57.80744 -53.45644 4.35101 2.61217 -53.77457 1194.18107
FREEZING PROCESS: loop number 4 T-loop= 1172.0000000000000
main_MD> interactions number 4 at Temperature= 1172.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.06834 -1.03725 -4.39842
force_rgl> df(natom) 4.04489 -1.63126 1.00853
755.0000 -57.10482 -52.85511 4.24971 2.59234 -53.94861 1183.68984
760.0000 -59.07823 -55.03940 4.03883 2.61491 -53.75056 1127.66199
765.0000 -58.09791 -54.78965 3.30826 2.51551 -54.62292 1047.49563
770.0000 -57.97586 -54.24534 3.73052 2.60733 -53.81704 1208.52242
775.0000 -57.40240 -53.44889 3.95351 2.62777 -53.63767 1258.10860
780.0000 -58.01739 -54.92773 3.08966 2.51945 -54.58837 1116.45806
785.0000 -59.02127 -55.68925 3.33201 2.43846 -55.29911 1018.28751
790.0000 -58.20580 -55.40774 2.79805 2.42613 -55.40736 1051.26793
795.0000 -59.02452 -54.72446 4.30006 2.49170 -54.83187 1105.35707
800.0000 -56.96746 -53.13345 3.83401 2.58378 -54.02373 1211.92973
805.0000 -57.06556 -53.05807 4.00749 2.63666 -53.55967 1290.15491
810.0000 -57.70627 -53.20542 4.50086 2.65649 -53.38567 1248.98428
815.0000 -57.78965 -53.07154 4.71811 2.65625 -53.38772 1247.84493
820.0000 -57.98345 -54.60156 3.38190 2.57063 -54.13913 1173.32569
825.0000 -56.44286 -53.29607 3.14679 2.60542 -53.83385 1230.78405
830.0000 -58.84065 -53.87308 4.96757 2.63180 -53.60228 1189.57076
835.0000 -58.30888 -54.48066 3.82821 2.54499 -54.36416 1142.69085
840.0000 -58.47927 -54.27000 4.20928 2.56486 -54.18976 1156.56911
845.0000 -56.61402 -52.98248 3.63154 2.65582 -53.39147 1283.91460
850.0000 -58.18181 -53.93938 4.24242 2.63307 -53.59114 1252.97646
855.0000 -58.81237 -55.05768 3.75469 2.54704 -54.34617 1204.70179
860.0000 -58.20901 -53.53561 4.67340 2.54793 -54.33836 1150.30514
865.0000 -58.27106 -54.87253 3.39852 2.59342 -53.93913 1141.34417
870.0000 -59.89954 -55.16023 4.73931 2.43269 -55.34981 1001.21864
875.0000 -58.43299 -54.75507 3.67793 2.44213 -55.26694 1082.69122
880.0000 -58.00265 -53.91257 4.09009 2.59229 -53.94911 1210.57683
885.0000 -58.44706 -54.93354 3.51352 2.50978 -54.67322 1116.83141
890.0000 -58.82014 -54.56113 4.25901 2.50392 -54.72462 1137.17381
895.0000 -58.38149 -54.52306 3.85842 2.53690 -54.43519 1179.77069
900.0000 -57.88243 -54.77042 3.11201 2.46400 -55.07503 1049.78879
905.0000 -57.06076 -53.24001 3.82075 2.56013 -54.23134 1197.91811
910.0000 -57.93217 -53.05785 4.87431 2.63779 -53.54975 1248.57108
915.0000 -57.21349 -51.30377 5.90972 2.82818 -51.87880 1294.44412
920.0000 -57.82170 -53.73517 4.08652 2.69761 -53.02475 1375.47826
925.0000 -58.22028 -54.94967 3.27061 2.43406 -55.33772 1044.43247
930.0000 -57.49187 -53.31597 4.17591 2.59814 -53.89769 1183.28343
935.0000 -57.64163 -53.95796 3.68367 2.64855 -53.45532 1229.30828
940.0000 -57.14425 -52.62532 4.51893 2.61819 -53.72174 1247.56159
945.0000 -57.37622 -53.81904 3.55718 2.70406 -52.96810 1261.87422
950.0000 -57.64838 -53.94686 3.70151 2.66194 -53.33779 1242.49816
955.0000 -57.97626 -55.11561 2.86065 2.52132 -54.57191 1088.12571
960.0000 -58.19498 -54.79450 3.40047 2.50388 -54.72499 1153.42340
965.0000 -58.66346 -55.00552 3.65794 2.55616 -54.26616 1176.18353
970.0000 -59.00047 -54.01528 4.98519 2.56574 -54.18210 1211.28098
975.0000 -58.09591 -53.65205 4.44387 2.54494 -54.36460 1147.54968
980.0000 -58.02378 -54.55584 3.46795 2.56864 -54.15664 1162.51931
985.0000 -59.27653 -55.99923 3.27730 2.44974 -55.20012 1009.70274
990.0000 -57.86614 -54.54320 3.32294 2.49920 -54.76603 1103.54026
995.0000 -58.58970 -54.60900 3.98070 2.47080 -55.01529 1069.40594
1000.0000 -58.41593 -54.55744 3.85849 2.48999 -54.84694 1010.87256
FREEZING PROCESS: loop number 5 T-loop= 1147.0000000000000
main_MD> interactions number 5 at Temperature= 1147.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.74635 -0.56928 0.50982
force_rgl> df(natom) 1.75900 -0.25861 0.87599
1005.0000 -59.18724 -54.42558 4.76167 2.55018 -54.31863 1162.05302
1010.0000 -57.01513 -53.61784 3.39729 2.65068 -53.43660 1334.43059
1015.0000 -57.47295 -53.55420 3.91875 2.67834 -53.19388 1263.84049
1020.0000 -57.92522 -53.47017 4.45504 2.62876 -53.62904 1203.24735
1025.0000 -58.03178 -53.61643 4.41534 2.69582 -53.04048 1279.45755
1030.0000 -56.79681 -53.07593 3.72088 2.53815 -54.42425 1162.63855
1035.0000 -58.57177 -54.40396 4.16781 2.58315 -54.02931 1157.05156
1040.0000 -58.35589 -54.68204 3.67385 2.59365 -53.93717 1215.34317
1045.0000 -58.77519 -55.76121 3.01398 2.47761 -54.95551 1136.13533
1050.0000 -59.99746 -57.10079 2.89667 2.30448 -56.47499 894.57306
1055.0000 -59.23087 -56.15751 3.07337 2.29961 -56.51776 929.95979
1060.0000 -56.77121 -52.92720 3.84401 2.51428 -54.63376 1142.08336
1065.0000 -56.84465 -53.00812 3.83652 2.65538 -53.39539 1262.43115
1070.0000 -57.95044 -53.58883 4.36161 2.62404 -53.67039 1212.89566
1075.0000 -58.42270 -53.97122 4.45147 2.56499 -54.18866 1144.78610
1080.0000 -56.86307 -52.98410 3.87897 2.67887 -53.18922 1279.36717
1085.0000 -57.16452 -53.48292 3.68160 2.60135 -53.86952 1202.77959
1090.0000 -57.25067 -53.28056 3.97011 2.62323 -53.67751 1248.11364
1095.0000 -57.62474 -53.63744 3.98731 2.64254 -53.50804 1256.49371
1100.0000 -57.86128 -53.66795 4.19334 2.64174 -53.51511 1224.71691
1105.0000 -58.21440 -54.00667 4.20773 2.61691 -53.73299 1154.86439
1110.0000 -57.70383 -53.68582 4.01801 2.61074 -53.78711 1235.55259
1115.0000 -58.38727 -54.45107 3.93619 2.57289 -54.11936 1132.14224
1120.0000 -57.04049 -53.25371 3.78678 2.59978 -53.88337 1164.78911
1125.0000 -59.01935 -54.20576 4.81359 2.62318 -53.67800 1319.64521
1130.0000 -58.00644 -53.88525 4.12119 2.62907 -53.62624 1209.74956
1135.0000 -59.64969 -56.17711 3.47257 2.42487 -55.41843 975.61128
1140.0000 -59.22312 -55.33345 3.88967 2.38089 -55.80435 976.96105
1145.0000 -57.86922 -53.71466 4.15457 2.56799 -54.16234 1215.45432
1150.0000 -57.55271 -53.08715 4.46556 2.63740 -53.55318 1189.68314
1155.0000 -57.96954 -55.31779 2.65174 2.56487 -54.18973 1187.53218
1160.0000 -57.72887 -53.05704 4.67184 2.57386 -54.11085 1163.23415
1165.0000 -57.91745 -54.72426 3.19319 2.56848 -54.15804 1157.49834
1170.0000 -58.56389 -55.13750 3.42639 2.46875 -55.03327 1113.25571
1175.0000 -59.51374 -57.15342 2.36032 2.41052 -55.54435 1051.82405
1180.0000 -60.18331 -56.53572 3.64758 2.31621 -56.37206 895.09015
1185.0000 -58.63974 -54.62098 4.01877 2.37478 -55.85801 1001.11028
1190.0000 -57.53339 -53.89751 3.63588 2.53809 -54.42477 1139.08401
1195.0000 -57.08613 -52.51719 4.56894 2.68800 -53.10906 1294.86689
1200.0000 -57.75688 -53.60422 4.15266 2.66341 -53.32492 1282.58724
1205.0000 -57.82809 -52.49964 5.32845 2.72780 -52.75974 1339.68127
1210.0000 -55.77151 -51.13690 4.63461 2.84210 -51.75665 1372.71016
1215.0000 -57.95256 -53.49713 4.45542 2.69176 -53.07605 1263.28344
1220.0000 -58.19365 -55.19911 2.99453 2.53073 -54.48935 1123.32699
1225.0000 -57.45199 -54.32741 3.12458 2.50431 -54.72117 1117.28355
1230.0000 -58.52592 -53.39497 5.13095 2.58426 -54.01955 1136.67859
1235.0000 -58.48097 -55.73519 2.74578 2.54489 -54.36506 1157.31240
1240.0000 -59.70458 -55.42048 4.28410 2.49882 -54.76941 1146.80881
1245.0000 -59.24863 -54.59862 4.65001 2.53532 -54.44907 1113.16360
1250.0000 -58.39663 -54.37930 4.01733 2.55594 -54.26809 1192.70250
FREEZING PROCESS: loop number 6 T-loop= 1122.0000000000000
main_MD> interactions number 6 at Temperature= 1122.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.76332 2.09231 0.45444
force_rgl> df(natom) -0.67051 -0.53821 1.31869
1255.0000 -58.12421 -54.31034 3.81386 2.52512 -54.53854 1081.82464
1260.0000 -57.96172 -53.70238 4.25934 2.58490 -54.01395 1198.86715
1265.0000 -58.41454 -54.92300 3.49154 2.52204 -54.56561 1122.19844
1270.0000 -58.20890 -54.86928 3.33963 2.44451 -55.24608 1048.48633
1275.0000 -59.92500 -56.47263 3.45237 2.42192 -55.44430 1037.83024
1280.0000 -58.74026 -55.18163 3.55863 2.39597 -55.67204 1046.74371
1285.0000 -58.36463 -55.22953 3.13510 2.47324 -54.99391 1059.50017
1290.0000 -58.92770 -55.17891 3.74880 2.49197 -54.82949 1105.66255
1295.0000 -57.79029 -54.64708 3.14321 2.52880 -54.50630 1166.31845
1300.0000 -58.15621 -54.71559 3.44061 2.49814 -54.77538 1082.28105
1305.0000 -59.27062 -56.02990 3.24072 2.43302 -55.34687 989.02740
1310.0000 -57.41384 -53.40716 4.00668 2.46604 -55.05707 1131.04955
1315.0000 -57.23457 -53.18205 4.05252 2.66890 -53.27672 1267.56567
1320.0000 -58.46830 -53.08449 5.38382 2.59407 -53.93342 1209.61456
1325.0000 -58.29996 -54.53014 3.76981 2.55191 -54.30346 1130.63689
1330.0000 -57.94057 -54.16618 3.77439 2.49977 -54.76107 1086.05782
1335.0000 -58.43219 -54.27406 4.15812 2.51346 -54.64094 1085.57923
1340.0000 -58.68676 -55.23533 3.45143 2.48334 -54.90527 1104.23975
1345.0000 -58.32747 -54.14853 4.17894 2.49894 -54.76832 1054.36943
1350.0000 -58.86740 -55.16760 3.69980 2.42231 -55.44086 1069.76583
1355.0000 -59.64171 -56.84071 2.80100 2.43662 -55.31530 1099.52134
1360.0000 -58.73453 -55.51098 3.22355 2.31355 -56.39543 928.50297
1365.0000 -58.57653 -54.94031 3.63622 2.48436 -54.89629 1100.10292
1370.0000 -58.75826 -55.35861 3.39965 2.49728 -54.78291 1152.01910
1375.0000 -59.73219 -56.89837 2.83383 2.36371 -55.95519 971.51025
1380.0000 -60.32204 -56.83636 3.48568 2.28709 -56.62760 984.90522
1385.0000 -59.17272 -56.81627 2.35645 2.26114 -56.85541 900.72715
1390.0000 -58.62281 -54.65840 3.96440 2.40709 -55.57449 1050.54983
1395.0000 -58.23123 -53.60027 4.63096 2.58387 -54.02298 1200.43170
1400.0000 -58.27426 -54.37960 3.89466 2.57685 -54.08462 1151.77101
1405.0000 -57.63031 -53.34264 4.28767 2.56063 -54.22694 1109.25452
1410.0000 -58.54367 -54.50049 4.04318 2.56392 -54.19807 1231.81238
1415.0000 -59.22823 -55.75198 3.47625 2.43073 -55.36695 1096.99375
1420.0000 -58.02011 -53.77166 4.24845 2.45020 -55.19614 1066.45132
1425.0000 -57.94758 -54.02670 3.92089 2.57085 -54.13720 1051.80070
1430.0000 -58.70768 -55.03584 3.67184 2.52160 -54.56950 1126.24812
1435.0000 -59.52378 -55.91404 3.60974 2.40598 -55.58420 1027.40941
1440.0000 -57.56324 -54.18081 3.38243 2.50057 -54.75401 1134.48970
1445.0000 -58.57591 -55.10047 3.47544 2.52853 -54.50868 1126.24017
1450.0000 -58.78578 -54.66818 4.11761 2.49256 -54.82435 1067.39035
1455.0000 -57.94329 -53.89195 4.05135 2.53056 -54.49083 1128.04075
1460.0000 -57.12897 -53.58812 3.54085 2.61722 -53.73027 1232.03611
1465.0000 -57.85163 -54.05789 3.79375 2.63388 -53.58406 1246.93517
1470.0000 -59.61208 -55.81696 3.79512 2.47687 -54.96205 1127.31023
1475.0000 -59.59336 -55.68490 3.90846 2.28805 -56.61924 900.74383
1480.0000 -59.16536 -55.51283 3.65253 2.42841 -55.38734 1002.38195
1485.0000 -58.29786 -54.56047 3.73740 2.39394 -55.68984 1021.00944
1490.0000 -58.15281 -53.99911 4.15370 2.56337 -54.20288 1099.93244
1495.0000 -58.42359 -54.40990 4.01369 2.58698 -53.99564 1116.28376
1500.0000 -58.12021 -54.73961 3.38060 2.52821 -54.51145 1150.41876
FREEZING PROCESS: loop number 7 T-loop= 1097.0000000000000
main_MD> interactions number 7 at Temperature= 1097.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.84299 -2.71998 -1.65340
force_rgl> df(natom) 1.15526 -1.12673 -0.48263
1505.0000 -60.80438 -56.69744 4.10694 2.44496 -55.24210 1030.22129
1510.0000 -58.84975 -55.67947 3.17028 2.35172 -56.06040 997.05166
1515.0000 -59.17765 -55.68841 3.48924 2.41526 -55.50273 1069.95944
1520.0000 -57.87875 -54.03741 3.84133 2.55516 -54.27495 1136.56621
1525.0000 -60.52918 -55.98411 4.54507 2.51666 -54.61285 1157.98796
1530.0000 -58.67246 -54.99884 3.67362 2.43783 -55.30465 1092.83337
1535.0000 -59.00751 -56.36802 2.63949 2.41707 -55.48685 1024.32288
1540.0000 -58.90599 -55.39673 3.50926 2.38770 -55.74464 1030.17511
1545.0000 -58.42606 -54.88880 3.53727 2.46802 -55.03973 1073.47163
1550.0000 -58.93713 -55.16114 3.77599 2.46996 -55.02272 1105.47088
1555.0000 -58.55944 -54.91457 3.64487 2.46253 -55.08792 1087.84572
1560.0000 -57.89083 -53.36212 4.52871 2.60202 -53.86364 1241.37180
1565.0000 -58.23528 -53.62117 4.61412 2.61063 -53.78810 1202.48649
1570.0000 -59.29624 -54.95834 4.33790 2.55867 -54.24411 1151.09575
1575.0000 -57.84092 -53.39864 4.44228 2.58211 -54.03843 1192.67398
1580.0000 -58.63694 -53.82400 4.81293 2.63325 -53.58961 1309.73303
1585.0000 -58.11155 -54.39119 3.72036 2.50054 -54.75430 1124.92925
1590.0000 -58.44590 -55.01892 3.42698 2.52910 -54.50364 1122.51790
1595.0000 -57.25163 -52.95880 4.29283 2.58035 -54.05387 1209.96772
1600.0000 -57.25032 -52.87774 4.37257 2.69454 -53.05165 1283.42852
1605.0000 -58.23852 -53.76963 4.46889 2.67881 -53.18972 1313.00588
1610.0000 -57.64491 -54.53399 3.11092 2.63147 -53.60521 1220.98902
1615.0000 -58.05398 -54.68464 3.36933 2.49633 -54.79121 1105.18279
1620.0000 -58.23902 -54.21449 4.02453 2.51836 -54.59790 1122.48260
1625.0000 -58.32301 -53.44354 4.87948 2.59706 -53.90723 1260.39194
1630.0000 -58.01336 -53.51616 4.49720 2.68576 -53.12875 1253.60433
1635.0000 -59.37115 -55.97222 3.39893 2.60592 -53.82946 1217.69251
1640.0000 -58.86044 -54.11565 4.74479 2.46718 -55.04710 1066.79513
1645.0000 -57.83501 -54.46784 3.36718 2.55074 -54.31371 1095.18156
1650.0000 -58.60197 -55.39227 3.20971 2.42873 -55.38455 1082.14659
1655.0000 -58.74646 -55.71829 3.02818 2.41130 -55.53755 1011.38884
1660.0000 -59.55897 -54.69377 4.86520 2.42167 -55.44646 1051.88236
1665.0000 -59.25473 -55.82578 3.42895 2.41946 -55.46592 1086.27126
1670.0000 -58.70497 -54.88353 3.82144 2.36337 -55.95812 968.64177
1675.0000 -58.65420 -55.72163 2.93257 2.42950 -55.37777 1022.17131
1680.0000 -57.97028 -55.42630 2.54398 2.44509 -55.24098 1077.78488
1685.0000 -59.18648 -56.24485 2.94164 2.39599 -55.67190 1016.43314
1690.0000 -59.11510 -55.38679 3.72831 2.37373 -55.86728 1002.04076
1695.0000 -59.76076 -56.18726 3.57351 2.42973 -55.37574 1059.49505
1700.0000 -58.65102 -55.77198 2.87904 2.36547 -55.93973 935.35097
1705.0000 -59.01744 -55.68043 3.33701 2.36818 -55.91597 990.84141
1710.0000 -58.13088 -54.55786 3.57302 2.46322 -55.08182 1054.16659
1715.0000 -57.47633 -54.06985 3.40647 2.62359 -53.67433 1265.19539
1720.0000 -58.05473 -53.87954 4.17520 2.54709 -54.34575 1114.46212
1725.0000 -58.93975 -55.23591 3.70383 2.48263 -54.91149 1088.57883
1730.0000 -59.22459 -56.61306 2.61153 2.38949 -55.72893 994.62444
1735.0000 -58.13363 -55.04703 3.08660 2.39356 -55.69322 1012.23573
1740.0000 -59.02967 -55.67603 3.35364 2.42692 -55.40042 1024.47939
1745.0000 -58.17292 -54.63543 3.53749 2.41583 -55.49778 1058.62174
1750.0000 -58.40053 -55.27749 3.12304 2.48009 -54.93374 1084.35012
FREEZING PROCESS: loop number 8 T-loop= 1072.0000000000000
main_MD> interactions number 8 at Temperature= 1072.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.91739 -1.12509 4.21566
force_rgl> df(natom) 0.34857 -11.37082 -2.92041
1755.0000 -59.33450 -55.46613 3.86837 2.40049 -55.63235 1006.08574
1760.0000 -59.83039 -56.32439 3.50600 2.37845 -55.82585 1018.20284
1765.0000 -59.48001 -56.05861 3.42140 2.30684 -56.45430 973.22195
1770.0000 -60.01471 -56.22220 3.79251 2.36234 -55.96722 1020.17431
1775.0000 -59.48462 -56.58441 2.90021 2.33309 -56.22394 964.77899
1780.0000 -58.71219 -55.52246 3.18973 2.37904 -55.82059 986.86369
1785.0000 -59.12270 -55.53823 3.58448 2.44496 -55.24213 975.32683
1790.0000 -58.66154 -54.04714 4.61441 2.43760 -55.30667 1067.73597
1795.0000 -58.16619 -54.36842 3.79777 2.54707 -54.34597 1106.94686
1800.0000 -59.41085 -56.18234 3.22851 2.45456 -55.15781 1063.50198
1805.0000 -58.22905 -55.05914 3.16991 2.39583 -55.67331 986.26510
1810.0000 -58.31352 -54.77255 3.54096 2.48027 -54.93219 1062.94771
1815.0000 -58.40557 -54.32254 4.08304 2.51685 -54.61118 1082.60101
1820.0000 -59.42948 -55.43482 3.99466 2.51176 -54.65586 1086.43676
1825.0000 -58.82619 -55.96679 2.85940 2.44512 -55.24071 1065.03933
1830.0000 -59.12054 -55.76801 3.35253 2.44419 -55.24881 1067.44273
1835.0000 -58.03707 -55.08112 2.95595 2.44798 -55.21560 1055.94431
1840.0000 -59.19719 -55.48661 3.71058 2.47953 -54.93868 1061.10964
1845.0000 -59.48644 -56.02028 3.46615 2.37858 -55.82471 1010.02937
1850.0000 -58.67736 -54.03934 4.63802 2.48352 -54.90366 1165.46881
1855.0000 -57.16640 -53.85702 3.30938 2.61447 -53.75439 1233.04730
1860.0000 -57.46262 -53.80118 3.66144 2.60389 -53.84730 1166.17434
1865.0000 -59.33216 -54.68580 4.64636 2.57962 -54.06024 1205.21507
1870.0000 -58.71542 -55.27852 3.43690 2.51258 -54.64868 1065.26261
1875.0000 -59.23448 -55.62112 3.61336 2.42289 -55.43579 962.24780
1880.0000 -59.08580 -55.68458 3.40122 2.43641 -55.31709 1072.11275
1885.0000 -58.83179 -55.37015 3.46164 2.44621 -55.23112 1033.87839
1890.0000 -59.23263 -56.24855 2.98408 2.36632 -55.93230 987.10728
1895.0000 -58.92280 -54.36328 4.55951 2.47718 -54.95933 1150.94963
1900.0000 -58.53959 -55.32022 3.21937 2.45945 -55.11489 1117.05029
1905.0000 -58.93637 -54.20237 4.73400 2.47069 -55.01631 1060.28317
1910.0000 -58.49373 -54.35695 4.13678 2.49356 -54.81557 1125.86346
1915.0000 -58.75361 -55.71027 3.04334 2.54674 -54.34885 1155.97707
1920.0000 -58.17070 -54.91496 3.25574 2.45000 -55.19785 1074.02845
1925.0000 -58.35873 -54.85378 3.50495 2.37951 -55.81654 1017.50606
1930.0000 -59.21926 -55.80222 3.41704 2.44192 -55.26876 1070.66090
1935.0000 -59.71207 -56.59065 3.12142 2.33630 -56.19574 985.78827
1940.0000 -59.00671 -55.19670 3.81001 2.40681 -55.57692 1056.25471
1945.0000 -59.50802 -55.62909 3.87893 2.31914 -56.34633 1019.20881
1950.0000 -57.62327 -53.79123 3.83203 2.50902 -54.67990 1176.83695
1955.0000 -57.73357 -54.14637 3.58720 2.50509 -54.71441 1027.36684
1960.0000 -57.43073 -53.19441 4.23631 2.62369 -53.67348 1292.07318
1965.0000 -57.53141 -52.96717 4.56424 2.71783 -52.84729 1319.29753
1970.0000 -56.93177 -53.38768 3.54409 2.70275 -52.97961 1294.88846
1975.0000 -58.82603 -54.46261 4.36342 2.61447 -53.75441 1306.10410
1980.0000 -59.11574 -56.49692 2.61881 2.37966 -55.81518 998.42467
1985.0000 -58.57796 -55.13117 3.44679 2.39789 -55.65522 1012.93592
1990.0000 -58.54453 -55.19146 3.35306 2.48772 -54.86681 1190.48604
1995.0000 -58.95233 -55.71938 3.23295 2.50343 -54.72898 1116.48390
2000.0000 -59.32604 -55.64565 3.68038 2.39383 -55.69081 984.52892
FREEZING PROCESS: loop number 9 T-loop= 1047.0000000000000
main_MD> interactions number 9 at Temperature= 1047.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.34646 -0.49574 2.44884
force_rgl> df(natom) 1.08577 1.03403 -1.97865
2005.0000 -58.67248 -55.39579 3.27669 2.37175 -55.88460 1023.39638
2010.0000 -58.66728 -54.46724 4.20004 2.44829 -55.21291 1080.94840
2015.0000 -59.22794 -55.06755 4.16039 2.48543 -54.88692 1058.49526
2020.0000 -58.43071 -54.23040 4.20030 2.44863 -55.20990 1060.42827
2025.0000 -59.00827 -54.86830 4.13997 2.53859 -54.42039 1137.79334
2030.0000 -60.10805 -55.87820 4.22985 2.43523 -55.32747 1078.00991
2035.0000 -58.52263 -55.36682 3.15581 2.48248 -54.91276 1095.58263
2040.0000 -58.23181 -55.09599 3.13582 2.42294 -55.43536 1021.13546
2045.0000 -59.55551 -56.23825 3.31726 2.39860 -55.64897 970.50273
2050.0000 -60.01027 -56.67832 3.33195 2.25364 -56.92123 885.97647
2055.0000 -59.66583 -56.88299 2.78284 2.29483 -56.55972 966.37823
2060.0000 -58.19375 -54.48503 3.70872 2.40076 -55.62997 1011.35303
2065.0000 -58.57598 -54.57019 4.00579 2.57346 -54.11435 1214.45022
2070.0000 -58.74134 -55.13884 3.60250 2.49866 -54.77077 1092.30653
2075.0000 -58.48058 -55.21807 3.26251 2.43136 -55.36142 1045.44920
2080.0000 -58.72183 -54.69322 4.02861 2.38026 -55.80994 972.31942
2085.0000 -59.09806 -55.09787 4.00019 2.49594 -54.79470 1126.56486
2090.0000 -58.78061 -55.76861 3.01200 2.42702 -55.39954 1075.85285
2095.0000 -59.26335 -55.45811 3.80524 2.46497 -55.06647 1137.95641
2100.0000 -57.44286 -53.86069 3.58217 2.54728 -54.34412 1220.76540
2105.0000 -58.16006 -53.97608 4.18397 2.58001 -54.05686 1133.94022
2110.0000 -59.44746 -56.38547 3.06198 2.45870 -55.12153 1053.30389
2115.0000 -59.42479 -55.92578 3.49901 2.31652 -56.36935 982.21586
2120.0000 -59.52780 -55.91425 3.61355 2.36932 -55.90590 998.22100
2125.0000 -58.58945 -55.17292 3.41653 2.36088 -55.97999 1010.48746
2130.0000 -58.85623 -54.88296 3.97327 2.40391 -55.60235 1034.34040
2135.0000 -58.91185 -55.99987 2.91198 2.41315 -55.52123 1020.84359
2140.0000 -57.45157 -54.59453 2.85704 2.43578 -55.32269 1046.44799
2145.0000 -58.28805 -55.10509 3.18296 2.43217 -55.35436 1047.70480
2150.0000 -58.12875 -55.35952 2.76923 2.44856 -55.21051 1003.73632
2155.0000 -59.93440 -56.05404 3.88036 2.31966 -56.34180 958.17004
2160.0000 -59.06328 -56.25398 2.80930 2.36212 -55.96914 993.93817
2165.0000 -59.18719 -54.40348 4.78371 2.39553 -55.67589 974.71822
2170.0000 -58.72588 -54.66084 4.06504 2.54838 -54.33445 1154.43281
2175.0000 -59.55272 -56.26293 3.28978 2.43885 -55.29572 1046.68187
2180.0000 -59.53341 -56.51691 3.01650 2.29601 -56.54937 988.85830
2185.0000 -58.78161 -55.57158 3.21003 2.33012 -56.25001 971.24530
2190.0000 -58.55512 -53.05479 5.50033 2.60509 -53.83673 1247.89508
2195.0000 -58.55409 -54.89013 3.66395 2.64045 -53.52636 1266.70024
2200.0000 -59.05701 -55.10180 3.95521 2.44261 -55.26276 1059.75629
2205.0000 -58.71575 -54.67234 4.04341 2.48226 -54.91475 1087.41341
2210.0000 -58.50596 -54.42687 4.07909 2.54998 -54.32042 1188.87474
2215.0000 -58.33331 -54.91668 3.41663 2.48837 -54.86114 1114.58287
2220.0000 -58.57883 -55.70014 2.87869 2.40282 -55.61192 1006.84110
2225.0000 -59.39690 -55.86345 3.53345 2.36678 -55.92821 937.89923
2230.0000 -59.96975 -56.49313 3.47662 2.30626 -56.45935 889.01055
2235.0000 -58.72859 -54.49821 4.23038 2.41674 -55.48977 991.76602
2240.0000 -58.31129 -54.72694 3.58435 2.55772 -54.25244 1140.68851
2245.0000 -59.06146 -56.49909 2.56237 2.41783 -55.48023 1034.53145
2250.0000 -59.45178 -55.09597 4.35581 2.37218 -55.88087 986.42135
FREEZING PROCESS: loop number 10 T-loop= 1022.0000000000000
main_MD> interactions number 10 at Temperature= 1022.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.35650 -1.32344 0.69992
force_rgl> df(natom) -6.98276 3.05358 -1.22390
2255.0000 -58.64935 -54.55437 4.09498 2.50783 -54.69030 1086.97477
2260.0000 -57.88469 -54.06321 3.82148 2.53182 -54.47980 1138.43735
2265.0000 -59.51304 -56.36639 3.14665 2.38069 -55.80614 1033.31169
2270.0000 -58.51188 -55.34847 3.16341 2.40404 -55.60125 1013.21081
2275.0000 -59.60799 -56.55043 3.05756 2.35197 -56.05819 983.81203
2280.0000 -59.68744 -56.63928 3.04815 2.27913 -56.69749 918.14152
2285.0000 -58.66638 -55.49542 3.17096 2.37616 -55.84588 1043.39402
2290.0000 -58.28054 -55.54641 2.73413 2.39250 -55.70250 979.30859
2295.0000 -59.12283 -55.03414 4.08869 2.47507 -54.97784 1161.69881
2300.0000 -59.45351 -55.87188 3.58163 2.38661 -55.75421 1002.18414
2305.0000 -58.15462 -54.85693 3.29769 2.40893 -55.55829 1029.72041
2310.0000 -59.72336 -56.82455 2.89881 2.46714 -55.04745 1117.18624
2315.0000 -59.66653 -56.55723 3.10930 2.26504 -56.82112 910.61069
2320.0000 -59.44589 -56.21850 3.22739 2.27493 -56.73433 908.51596
2325.0000 -58.57962 -54.58538 3.99424 2.42212 -55.44254 1062.79330
2330.0000 -59.15307 -55.22513 3.92795 2.44758 -55.21911 1099.48806
2335.0000 -58.55075 -55.24460 3.30616 2.42568 -55.41132 1033.71133
2340.0000 -58.63090 -55.83329 2.79761 2.43584 -55.32218 1034.03992
2345.0000 -58.56127 -54.80296 3.75831 2.43367 -55.34115 1067.53338
2350.0000 -59.12663 -55.62992 3.49671 2.44841 -55.21182 1097.88001
2355.0000 -58.50832 -55.47072 3.03760 2.46350 -55.07939 1119.59833
2360.0000 -58.29824 -54.84494 3.45330 2.42659 -55.40335 1021.26911
2365.0000 -59.36061 -56.29498 3.06562 2.37658 -55.84223 997.99445
2370.0000 -58.42215 -53.53334 4.88882 2.39851 -55.64978 1033.01341
2375.0000 -58.75796 -54.88267 3.87529 2.54718 -54.34493 1187.30049
2380.0000 -60.57878 -56.91517 3.66361 2.34096 -56.15486 1012.59595
2385.0000 -59.10694 -55.87747 3.22947 2.26614 -56.81151 917.88789
2390.0000 -58.67950 -53.88744 4.79206 2.50006 -54.75852 1080.78966
2395.0000 -57.77568 -54.27573 3.49995 2.54890 -54.32989 1110.49890
2400.0000 -58.71148 -55.10221 3.60927 2.55056 -54.31528 1229.40701
2405.0000 -59.36150 -56.68417 2.67733 2.45303 -55.17128 1037.57691
2410.0000 -60.28594 -57.23643 3.04952 2.27301 -56.75118 884.39700
2415.0000 -59.07615 -55.83199 3.24416 2.31519 -56.38105 953.09148
2420.0000 -57.48923 -53.80941 3.67982 2.49234 -54.82625 1145.31106
2425.0000 -57.69809 -54.05331 3.64478 2.54565 -54.35844 1123.45383
2430.0000 -58.77092 -54.18800 4.58292 2.53973 -54.41038 1112.84926
2435.0000 -58.27722 -54.59438 3.68284 2.47582 -54.97123 1052.00499
2440.0000 -60.11751 -56.66097 3.45654 2.42484 -55.41868 1102.56542
2445.0000 -58.99167 -55.15666 3.83501 2.34529 -56.11683 1009.48478
2450.0000 -59.34049 -55.24455 4.09594 2.43109 -55.36380 1123.84768
2455.0000 -59.07075 -54.97241 4.09834 2.44514 -55.24049 1073.17587
2460.0000 -59.27372 -55.72583 3.54789 2.40247 -55.61503 1004.79267
2465.0000 -59.31329 -56.44591 2.86738 2.36808 -55.91680 1010.34889
2470.0000 -58.43275 -55.36105 3.07169 2.38789 -55.74293 1006.67857
2475.0000 -59.38682 -55.37705 4.00977 2.42013 -55.45998 1059.72847
2480.0000 -59.19735 -55.21583 3.98152 2.46359 -55.07858 1107.64035
2485.0000 -58.00433 -53.82680 4.17753 2.52937 -54.50130 1043.28930
2490.0000 -58.09149 -54.13734 3.95415 2.59935 -53.88707 1196.50087
2495.0000 -59.35973 -55.87802 3.48170 2.46443 -55.07121 1094.39925
2500.0000 -59.60590 -56.42151 3.18439 2.38008 -55.81147 980.35620
FREEZING PROCESS: loop number 11 T-loop= 997.00000000000000
main_MD> interactions number 11 at Temperature= 997.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -5.15945 1.43678 1.62330
force_rgl> df(natom) -3.20046 0.58362 -0.38036
2505.0000 -59.54493 -56.05767 3.48726 2.36501 -55.94375 1056.35868
2510.0000 -59.61173 -55.88617 3.72556 2.36404 -55.95229 1010.95033
2515.0000 -58.11545 -55.06521 3.05025 2.43187 -55.35697 1077.83852
2520.0000 -59.59297 -56.83492 2.75804 2.37264 -55.87681 1036.34312
2525.0000 -59.60820 -57.18854 2.41965 2.19657 -57.42203 880.52487
2530.0000 -58.43820 -55.46033 2.97786 2.36398 -55.95277 999.39864
2535.0000 -58.66648 -55.97841 2.68807 2.42565 -55.41156 1070.21397
2540.0000 -58.92116 -55.91803 3.00313 2.36175 -55.97235 1036.80808
2545.0000 -58.59664 -55.24971 3.34692 2.33582 -56.19996 935.44726
2550.0000 -59.23343 -55.81663 3.41681 2.43039 -55.36994 1050.90335
2555.0000 -58.52804 -55.79801 2.73002 2.37026 -55.89765 1010.45086
2560.0000 -59.50453 -55.83173 3.67280 2.41035 -55.54588 1064.58973
2565.0000 -58.14720 -54.64244 3.50476 2.45884 -55.12028 1072.81394
2570.0000 -59.56779 -56.24476 3.32303 2.39272 -55.70055 978.85951
2575.0000 -58.39598 -55.43135 2.96463 2.40618 -55.58244 1045.85654
2580.0000 -58.56655 -55.59293 2.97362 2.37432 -55.86203 949.78557
2585.0000 -59.40710 -55.83528 3.57182 2.42811 -55.39001 1078.97378
2590.0000 -59.88738 -56.42407 3.46330 2.34282 -56.13853 997.12426
2595.0000 -59.86690 -55.91070 3.95620 2.33840 -56.17727 978.33438
2600.0000 -59.51295 -56.14775 3.36520 2.34392 -56.12885 1015.58401
2605.0000 -59.07858 -55.38626 3.69232 2.41044 -55.54508 1008.15696
2610.0000 -58.97014 -54.90029 4.06985 2.42401 -55.42592 1039.78929
2615.0000 -59.71291 -56.79859 2.91433 2.33830 -56.17822 945.19928
2620.0000 -60.24432 -56.65025 3.59407 2.33490 -56.20801 980.35036
2625.0000 -60.87122 -57.63649 3.23473 2.18505 -57.52314 839.67140
2630.0000 -59.51210 -56.78111 2.73099 2.25719 -56.88999 898.17930
2635.0000 -59.69388 -57.04852 2.64536 2.24359 -57.00941 832.78008
2640.0000 -58.50141 -55.00840 3.49301 2.34812 -56.09197 907.01152
2645.0000 -58.42889 -54.56198 3.86691 2.53057 -54.49073 1107.39096
2650.0000 -58.72167 -54.29359 4.42808 2.60566 -53.83171 1171.24343
2655.0000 -57.80435 -54.31176 3.49259 2.56167 -54.21783 1209.65794
2660.0000 -57.59963 -55.11904 2.48060 2.48186 -54.91824 1034.31710
2665.0000 -58.68661 -55.39404 3.29257 2.46413 -55.07384 1048.59383
2670.0000 -58.61663 -55.23589 3.38073 2.40452 -55.59697 1061.06889
2675.0000 -57.89927 -54.52480 3.37448 2.48889 -54.85652 1079.68347
2680.0000 -58.72855 -54.40930 4.31924 2.53037 -54.49255 1144.81275
2685.0000 -59.38522 -54.72463 4.66059 2.54339 -54.37825 1140.85159
2690.0000 -57.47032 -53.24471 4.22561 2.60127 -53.87030 1146.85234
2695.0000 -59.82151 -55.63525 4.18627 2.50828 -54.68638 1091.95169
2700.0000 -59.25102 -55.76241 3.48861 2.38806 -55.74149 991.12533
2705.0000 -58.37046 -54.68650 3.68396 2.40675 -55.57746 1026.05435
2710.0000 -59.02871 -55.77710 3.25161 2.41135 -55.53705 1036.02535
2715.0000 -58.55559 -55.83228 2.72331 2.35518 -56.03006 982.92894
2720.0000 -59.76479 -56.52431 3.24048 2.36667 -55.92923 986.48829
2725.0000 -58.40417 -55.44228 2.96190 2.43217 -55.35433 1034.34381
2730.0000 -58.30569 -54.51955 3.78614 2.50599 -54.70650 1087.77920
2735.0000 -59.18311 -56.45882 2.72428 2.51990 -54.58440 1147.38371
2740.0000 -59.86167 -56.62169 3.23998 2.34386 -56.12942 968.94338
2745.0000 -59.32325 -54.78068 4.54258 2.35650 -56.01850 988.65725
2750.0000 -58.77838 -56.06346 2.71492 2.37129 -55.88869 1022.78410
FREEZING PROCESS: loop number 12 T-loop= 972.00000000000000
main_MD> interactions number 12 at Temperature= 972.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.45912 0.11608 3.43147
force_rgl> df(natom) -3.03776 3.66826 -0.47405
2755.0000 -59.49203 -55.02142 4.47062 2.38913 -55.73210 992.26815
2760.0000 -58.25745 -55.40740 2.85005 2.42574 -55.41082 1070.73086
2765.0000 -59.78313 -56.17590 3.60723 2.39612 -55.67073 1048.21033
2770.0000 -60.80975 -56.77239 4.03735 2.32320 -56.31069 935.32469
2775.0000 -59.56919 -55.86928 3.69992 2.32284 -56.31384 914.74002
2780.0000 -59.95642 -56.12810 3.82832 2.38435 -55.77402 1011.70846
2785.0000 -60.09738 -56.55510 3.54228 2.34705 -56.10142 958.76307
2790.0000 -60.57542 -56.12634 4.44908 2.35720 -56.01234 1024.77062
2795.0000 -58.56981 -54.81677 3.75304 2.40760 -55.56995 1022.58619
2800.0000 -57.93897 -54.59630 3.34266 2.51611 -54.61765 1159.11798
2805.0000 -58.30880 -54.00618 4.30262 2.58383 -54.02333 1165.32122
2810.0000 -58.49157 -54.19544 4.29614 2.61026 -53.79132 1206.97810
2815.0000 -60.02254 -56.51732 3.50521 2.39991 -55.63750 993.10203
2820.0000 -59.87870 -56.40653 3.47217 2.30555 -56.46564 907.47990
2825.0000 -60.17921 -57.70868 2.47053 2.22210 -57.19804 829.43833
2830.0000 -59.54399 -56.70396 2.84003 2.25725 -56.88951 904.73597
2835.0000 -59.99924 -56.20901 3.79022 2.30088 -56.50661 937.45416
2840.0000 -59.41682 -55.55743 3.85939 2.41601 -55.49618 1039.56601
2845.0000 -60.02614 -57.25155 2.77459 2.31771 -56.35890 959.94403
2850.0000 -59.59357 -56.32193 3.27164 2.30758 -56.44778 963.26465
2855.0000 -57.57785 -55.30488 2.27297 2.36346 -55.95733 985.39858
2860.0000 -58.63852 -54.65361 3.98492 2.46087 -55.10247 1043.45169
2865.0000 -58.60805 -55.10088 3.50717 2.55394 -54.28562 1114.94058
2870.0000 -57.22585 -54.11465 3.11120 2.52067 -54.57763 1145.78114
2875.0000 -59.35808 -56.33324 3.02484 2.45427 -55.16042 1047.13068
2880.0000 -59.14378 -55.10588 4.03790 2.39806 -55.65371 1000.07145
2885.0000 -59.64199 -56.46944 3.17255 2.42597 -55.40872 1022.84910
2890.0000 -59.17351 -55.54157 3.63193 2.27966 -56.69283 915.12343
2895.0000 -60.05399 -56.96351 3.09048 2.32966 -56.25404 916.32530
2900.0000 -59.79306 -56.26010 3.53296 2.26814 -56.79397 881.88098
2905.0000 -60.65039 -57.57531 3.07508 2.20617 -57.33777 865.62839
2910.0000 -60.44774 -57.29010 3.15764 2.14969 -57.83347 783.00864
2915.0000 -59.40795 -56.34711 3.06085 2.27486 -56.73499 883.82516
2920.0000 -59.83909 -55.87244 3.96665 2.32168 -56.32401 932.25795
2925.0000 -59.54557 -56.39367 3.15190 2.38174 -55.79697 986.71703
2930.0000 -59.57146 -55.79952 3.77194 2.35103 -56.06643 946.34260
2935.0000 -60.03948 -55.88507 4.15441 2.44570 -55.23556 1100.79934
2940.0000 -59.19523 -56.59847 2.59675 2.34687 -56.10293 950.89051
2945.0000 -58.50484 -55.39196 3.11288 2.38394 -55.77766 1008.60207
2950.0000 -58.94396 -55.74896 3.19500 2.42449 -55.42173 995.51163
2955.0000 -58.45655 -55.44088 3.01568 2.38615 -55.75819 1054.96391
2960.0000 -58.80630 -55.35312 3.45318 2.44846 -55.21140 1052.57493
2965.0000 -59.01873 -55.47912 3.53961 2.42283 -55.43628 1034.82265
2970.0000 -59.47596 -56.20014 3.27581 2.43718 -55.31034 1053.06788
2975.0000 -60.28308 -56.68656 3.59652 2.29241 -56.58092 931.07338
2980.0000 -60.18267 -57.82303 2.35965 2.22846 -57.14217 894.18876
2985.0000 -59.36666 -56.32269 3.04397 2.24552 -56.99242 850.82959
2990.0000 -59.79930 -55.78307 4.01623 2.29614 -56.54822 928.45743
2995.0000 -59.47806 -56.10200 3.37607 2.41013 -55.54777 1066.41294
3000.0000 -58.95942 -55.41387 3.54555 2.39587 -55.67292 1049.31532
FREEZING PROCESS: loop number 13 T-loop= 947.00000000000000
main_MD> interactions number 13 at Temperature= 947.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.36106 -0.37253 -5.07528
force_rgl> df(natom) 5.42159 -6.20439 1.43529
3005.0000 -59.31072 -55.42807 3.88265 2.41336 -55.51945 960.44325
3010.0000 -59.46601 -56.33622 3.12979 2.39905 -55.64499 996.07145
3015.0000 -60.49285 -57.59478 2.89807 2.32857 -56.26356 977.37407
3020.0000 -59.65333 -56.06506 3.58828 2.24072 -57.03462 873.88996
3025.0000 -58.11324 -54.97874 3.13451 2.44252 -55.26350 1061.64792
3030.0000 -58.71949 -55.84924 2.87025 2.39115 -55.71432 965.93868
3035.0000 -60.80277 -57.21209 3.59068 2.22134 -57.20470 843.55629
3040.0000 -59.88152 -56.51033 3.37119 2.26137 -56.85338 897.58637
3045.0000 -59.69156 -57.85814 1.83343 2.25414 -56.91678 883.26870
3050.0000 -59.81770 -56.56597 3.25173 2.25382 -56.91962 884.09464
3055.0000 -60.08645 -56.22044 3.86601 2.31629 -56.37136 949.42952
3060.0000 -58.76959 -55.42427 3.34532 2.42769 -55.39364 1041.25199
3065.0000 -59.38270 -56.65485 2.72785 2.41179 -55.53323 1059.83458
3070.0000 -59.29977 -56.43042 2.86935 2.25679 -56.89354 887.31556
3075.0000 -58.39428 -55.65715 2.73713 2.43450 -55.33393 987.13950
3080.0000 -59.88613 -56.72025 3.16588 2.31950 -56.34314 903.85948
3085.0000 -59.87950 -56.60768 3.27183 2.26859 -56.79000 865.98044
3090.0000 -59.15688 -55.75245 3.40443 2.39917 -55.64396 1026.90447
3095.0000 -59.43920 -56.63090 2.80830 2.38713 -55.74960 1014.19836
3100.0000 -59.50706 -56.83958 2.66748 2.26446 -56.82623 902.11442
3105.0000 -60.46291 -57.40375 3.05916 2.23514 -57.08355 841.25802
3110.0000 -61.10433 -57.74728 3.35706 2.18063 -57.56194 822.62985
3115.0000 -61.78397 -59.02801 2.75596 2.13331 -57.97726 808.25068
3120.0000 -60.59965 -58.42398 2.17567 2.03774 -58.81602 700.47097
3125.0000 -60.63969 -58.01736 2.62233 2.08246 -58.42351 731.14342
3130.0000 -60.99834 -58.09506 2.90328 2.09814 -58.28592 764.65466
3135.0000 -60.31847 -57.61099 2.70749 2.19142 -57.46723 831.72761
3140.0000 -59.55552 -56.30200 3.25352 2.23721 -57.06537 857.99550
3145.0000 -59.02966 -56.69968 2.32998 2.31707 -56.36447 918.99311
3150.0000 -58.73314 -55.07883 3.65431 2.37018 -55.89835 1004.48558
3155.0000 -60.16773 -56.38695 3.78078 2.34092 -56.15521 975.60956
3160.0000 -59.64539 -56.61370 3.03169 2.32082 -56.33161 971.07460
3165.0000 -60.17723 -56.53582 3.64141 2.28527 -56.64358 925.00595
3170.0000 -59.79882 -56.78959 3.00924 2.26779 -56.79704 889.28477
3175.0000 -59.67041 -57.45851 2.21190 2.22051 -57.21193 826.80654
3180.0000 -60.36286 -57.39539 2.96746 2.26666 -56.80690 874.56199
3185.0000 -59.61835 -56.62928 2.98907 2.22518 -57.17096 895.01013
3190.0000 -58.86687 -56.16166 2.70521 2.24789 -56.97165 894.24442
3195.0000 -59.59481 -54.84196 4.75285 2.43179 -55.35766 1056.55637
3200.0000 -59.00252 -54.73756 4.26495 2.50538 -54.71179 1059.67868
3205.0000 -59.94362 -55.42973 4.51389 2.42173 -55.44593 1054.50603
3210.0000 -60.21866 -57.18093 3.03773 2.36898 -55.90889 1015.62943
3215.0000 -59.73335 -57.38431 2.34904 2.25459 -56.91283 892.25997
3220.0000 -59.78417 -57.66555 2.11862 2.17381 -57.62182 820.80053
3225.0000 -60.00248 -57.16125 2.84123 2.18534 -57.52061 841.96977
3230.0000 -60.51191 -57.62344 2.88847 2.19790 -57.41039 879.69468
3235.0000 -59.44810 -56.40950 3.03859 2.22558 -57.16744 900.94520
3240.0000 -59.16680 -56.06277 3.10403 2.30137 -56.50233 919.83697
3245.0000 -59.07490 -55.66748 3.40742 2.36678 -55.92825 984.39312
3250.0000 -60.55139 -56.97135 3.58003 2.29392 -56.56765 918.98480
FREEZING PROCESS: loop number 14 T-loop= 922.00000000000000
main_MD> interactions number 14 at Temperature= 922.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.96861 -1.38280 2.13576
force_rgl> df(natom) -0.65118 2.15983 -0.55546
3255.0000 -59.89565 -56.90540 2.99025 2.20648 -57.33506 841.13734
3260.0000 -61.23846 -58.30884 2.92963 2.18494 -57.52413 800.37844
3265.0000 -60.20659 -57.41116 2.79543 2.13488 -57.96345 771.18684
3270.0000 -59.48354 -56.16235 3.32119 2.21780 -57.23577 854.67784
3275.0000 -58.38380 -55.27870 3.10510 2.37573 -55.84970 1015.73615
3280.0000 -59.26533 -55.83046 3.43487 2.41684 -55.48886 1020.50923
3285.0000 -58.60010 -55.98614 2.61396 2.31233 -56.40611 879.93761
3290.0000 -59.62421 -56.79082 2.83338 2.26879 -56.78819 872.77582
3295.0000 -60.91416 -57.62077 3.29339 2.21863 -57.22843 833.32783
3300.0000 -58.27835 -54.94416 3.33419 2.26897 -56.78665 918.59602
3305.0000 -59.28580 -56.18058 3.10522 2.41945 -55.46600 1027.98151
3310.0000 -59.24234 -55.70511 3.53723 2.36681 -55.92798 1010.42215
3315.0000 -59.65149 -56.82452 2.82698 2.27585 -56.72629 866.20898
3320.0000 -59.22817 -56.78653 2.44164 2.32184 -56.32266 898.96156
3325.0000 -60.36074 -56.80939 3.55135 2.33952 -56.16750 932.85426
3330.0000 -59.68594 -56.20408 3.48187 2.30449 -56.47494 941.47870
3335.0000 -60.64484 -57.71326 2.93158 2.23172 -57.11360 892.73987
3340.0000 -59.12210 -56.05641 3.06569 2.23291 -57.10312 883.28201
3345.0000 -60.64104 -57.27716 3.36388 2.31268 -56.40303 911.65627
3350.0000 -59.38905 -55.67017 3.71888 2.23487 -57.08591 838.57636
3355.0000 -57.85501 -55.43405 2.42096 2.36401 -55.95255 878.06503
3360.0000 -59.18490 -56.21307 2.97184 2.36983 -55.90143 959.70783
3365.0000 -59.89263 -57.03499 2.85764 2.30310 -56.48711 929.66027
3370.0000 -59.40512 -54.97349 4.43163 2.38113 -55.80228 1012.94655
3375.0000 -59.36034 -55.85980 3.50054 2.44193 -55.26872 1108.18641
3380.0000 -59.17650 -56.03295 3.14355 2.30978 -56.42853 937.02748
3385.0000 -57.93301 -55.09662 2.83639 2.31034 -56.42361 928.79721
3390.0000 -59.48247 -56.28448 3.19799 2.40608 -55.58330 1037.19644
3395.0000 -59.49539 -56.67693 2.81846 2.30677 -56.45486 920.20371
3400.0000 -60.15299 -56.46313 3.68986 2.26194 -56.84839 893.86088
3405.0000 -59.69953 -57.81699 1.88254 2.26359 -56.83390 932.52178
3410.0000 -59.97595 -57.38980 2.58615 2.20317 -57.36413 825.06005
3415.0000 -60.12266 -57.17988 2.94277 2.26370 -56.83291 924.60893
3420.0000 -60.29389 -57.63261 2.66128 2.17295 -57.62932 808.70359
3425.0000 -59.31485 -56.25996 3.05489 2.25895 -56.87457 898.42768
3430.0000 -59.57751 -56.72820 2.84931 2.39207 -55.70632 1012.14971
3435.0000 -59.78367 -57.35908 2.42459 2.26174 -56.85014 874.43775
3440.0000 -58.26214 -55.47610 2.78604 2.32510 -56.29407 844.56299
3445.0000 -60.36473 -57.31906 3.04567 2.25372 -56.92045 887.60724
3450.0000 -60.45423 -57.44593 3.00831 2.18558 -57.51853 809.62908
3455.0000 -60.59097 -58.13326 2.45771 2.15352 -57.79991 747.94591
3460.0000 -60.02749 -57.28487 2.74262 2.15688 -57.77040 773.89094
3465.0000 -60.16119 -57.22994 2.93124 2.27967 -56.69277 903.32716
3470.0000 -59.73797 -57.07197 2.66600 2.24100 -57.03212 847.90841
3475.0000 -59.72420 -57.17234 2.55187 2.19894 -57.40122 861.32722
3480.0000 -60.41265 -56.93595 3.47669 2.25551 -56.90480 864.41080
3485.0000 -58.66676 -55.81367 2.85309 2.29111 -56.59237 933.82437
3490.0000 -60.29081 -57.17704 3.11376 2.24922 -56.95998 893.87911
3495.0000 -59.36795 -55.70478 3.66318 2.26099 -56.85669 867.36081
3500.0000 -60.96671 -57.60906 3.35765 2.29773 -56.53426 934.18410
FREEZING PROCESS: loop number 15 T-loop= 897.00000000000000
main_MD> interactions number 15 at Temperature= 897.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.51877 -4.66125 -3.20531
force_rgl> df(natom) -0.83913 0.75126 0.75344
3505.0000 -59.91437 -57.34856 2.56581 2.15061 -57.82542 769.65829
3510.0000 -59.57260 -56.87399 2.69862 2.22310 -57.18918 884.13216
3515.0000 -60.24069 -57.88760 2.35309 2.23490 -57.08570 884.88670
3520.0000 -60.63697 -58.20901 2.42796 2.17840 -57.58150 821.23545
3525.0000 -60.49379 -56.74926 3.74453 2.21386 -57.27034 892.61723
3530.0000 -60.08341 -57.48525 2.59817 2.19527 -57.43344 825.94694
3535.0000 -59.91995 -57.04126 2.87870 2.18775 -57.49943 796.04319
3540.0000 -60.16451 -57.33843 2.82608 2.24784 -56.97206 878.80720
3545.0000 -59.44770 -56.97825 2.46945 2.22805 -57.14575 861.78276
3550.0000 -60.17932 -57.13178 3.04754 2.24031 -57.03820 842.03031
3555.0000 -59.44215 -56.90375 2.53840 2.21447 -57.26495 851.76048
3560.0000 -59.74674 -57.53287 2.21386 2.24113 -57.03100 878.40942
3565.0000 -59.71167 -56.87451 2.83716 2.19340 -57.44990 826.96279
3570.0000 -59.14397 -56.21396 2.93001 2.22400 -57.18131 830.41715
3575.0000 -59.34386 -57.42591 1.91795 2.32547 -56.29076 948.80657
3580.0000 -60.48772 -57.54099 2.94673 2.23921 -57.04781 890.48881
3585.0000 -60.15835 -57.37018 2.78816 2.18437 -57.52916 835.02113
3590.0000 -59.46880 -56.52212 2.94668 2.26147 -56.85251 849.35207
3595.0000 -59.15914 -55.94949 3.20965 2.28451 -56.65025 896.81759
3600.0000 -59.38284 -56.77807 2.60477 2.35064 -56.06986 1039.26188
3605.0000 -59.60492 -56.38733 3.21759 2.25800 -56.88295 881.48606
3610.0000 -60.03984 -57.00438 3.03547 2.26025 -56.86321 858.33477
3615.0000 -59.39347 -56.32658 3.06689 2.25578 -56.90239 893.72722
3620.0000 -60.99674 -57.62839 3.36836 2.23447 -57.08946 861.00885
3625.0000 -60.58722 -57.52317 3.06405 2.23131 -57.11719 829.13757
3630.0000 -59.70688 -56.55629 3.15059 2.20030 -57.38935 837.25832
3635.0000 -59.43976 -55.80701 3.63275 2.28341 -56.65989 931.65218
3640.0000 -59.79852 -56.39060 3.40793 2.35077 -56.06878 996.75843
3645.0000 -60.04277 -57.32791 2.71486 2.27478 -56.73570 946.72850
3650.0000 -59.62188 -57.00017 2.62171 2.17139 -57.64309 828.50867
3655.0000 -59.33961 -57.28481 2.05480 2.25561 -56.90389 885.09502
3660.0000 -60.29047 -57.81648 2.47399 2.20562 -57.34265 837.89649
3665.0000 -59.90510 -56.96608 2.93901 2.14937 -57.83632 810.00616
3670.0000 -60.40088 -57.36740 3.03348 2.23443 -57.08975 854.78375
3675.0000 -59.59415 -56.65784 2.93630 2.26643 -56.80896 903.65706
3680.0000 -59.40496 -55.71032 3.69464 2.36993 -55.90060 964.13607
3685.0000 -59.70880 -56.15323 3.55556 2.40499 -55.59284 1075.03023
3690.0000 -60.29099 -56.87961 3.41138 2.28584 -56.63863 908.48160
3695.0000 -60.20812 -57.47560 2.73253 2.27210 -56.75914 902.66027
3700.0000 -59.60413 -56.89443 2.70970 2.21692 -57.24346 807.85804
3705.0000 -60.28121 -57.75306 2.52815 2.21377 -57.27107 825.43603
3710.0000 -60.91208 -58.18794 2.72414 2.16007 -57.74241 789.00292
3715.0000 -59.49333 -57.29113 2.20220 2.18305 -57.54075 795.67820
3720.0000 -59.20060 -55.63259 3.56801 2.33786 -56.18204 999.39761
3725.0000 -60.08575 -57.07867 3.00708 2.33215 -56.23218 983.00075
3730.0000 -59.22460 -56.82408 2.40053 2.26222 -56.84593 847.47869
3735.0000 -59.58014 -56.80940 2.77074 2.24484 -56.99845 885.59740
3740.0000 -60.43219 -57.95558 2.47661 2.16301 -57.71657 757.14503
3745.0000 -60.33384 -57.12590 3.20794 2.20383 -57.35831 833.37988
3750.0000 -60.70361 -57.82178 2.88182 2.21341 -57.27426 845.94594
FREEZING PROCESS: loop number 16 T-loop= 872.00000000000000
main_MD> interactions number 16 at Temperature= 872.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.00926 3.28582 -1.68417
force_rgl> df(natom) 3.06345 -0.81777 1.08705
3755.0000 -59.36130 -56.91014 2.45116 2.24148 -57.02789 892.83661
3760.0000 -60.42311 -58.42978 1.99333 2.15218 -57.81169 808.16416
3765.0000 -60.03264 -57.44030 2.59234 2.15810 -57.75971 774.87276
3770.0000 -60.82986 -58.06644 2.76342 2.14123 -57.90777 795.84393
3775.0000 -59.46527 -57.07376 2.39151 2.28477 -56.64796 901.68174
3780.0000 -59.70902 -57.09175 2.61727 2.24914 -56.96067 832.06674
3785.0000 -59.35169 -56.86155 2.49014 2.29520 -56.55642 952.27360
3790.0000 -60.01437 -57.30693 2.70745 2.23057 -57.12370 890.78220
3795.0000 -60.73804 -57.74391 2.99413 2.15064 -57.82513 780.43244
3800.0000 -60.53951 -58.14921 2.39030 2.10527 -58.22332 769.47629
3805.0000 -59.45247 -57.15535 2.29712 2.13094 -57.99809 738.04799
3810.0000 -59.36159 -56.74886 2.61273 2.22435 -57.17827 866.37652
3815.0000 -60.10265 -57.61858 2.48407 2.21808 -57.23328 826.97260
3820.0000 -60.37784 -57.33125 3.04659 2.15988 -57.74407 776.56506
3825.0000 -60.95745 -58.74197 2.21548 2.15614 -57.77690 779.58599
3830.0000 -60.23954 -56.73255 3.50699 2.15134 -57.81900 778.67374
3835.0000 -60.92415 -58.85114 2.07300 2.14844 -57.84444 815.92746
3840.0000 -61.00082 -58.42802 2.57280 2.04007 -58.79559 674.63434
3845.0000 -61.04646 -59.00472 2.04174 2.03586 -58.83253 690.43070
3850.0000 -60.76817 -58.30073 2.46744 2.12704 -58.03231 776.24413
3855.0000 -60.28399 -57.75493 2.52906 2.14680 -57.85886 788.71951
3860.0000 -61.03421 -57.63972 3.39449 2.14737 -57.85387 824.28582
3865.0000 -60.90346 -58.00139 2.90207 2.16636 -57.68718 812.74093
3870.0000 -60.11028 -57.33511 2.77518 2.17843 -57.58128 810.64654
3875.0000 -60.57772 -57.44837 3.12935 2.23416 -57.09211 925.01595
3880.0000 -60.30754 -57.57052 2.73702 2.19301 -57.45330 832.70897
3885.0000 -59.79155 -56.19989 3.59166 2.30161 -56.50021 919.67728
3890.0000 -60.17535 -57.68353 2.49181 2.28553 -56.64127 919.04734
3895.0000 -60.25888 -57.55617 2.70271 2.21006 -57.30369 864.35841
3900.0000 -60.69950 -58.35052 2.34898 2.16441 -57.70434 757.14359
3905.0000 -60.36363 -57.32347 3.04016 2.12475 -58.05236 750.85900
3910.0000 -60.42571 -57.27445 3.15126 2.20663 -57.33376 825.21607
3915.0000 -59.66404 -56.90920 2.75484 2.24937 -56.95864 916.39495
3920.0000 -59.61061 -57.18956 2.42105 2.30103 -56.50528 963.05764
3925.0000 -60.16102 -57.07910 3.08192 2.24459 -57.00058 832.53247
3930.0000 -59.58135 -57.13809 2.44326 2.24766 -56.97372 834.21311
3935.0000 -59.61988 -56.47567 3.14421 2.27004 -56.77725 891.02577
3940.0000 -60.47108 -57.11825 3.35283 2.24766 -56.97364 823.59061
3945.0000 -59.71350 -56.87681 2.83668 2.21909 -57.22441 871.34109
3950.0000 -59.75868 -56.45031 3.30837 2.24858 -56.96557 854.84719
3955.0000 -59.16880 -55.86832 3.30048 2.36213 -55.96902 954.74742
3960.0000 -60.21247 -57.05011 3.16237 2.31568 -56.37669 907.40051
3965.0000 -60.05293 -58.06256 1.99037 2.13808 -57.93539 740.01142
3970.0000 -59.45038 -56.56149 2.88888 2.16682 -57.68313 826.94746
3975.0000 -59.87264 -56.48263 3.39002 2.26037 -56.86212 906.82938
3980.0000 -59.47161 -57.01907 2.45255 2.28193 -56.67294 905.54652
3985.0000 -59.35945 -56.74646 2.61299 2.28306 -56.66302 889.96174
3990.0000 -58.83432 -56.33037 2.50396 2.28285 -56.66480 908.22814
3995.0000 -59.73873 -55.72280 4.01593 2.27955 -56.69376 896.99949
4000.0000 -59.40240 -55.40667 3.99573 2.34261 -56.14036 987.09617
FREEZING PROCESS: loop number 17 T-loop= 847.00000000000000
main_MD> interactions number 17 at Temperature= 847.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.71037 0.08526 0.22205
force_rgl> df(natom) 1.79229 0.89471 0.24383
4005.0000 -60.75887 -57.94554 2.81332 2.23213 -57.11000 917.71742
4010.0000 -60.22410 -57.22646 2.99765 2.15607 -57.77747 823.94871
4015.0000 -61.12899 -58.07457 3.05441 2.23996 -57.04123 862.51027
4020.0000 -61.43153 -58.82711 2.60442 2.04620 -58.74179 723.21629
4025.0000 -60.54912 -57.88115 2.66796 2.07455 -58.49295 755.11028
4030.0000 -60.56246 -58.22495 2.33752 2.11936 -58.09971 787.63284
4035.0000 -61.19217 -57.84207 3.35011 2.16461 -57.70259 790.98954
4040.0000 -59.66732 -56.68517 2.98215 2.19973 -57.39431 826.98589
4045.0000 -59.51294 -56.95145 2.56149 2.29355 -56.57096 932.99866
4050.0000 -59.98245 -57.38545 2.59700 2.22664 -57.15817 834.11916
4055.0000 -61.06537 -58.71145 2.35392 2.14360 -57.88693 766.67107
4060.0000 -61.47812 -58.75238 2.72574 2.05317 -58.68061 718.06387
4065.0000 -60.80059 -57.74118 3.05942 2.06594 -58.56848 711.48894
4070.0000 -59.78704 -56.76568 3.02136 2.17638 -57.59925 783.96866
4075.0000 -59.54869 -56.59034 2.95836 2.30140 -56.50207 873.99163
4080.0000 -59.98095 -57.26241 2.71854 2.29101 -56.59319 855.32809
4085.0000 -59.83023 -56.28699 3.54324 2.28838 -56.61633 921.63812
4090.0000 -60.00500 -56.62001 3.38500 2.32998 -56.25121 969.84133
4095.0000 -60.13550 -56.55281 3.58270 2.32711 -56.27640 949.10136
4100.0000 -60.03705 -56.96685 3.07020 2.30200 -56.49678 922.20648
4105.0000 -59.61205 -57.40705 2.20499 2.22075 -57.20987 804.30987
4110.0000 -59.72452 -56.35725 3.36728 2.27539 -56.73034 932.10277
4115.0000 -58.89007 -55.38096 3.50910 2.31533 -56.37976 972.93973
4120.0000 -60.60545 -56.84409 3.76136 2.40482 -55.59440 1006.70701
4125.0000 -60.44395 -57.63886 2.80509 2.25636 -56.89736 857.86156
4130.0000 -59.79827 -57.36053 2.43774 2.17251 -57.63320 808.83609
4135.0000 -60.42556 -57.26974 3.15582 2.18427 -57.53000 835.98108
4140.0000 -60.03108 -56.78362 3.24746 2.24392 -57.00646 892.39300
4145.0000 -60.06415 -56.75642 3.30773 2.29722 -56.53871 921.30395
4150.0000 -59.94481 -56.77611 3.16870 2.33207 -56.23289 951.37295
4155.0000 -59.56683 -56.69864 2.86819 2.25786 -56.88413 863.86864
4160.0000 -60.11581 -57.62687 2.48895 2.28089 -56.68200 892.03635
4165.0000 -60.78357 -58.11296 2.67061 2.10148 -58.25656 740.09543
4170.0000 -59.84475 -57.72098 2.12376 2.14916 -57.83814 812.47593
4175.0000 -59.62623 -56.39694 3.22930 2.24892 -56.96260 884.36847
4180.0000 -59.33978 -56.01590 3.32389 2.34056 -56.15833 951.07663
4185.0000 -59.31759 -56.04268 3.27491 2.40335 -55.60730 963.99903
4190.0000 -59.79264 -55.94639 3.84624 2.37235 -55.87939 1035.35943
4195.0000 -60.54545 -57.87751 2.66795 2.28532 -56.64314 911.15836
4200.0000 -59.92032 -57.09258 2.82774 2.17856 -57.58009 823.52778
4205.0000 -60.26707 -57.98593 2.28114 2.17099 -57.64658 749.14932
4210.0000 -60.33946 -58.45981 1.87966 2.12499 -58.05029 750.89537
4215.0000 -60.99275 -58.99043 2.00231 2.01744 -58.99414 642.57292
4220.0000 -60.19647 -57.39811 2.79836 2.09424 -58.32011 781.38592
4225.0000 -60.48009 -57.31940 3.16069 2.12297 -58.06797 786.47564
4230.0000 -60.15424 -57.43005 2.72419 2.21418 -57.26752 882.47503
4235.0000 -60.12476 -57.65805 2.46671 2.16047 -57.73892 828.60719
4240.0000 -60.46675 -57.81455 2.65220 2.14053 -57.91386 765.13993
4245.0000 -60.57937 -57.92738 2.65198 2.10366 -58.23747 752.22764
4250.0000 -59.73802 -56.22689 3.51113 2.21102 -57.29524 852.85266
FREEZING PROCESS: loop number 18 T-loop= 822.00000000000000
main_MD> interactions number 18 at Temperature= 822.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.00074 5.72581 -3.21229
force_rgl> df(natom) -0.92843 3.44818 0.22671
4255.0000 -60.64227 -58.10966 2.53262 2.21467 -57.26316 919.25212
4260.0000 -60.94115 -57.79992 3.14123 2.16628 -57.68787 879.61129
4265.0000 -60.29709 -57.40406 2.89304 2.17973 -57.56990 835.37167
4270.0000 -60.28401 -56.95257 3.33144 2.20656 -57.33438 858.02630
4275.0000 -60.09292 -57.61047 2.48245 2.15008 -57.83010 808.83134
4280.0000 -59.96193 -57.11899 2.84294 2.18768 -57.50011 823.09313
4285.0000 -60.80221 -57.72838 3.07383 2.20004 -57.39165 795.82352
4290.0000 -60.55234 -57.79677 2.75557 2.09239 -58.33635 708.24786
4295.0000 -61.22026 -59.05122 2.16905 2.09487 -58.31459 748.19895
4300.0000 -60.91477 -58.34170 2.57307 2.10656 -58.21200 751.74442
4305.0000 -60.31826 -57.73210 2.58616 2.10517 -58.22424 828.59884
4310.0000 -58.09939 -54.94977 3.14962 2.27969 -56.69258 881.97979
4315.0000 -60.31644 -56.47591 3.84053 2.43291 -55.34781 1006.64949
4320.0000 -59.92653 -57.19907 2.72746 2.24246 -57.01934 892.01789
4325.0000 -61.02073 -58.66065 2.36008 2.15602 -57.77796 802.80750
4330.0000 -60.63398 -57.56192 3.07207 2.12654 -58.03671 825.26607
4335.0000 -60.66420 -57.79160 2.87260 2.24359 -57.00937 922.24899
4340.0000 -60.18795 -58.01681 2.17113 2.12555 -58.04535 742.38367
4345.0000 -60.84486 -57.73510 3.10977 2.19920 -57.39894 856.56669
4350.0000 -61.09688 -58.42531 2.67157 2.09069 -58.35131 727.28530
4355.0000 -59.82012 -57.11937 2.70075 2.16360 -57.71140 787.73142
4360.0000 -59.54488 -57.17540 2.36947 2.23688 -57.06833 831.65156
4365.0000 -59.96827 -57.46827 2.50000 2.21474 -57.26257 832.86632
4370.0000 -59.58010 -57.04308 2.53702 2.18990 -57.48064 869.74570
4375.0000 -59.42183 -56.71150 2.71033 2.30184 -56.49815 940.51704
4380.0000 -59.39173 -56.62523 2.76650 2.22949 -57.13312 817.80580
4385.0000 -59.27506 -55.67430 3.60076 2.36442 -55.94892 951.69451
4390.0000 -60.31238 -56.81800 3.49438 2.33571 -56.20092 929.72306
4395.0000 -59.19500 -56.12880 3.06621 2.33090 -56.24316 884.80597
4400.0000 -59.85383 -56.53333 3.32051 2.35639 -56.01940 961.08996
4405.0000 -60.21226 -57.90751 2.30476 2.21917 -57.22370 870.47535
4410.0000 -61.43819 -58.06314 3.37505 2.09776 -58.28925 773.69129
4415.0000 -60.80182 -58.24540 2.55642 2.19030 -57.47710 814.90358
4420.0000 -60.91134 -58.16211 2.74923 2.04988 -58.70943 744.37560
4425.0000 -60.87901 -57.79911 3.07990 2.12293 -58.06833 821.64878
4430.0000 -61.15377 -57.73747 3.41630 2.20943 -57.30919 884.36320
4435.0000 -60.55825 -58.34886 2.20938 2.15747 -57.76518 791.11002
4440.0000 -59.42362 -56.75051 2.67311 2.16143 -57.73046 758.47137
4445.0000 -59.06976 -56.32258 2.74718 2.27325 -56.74909 842.37046
4450.0000 -59.11394 -55.56787 3.54607 2.35313 -56.04806 951.12037
4455.0000 -59.48157 -56.02411 3.45746 2.38506 -55.76779 990.61359
4460.0000 -59.04523 -56.26210 2.78313 2.36336 -55.95822 976.94218
4465.0000 -59.23539 -56.35701 2.87839 2.30525 -56.46828 913.83640
4470.0000 -60.06626 -57.35164 2.71461 2.23641 -57.07241 870.96979
4475.0000 -60.62233 -58.35818 2.26415 2.16138 -57.73087 798.19763
4480.0000 -61.43031 -58.35022 3.08009 2.14773 -57.85073 772.07705
4485.0000 -60.18179 -57.79134 2.39044 2.14292 -57.89294 849.45079
4490.0000 -60.27641 -57.11098 3.16543 2.22851 -57.14171 804.77728
4495.0000 -61.11336 -57.91142 3.20194 2.23713 -57.06612 878.33463
4500.0000 -60.99372 -58.38297 2.61075 2.06819 -58.54880 740.39155
FREEZING PROCESS: loop number 19 T-loop= 797.00000000000000
main_MD> interactions number 19 at Temperature= 797.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.42115 2.65266 0.20976
force_rgl> df(natom) 2.37822 -0.05576 0.33046
4505.0000 -61.27002 -59.08094 2.18908 2.02059 -58.96654 653.55696
4510.0000 -61.70819 -58.56017 3.14801 2.00695 -59.08624 683.08542
4515.0000 -60.76938 -58.54391 2.22547 1.99341 -59.20511 665.65712
4520.0000 -61.64727 -59.42336 2.22391 2.01581 -59.00845 678.43215
4525.0000 -60.86961 -58.85725 2.01236 2.00541 -59.09972 668.37328
4530.0000 -60.96476 -58.35813 2.60663 2.04782 -58.72758 669.87464
4535.0000 -60.87396 -58.53026 2.34370 2.07692 -58.47220 715.59147
4540.0000 -60.14649 -58.27973 1.86676 2.07955 -58.44911 740.13054
4545.0000 -60.18622 -57.64972 2.53650 2.14095 -57.91017 757.69262
4550.0000 -61.30108 -57.88785 3.41323 2.13221 -57.98689 741.01111
4555.0000 -60.56638 -57.52629 3.04009 2.19515 -57.43451 800.87826
4560.0000 -61.01928 -58.53863 2.48065 2.14850 -57.84395 752.79603
4565.0000 -60.17687 -57.88131 2.29556 2.12056 -58.08917 753.82601
4570.0000 -61.31032 -58.83712 2.47320 2.07529 -58.48642 692.34463
4575.0000 -60.69240 -58.11146 2.58093 2.11343 -58.15172 768.96176
4580.0000 -59.91366 -57.41911 2.49455 2.16555 -57.69426 775.17886
4585.0000 -60.65102 -58.30584 2.34518 2.13999 -57.91859 805.36259
4590.0000 -60.32670 -58.38031 1.94639 2.08634 -58.38949 708.29378
4595.0000 -60.26920 -57.71501 2.55420 2.10074 -58.26309 742.84311
4600.0000 -60.29702 -56.64674 3.65028 2.20662 -57.33382 807.32919
4605.0000 -60.38662 -57.55035 2.83628 2.24610 -56.98738 876.75380
4610.0000 -60.98073 -58.13765 2.84307 2.13828 -57.93360 807.22326
4615.0000 -60.75934 -57.88367 2.87567 2.15153 -57.81734 789.34336
4620.0000 -60.30492 -57.52827 2.77665 2.16807 -57.67215 824.19940
4625.0000 -61.40040 -59.15106 2.24934 2.10003 -58.26938 744.14947
4630.0000 -58.79602 -56.51078 2.28524 2.18949 -57.48422 846.43194
4635.0000 -59.33853 -56.90052 2.43800 2.25753 -56.88705 824.16031
4640.0000 -59.43594 -56.50646 2.92948 2.25596 -56.90085 853.62258
4645.0000 -60.57913 -57.52775 3.05139 2.22682 -57.15659 844.85055
4650.0000 -60.60241 -57.76802 2.83439 2.17644 -57.59877 808.53591
4655.0000 -60.95373 -58.46587 2.48786 2.12465 -58.05322 762.17345
4660.0000 -60.65492 -58.06199 2.59293 2.12526 -58.04788 808.15463
4665.0000 -61.09434 -58.91670 2.17764 2.07652 -58.47569 750.98220
4670.0000 -60.85094 -57.96839 2.88256 2.11195 -58.16469 790.57320
4675.0000 -60.09679 -57.54470 2.55209 2.16651 -57.68590 796.38834
4680.0000 -59.86636 -57.25261 2.61376 2.18593 -57.51547 840.80758
4685.0000 -61.29485 -57.95398 3.34087 2.21307 -57.27725 866.65870
4690.0000 -60.59051 -57.77614 2.81438 2.15116 -57.82062 826.47353
4695.0000 -60.17879 -57.28342 2.89536 2.17694 -57.59437 793.79499
4700.0000 -60.33839 -57.09720 3.24119 2.21927 -57.22285 802.06278
4705.0000 -60.41735 -57.92200 2.49535 2.15673 -57.77171 787.95306
4710.0000 -60.86173 -58.08127 2.78046 2.11109 -58.17228 759.81684
4715.0000 -61.80711 -58.94557 2.86154 2.10088 -58.26188 734.18591
4720.0000 -60.96555 -58.93479 2.03076 2.02206 -58.95367 656.40810
4725.0000 -60.73544 -57.92663 2.80881 2.04377 -58.76312 732.33515
4730.0000 -60.63884 -58.49453 2.14431 2.05132 -58.69687 733.90407
4735.0000 -61.36890 -58.60890 2.75999 2.08758 -58.37862 768.23497
4740.0000 -61.73111 -58.90111 2.83001 2.01344 -59.02931 705.30463
4745.0000 -61.01719 -58.17303 2.84416 2.03937 -58.80174 712.40697
4750.0000 -60.60488 -58.13916 2.46572 2.17110 -57.64558 805.63628
FREEZING PROCESS: loop number 20 T-loop= 772.00000000000000
main_MD> interactions number 20 at Temperature= 772.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -5.88297 4.54773 -0.45311
force_rgl> df(natom) 1.22892 -3.34504 -1.07240
4755.0000 -62.10468 -59.99657 2.10811 2.04594 -58.74405 715.58524
4760.0000 -60.85505 -59.00776 1.84729 1.99039 -59.23161 654.67847
4765.0000 -61.58457 -58.76853 2.81603 2.00800 -59.07704 685.12640
4770.0000 -60.66291 -58.63736 2.02555 2.01650 -59.00240 662.75773
4775.0000 -60.31826 -58.04191 2.27635 2.14279 -57.89403 778.78851
4780.0000 -60.84690 -57.81700 3.02990 2.13153 -57.99288 798.26728
4785.0000 -60.57379 -58.43973 2.13405 2.05839 -58.63480 708.88053
4790.0000 -60.72868 -57.96975 2.75893 2.08220 -58.42581 712.35713
4795.0000 -60.31618 -57.54370 2.77248 2.16271 -57.71920 787.48247
4800.0000 -60.61093 -57.24633 3.36460 2.17201 -57.63759 824.99816
4805.0000 -60.03584 -57.04535 2.99049 2.22814 -57.14498 890.63822
4810.0000 -60.16465 -57.38604 2.77861 2.20130 -57.38054 837.66260
4815.0000 -60.70505 -58.48628 2.21876 2.14540 -57.87118 770.22514
4820.0000 -60.68602 -57.08262 3.60340 2.15049 -57.82645 795.91526
4825.0000 -59.36904 -56.89123 2.47781 2.26513 -56.82033 860.14680
4830.0000 -60.04073 -57.85955 2.18118 2.20086 -57.38444 721.36544
4835.0000 -60.44328 -57.31503 3.12825 2.17872 -57.57871 824.79650
4840.0000 -59.94793 -57.29042 2.65750 2.15280 -57.80618 758.42855
4845.0000 -59.40796 -56.61996 2.78800 2.22060 -57.21118 821.19554
4850.0000 -59.26136 -56.84570 2.41566 2.21335 -57.27482 798.16142
4855.0000 -60.36001 -57.50189 2.85812 2.22440 -57.17785 839.60159
4860.0000 -61.00854 -58.89095 2.11759 2.11867 -58.10570 765.53772
4865.0000 -60.88481 -58.26190 2.62291 2.05190 -58.69175 683.55616
4870.0000 -60.49671 -58.29621 2.20049 2.03715 -58.82119 712.94790
4875.0000 -60.09664 -57.09331 3.00332 2.20439 -57.35343 825.18037
4880.0000 -60.19471 -57.40820 2.78652 2.21660 -57.24631 794.26392
4885.0000 -60.41649 -56.84270 3.57379 2.20306 -57.36510 836.52213
4890.0000 -59.33282 -56.85192 2.48090 2.31780 -56.35814 917.96018
4895.0000 -60.15945 -57.37989 2.77956 2.21720 -57.24103 829.74590
4900.0000 -59.04095 -56.32016 2.72079 2.25843 -56.87919 848.00466
4905.0000 -59.46910 -56.76844 2.70066 2.27026 -56.77533 905.82117
4910.0000 -60.48584 -57.57659 2.90925 2.19349 -57.44910 834.79642
4915.0000 -60.19131 -57.19836 2.99295 2.27175 -56.76228 921.41148
4920.0000 -61.12174 -58.11655 3.00519 2.17799 -57.58515 839.46167
4925.0000 -60.40083 -57.91424 2.48659 2.08871 -58.36864 722.69921
4930.0000 -59.93290 -57.58088 2.35202 2.17204 -57.63739 841.25927
4935.0000 -60.04787 -57.45173 2.59614 2.21735 -57.23964 831.63049
4940.0000 -60.97329 -57.99012 2.98316 2.09863 -58.28163 720.91942
4945.0000 -60.21452 -57.35269 2.86183 2.18239 -57.54655 827.63877
4950.0000 -60.97662 -57.87667 3.09995 2.11916 -58.10144 753.06184
4955.0000 -60.39032 -57.52287 2.86745 2.12818 -58.02226 781.50394
4960.0000 -61.48908 -58.62018 2.86890 2.12039 -58.09061 786.81338
4965.0000 -61.17468 -58.59472 2.57995 2.07968 -58.44789 736.68061
4970.0000 -60.26054 -57.92816 2.33238 2.12688 -58.03366 772.30670
4975.0000 -61.64205 -59.23474 2.40732 2.06234 -58.60012 706.92389
4980.0000 -60.59610 -57.72239 2.87372 2.06124 -58.60978 709.80037
4985.0000 -59.83562 -57.27974 2.55587 2.23516 -57.08341 874.26201
4990.0000 -61.46973 -58.47333 2.99640 2.16263 -57.71993 769.54613
4995.0000 -61.12450 -58.17887 2.94563 2.10043 -58.26581 705.12834
5000.0000 -60.12548 -57.58751 2.53797 2.10643 -58.21317 734.02433
FREEZING PROCESS: loop number 21 T-loop= 747.00000000000000
main_MD> interactions number 21 at Temperature= 747.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.99540 -0.37219 -0.24473
force_rgl> df(natom) 0.32134 -5.69621 0.44506
5005.0000 -61.38247 -58.43827 2.94420 2.12069 -58.08801 792.23090
5010.0000 -61.21595 -58.76454 2.45141 2.00425 -59.10994 703.15996
5015.0000 -60.55305 -58.36528 2.18777 2.14253 -57.89633 779.60059
5020.0000 -61.16338 -58.75986 2.40352 2.06791 -58.55121 717.25103
5025.0000 -60.78597 -58.16635 2.61962 2.05204 -58.69052 653.47373
5030.0000 -61.68544 -59.00780 2.67764 2.07754 -58.46667 692.44010
5035.0000 -60.98924 -58.77744 2.21180 1.99185 -59.21872 651.74607
5040.0000 -60.98921 -58.64927 2.33994 2.06528 -58.57433 740.41509
5045.0000 -61.14857 -58.41630 2.73227 2.06158 -58.60678 719.48820
5050.0000 -59.74193 -57.51895 2.22298 2.09623 -58.30271 728.09021
5055.0000 -60.61800 -58.58050 2.03751 2.09494 -58.31403 708.00953
5060.0000 -61.06192 -58.47570 2.58622 2.09071 -58.35111 695.25606
5065.0000 -60.69184 -58.44224 2.24960 2.08582 -58.39409 745.18297
5070.0000 -60.97546 -58.51324 2.46222 2.06916 -58.54024 723.92065
5075.0000 -60.63304 -58.20958 2.42346 2.02801 -58.90141 689.42794
5080.0000 -61.15325 -59.15310 2.00016 2.05305 -58.68165 693.96910
5085.0000 -61.17844 -58.52594 2.65250 2.05385 -58.67463 696.24742
5090.0000 -60.58097 -58.28209 2.29888 2.06559 -58.57161 673.58280
5095.0000 -60.97896 -58.40258 2.57639 2.12326 -58.06544 753.56909
5100.0000 -60.53530 -57.99768 2.53762 2.13305 -57.97953 728.04267
5105.0000 -60.10479 -57.93543 2.16936 2.14351 -57.88774 797.20759
5110.0000 -59.11030 -56.69129 2.41901 2.15981 -57.74464 757.65794
5115.0000 -60.66420 -58.16507 2.49913 2.15849 -57.75623 850.68360
5120.0000 -59.81967 -56.87114 2.94853 2.18855 -57.49245 823.47347
5125.0000 -60.33290 -58.23038 2.10252 2.16727 -57.67919 760.03382
5130.0000 -60.14699 -57.69571 2.45128 2.12924 -58.01301 751.02535
5135.0000 -60.65165 -58.06978 2.58187 2.13810 -57.93523 769.58779
5140.0000 -59.52121 -57.79848 1.72273 2.15946 -57.74773 807.56265
5145.0000 -60.06478 -57.01147 3.05331 2.12424 -58.05689 743.37432
5150.0000 -60.97706 -58.72157 2.25550 2.11437 -58.14349 760.11194
5155.0000 -61.11695 -59.26580 1.85115 1.96432 -59.46039 615.07263
5160.0000 -60.46659 -58.39894 2.06765 2.02774 -58.90378 662.85575
5165.0000 -61.04591 -58.88156 2.16436 2.07937 -58.45063 712.64744
5170.0000 -61.02347 -58.62923 2.39424 2.01318 -59.03158 653.80079
5175.0000 -61.30574 -59.21657 2.08917 2.03518 -58.83852 677.21002
5180.0000 -61.12418 -58.27345 2.85073 2.02909 -58.89190 644.01843
5185.0000 -60.38330 -58.46638 1.91691 2.12375 -58.06118 736.22642
5190.0000 -61.46775 -59.13780 2.32994 2.02995 -58.88442 622.97387
5195.0000 -61.09267 -58.84496 2.24772 2.02649 -58.91475 669.54134
5200.0000 -60.81738 -58.05867 2.75871 2.08677 -58.38572 718.99715
5205.0000 -61.53080 -59.59927 1.93153 2.08493 -58.40186 743.52014
5210.0000 -61.61264 -59.40656 2.20608 1.95707 -59.52396 623.53434
5215.0000 -60.99050 -58.95199 2.03850 1.98847 -59.24844 649.07963
5220.0000 -60.38289 -58.03446 2.34843 2.08123 -58.43437 704.13886
5225.0000 -60.90910 -58.36052 2.54858 2.10175 -58.25423 718.80869
5230.0000 -60.68693 -57.59651 3.09042 2.08710 -58.38284 704.41287
5235.0000 -60.69170 -57.38831 3.30339 2.14955 -57.83477 833.71044
5240.0000 -60.75862 -58.04950 2.70912 2.10636 -58.21380 736.78419
5245.0000 -60.50779 -57.62195 2.88584 2.17238 -57.63439 811.78320
5250.0000 -60.91549 -57.78446 3.13103 2.08564 -58.39559 758.33087
FREEZING PROCESS: loop number 22 T-loop= 722.00000000000000
main_MD> interactions number 22 at Temperature= 722.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.65147 1.00583 -0.75967
force_rgl> df(natom) 1.16350 1.23580 -0.91805
5255.0000 -61.72790 -59.21734 2.51056 2.09469 -58.31617 755.99540
5260.0000 -61.08282 -58.86005 2.22277 2.00934 -59.06523 665.88622
5265.0000 -60.97428 -59.21198 1.76230 2.00364 -59.11528 631.85898
5270.0000 -60.98477 -58.78248 2.20229 2.04534 -58.74935 696.91325
5275.0000 -59.91902 -57.86787 2.05116 2.14884 -57.84100 769.08575
5280.0000 -61.40068 -58.42723 2.97345 2.11910 -58.10198 773.04749
5285.0000 -60.88888 -58.36574 2.52314 2.10332 -58.24044 765.46583
5290.0000 -60.52349 -58.59839 1.92511 2.03476 -58.84218 656.39873
5295.0000 -60.73332 -58.38150 2.35181 2.06257 -58.59811 671.81622
5300.0000 -61.00377 -58.74593 2.25784 2.09202 -58.33959 763.93110
5305.0000 -61.13047 -58.53791 2.59256 2.01279 -59.03494 683.96212
5310.0000 -60.26034 -58.60187 1.65848 2.04974 -58.71074 712.61297
5315.0000 -61.11974 -58.93618 2.18356 2.01908 -58.97982 680.31123
5320.0000 -60.80492 -58.59020 2.21471 2.05995 -58.62110 715.92657
5325.0000 -61.05373 -58.66321 2.39052 2.05541 -58.66091 690.34495
5330.0000 -61.18855 -58.42981 2.75873 2.05461 -58.66796 685.83570
5335.0000 -61.01247 -57.38803 3.62444 2.11929 -58.10030 743.45100
5340.0000 -60.16367 -57.33577 2.82790 2.18143 -57.55496 812.97580
5345.0000 -60.95561 -58.85353 2.10208 2.07268 -58.50938 690.96784
5350.0000 -61.35370 -59.27470 2.07900 2.05047 -58.70425 701.38190
5355.0000 -61.74655 -59.82439 1.92216 1.95638 -59.53009 572.55206
5360.0000 -61.17381 -58.93746 2.23634 1.98425 -59.28545 618.14913
5365.0000 -61.10508 -58.51874 2.58634 2.11254 -58.15956 685.41854
5370.0000 -61.33889 -58.72746 2.61142 2.05780 -58.63999 682.72464
5375.0000 -59.92176 -57.69104 2.23073 2.10868 -58.19339 711.36203
5380.0000 -61.15423 -58.37998 2.77425 2.12719 -58.03101 749.66171
5385.0000 -59.93000 -57.59578 2.33422 2.14294 -57.89273 817.67516
5390.0000 -60.79374 -58.64299 2.15074 2.06669 -58.56191 676.87565
5395.0000 -60.89209 -58.54848 2.34361 2.12462 -58.05354 749.17866
5400.0000 -60.15252 -57.89733 2.25519 2.10104 -58.26048 703.16795
5405.0000 -60.98977 -58.64616 2.34361 2.13116 -57.99613 734.83154
5410.0000 -59.86365 -57.34400 2.51965 2.15322 -57.80254 751.43459
5415.0000 -60.65764 -58.36513 2.29250 2.18253 -57.54532 814.68567
5420.0000 -60.21729 -56.83999 3.37731 2.16136 -57.73105 815.28999
5425.0000 -59.39576 -56.64525 2.75052 2.26035 -56.86232 858.35518
5430.0000 -61.11565 -57.62585 3.48980 2.23279 -57.10422 882.94558
5435.0000 -59.53641 -57.02949 2.50692 2.18835 -57.49423 822.57842
5440.0000 -60.40334 -57.11477 3.28856 2.23546 -57.08077 901.07756
5445.0000 -60.28598 -57.86719 2.41879 2.13764 -57.93923 751.69837
5450.0000 -60.19252 -57.60547 2.58705 2.14793 -57.84898 774.13182
5455.0000 -60.45086 -57.17382 3.27704 2.15284 -57.80585 784.70440
5460.0000 -60.44817 -58.44627 2.00190 2.11808 -58.11091 699.51583
5465.0000 -61.10567 -58.26358 2.84209 2.09520 -58.31170 709.49481
5470.0000 -61.23918 -59.19046 2.04872 2.07320 -58.50479 692.52504
5475.0000 -60.96029 -59.17937 1.78091 2.02075 -58.96508 667.69345
5480.0000 -60.73699 -58.79734 1.93966 2.01707 -58.99744 669.03860
5485.0000 -60.93554 -58.51548 2.42006 2.04284 -58.77122 735.75072
5490.0000 -60.97798 -58.80771 2.17027 2.08473 -58.40365 730.48555
5495.0000 -61.34769 -59.57242 1.77527 1.95470 -59.54480 595.72691
5500.0000 -61.53644 -58.67486 2.86158 1.97850 -59.33592 643.09411
FREEZING PROCESS: loop number 23 T-loop= 697.00000000000000
main_MD> interactions number 23 at Temperature= 697.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.02551 1.16455 -0.96574
force_rgl> df(natom) 2.72502 -0.62960 -0.07316
5505.0000 -60.21491 -57.76462 2.45029 2.10696 -58.20849 789.01273
5510.0000 -60.27402 -58.01812 2.25590 2.19183 -57.46367 816.28713
5515.0000 -61.05547 -57.99230 3.06317 2.12337 -58.06451 793.64136
5520.0000 -60.72238 -58.22300 2.49939 2.09583 -58.30616 726.15688
5525.0000 -60.46961 -58.40485 2.06476 2.06359 -58.58914 706.62380
5530.0000 -61.04553 -59.28839 1.75714 2.02897 -58.89298 648.46326
5535.0000 -61.30302 -59.05511 2.24791 2.06080 -58.61366 638.64801
5540.0000 -60.75080 -58.66053 2.09027 2.02922 -58.89076 634.87979
5545.0000 -61.66231 -59.66395 1.99837 1.98557 -59.27385 649.21972
5550.0000 -61.03765 -59.25059 1.78706 1.96042 -59.49459 595.13923
5555.0000 -60.46319 -58.14786 2.31534 2.10901 -58.19051 758.55036
5560.0000 -61.26777 -58.51408 2.75368 2.04297 -58.77012 700.94145
5565.0000 -62.03634 -59.88572 2.15062 1.94763 -59.60683 606.72518
5570.0000 -61.81572 -59.69496 2.12076 1.94607 -59.62055 590.17637
5575.0000 -61.05482 -59.07494 1.97988 2.01533 -59.01270 658.54231
5580.0000 -61.76395 -59.11099 2.65296 2.02375 -58.93875 680.35618
5585.0000 -61.34253 -58.61304 2.72949 2.11227 -58.16188 763.98700
5590.0000 -61.21505 -58.86941 2.34564 2.03681 -58.82421 710.97698
5595.0000 -60.77546 -58.30723 2.46823 1.98612 -59.26907 658.99918
5600.0000 -60.45685 -58.07051 2.38634 2.08842 -58.37126 737.32624
5605.0000 -61.03008 -59.16029 1.86978 2.10586 -58.21820 741.98828
5610.0000 -61.48000 -59.77622 1.70378 1.95512 -59.54113 579.62083
5615.0000 -61.06629 -59.53310 1.53319 2.02610 -58.91819 694.62750
5620.0000 -61.29695 -59.51790 1.77905 1.98851 -59.24809 631.19940
5625.0000 -61.37496 -58.85441 2.52055 1.99876 -59.15812 637.90000
5630.0000 -61.89675 -60.03025 1.86650 2.01396 -59.02470 714.88033
5635.0000 -60.98609 -59.09656 1.88953 1.98792 -59.25323 660.21586
5640.0000 -61.53749 -59.29945 2.23804 2.03701 -58.82241 694.97964
5645.0000 -61.26277 -58.85666 2.40611 1.99109 -59.22540 633.65413
5650.0000 -61.45355 -58.61399 2.83956 2.03436 -58.84572 704.08402
5655.0000 -61.35576 -58.69668 2.65908 2.02503 -58.92757 669.40418
5660.0000 -60.72772 -58.62479 2.10292 2.05580 -58.65754 693.43310
5665.0000 -61.40365 -58.80692 2.59674 2.07810 -58.46182 694.82293
5670.0000 -62.06129 -59.55247 2.50882 2.02278 -58.94732 685.31193
5675.0000 -61.17159 -58.77599 2.39560 1.97681 -59.35076 639.13853
5680.0000 -61.84102 -59.61272 2.22830 1.99677 -59.17558 646.22226
5685.0000 -62.05858 -59.81791 2.24067 1.93951 -59.67816 614.57701
5690.0000 -61.75046 -59.52580 2.22465 1.94768 -59.60640 619.86247
5695.0000 -61.86140 -60.16156 1.69985 1.92109 -59.83976 581.59930
5700.0000 -60.73657 -58.45583 2.28074 1.99037 -59.23179 656.05811
5705.0000 -60.37359 -58.24104 2.13254 2.12516 -58.04878 709.89041
5710.0000 -60.64938 -58.40994 2.23944 2.11360 -58.15025 740.80990
5715.0000 -60.83349 -58.33556 2.49793 2.07634 -58.47729 706.15985
5720.0000 -60.30171 -58.28826 2.01345 2.11860 -58.10639 751.99879
5725.0000 -61.30010 -58.72699 2.57311 2.07751 -58.46700 695.30080
5730.0000 -59.87352 -57.63452 2.23900 2.11096 -58.17345 735.08950
5735.0000 -61.30199 -59.17138 2.13061 2.07635 -58.47719 713.15112
5740.0000 -60.57225 -57.25451 3.31774 2.17489 -57.61237 821.37687
5745.0000 -61.28569 -58.26570 3.02000 2.13150 -57.99316 779.43230
5750.0000 -60.75693 -57.88310 2.87382 2.11880 -58.10460 794.41716
FREEZING PROCESS: loop number 24 T-loop= 672.00000000000000
main_MD> interactions number 24 at Temperature= 672.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.32263 3.26377 5.19811
force_rgl> df(natom) -2.29351 0.56099 3.86395
5755.0000 -61.95703 -59.65903 2.29800 2.07514 -58.48781 759.44931
5760.0000 -61.47708 -59.29312 2.18396 2.01335 -59.03006 669.84426
5765.0000 -61.25813 -59.24948 2.00865 1.99894 -59.15653 654.92404
5770.0000 -61.87689 -59.52770 2.34919 1.95021 -59.58420 600.03364
5775.0000 -60.90527 -58.74444 2.16082 2.00065 -59.14155 650.76508
5780.0000 -60.79626 -57.73331 3.06295 2.14048 -57.91431 781.83202
5785.0000 -60.01111 -56.91778 3.09333 2.26053 -56.86068 911.60354
5790.0000 -61.16595 -58.86042 2.30553 2.13492 -57.96315 807.44780
5795.0000 -61.52992 -59.28772 2.24220 1.98432 -59.28484 654.77066
5800.0000 -62.20285 -59.55340 2.64945 1.98402 -59.28746 652.41651
5805.0000 -61.62265 -59.32029 2.30237 1.95222 -59.56658 624.19452
5810.0000 -61.29669 -59.55321 1.74348 1.96403 -59.46292 582.52191
5815.0000 -61.20657 -58.45289 2.75368 2.00937 -59.06497 625.53889
5820.0000 -61.52976 -59.35984 2.16991 2.02792 -58.90222 680.37050
5825.0000 -61.29002 -59.28637 2.00365 2.02355 -58.94051 688.35439
5830.0000 -61.32881 -59.28383 2.04498 2.00721 -59.08396 663.51874
5835.0000 -61.58700 -59.59481 1.99219 1.95338 -59.55636 571.45969
5840.0000 -62.16972 -59.86015 2.30957 1.93274 -59.73757 558.70853
5845.0000 -61.69845 -59.97185 1.72660 1.91426 -59.89974 581.98570
5850.0000 -60.93478 -59.21810 1.71668 1.91268 -59.91359 578.78383
5855.0000 -61.89719 -60.23464 1.66255 1.94361 -59.64212 619.82491
5860.0000 -61.80557 -59.02541 2.78016 1.90795 -59.95510 614.38310
5865.0000 -60.66278 -58.72622 1.93656 2.03970 -58.79882 719.85765
5870.0000 -61.81503 -59.30645 2.50858 2.03699 -58.82257 711.27121
5875.0000 -61.89010 -59.79753 2.09257 1.97426 -59.37312 642.28598
5880.0000 -62.15547 -59.59463 2.56084 1.92627 -59.79434 598.13168
5885.0000 -61.61535 -59.10371 2.51164 2.03691 -58.82330 721.96858
5890.0000 -62.04576 -59.23426 2.81150 1.97852 -59.33574 597.11120
5895.0000 -60.79585 -58.41413 2.38172 2.01632 -59.00400 676.35585
5900.0000 -60.95851 -59.43052 1.52799 2.05310 -58.68118 680.43496
5905.0000 -61.18600 -59.24511 1.94089 1.99227 -59.21505 637.59438
5910.0000 -61.17270 -58.64918 2.52352 1.99177 -59.21949 625.13549
5915.0000 -60.66371 -58.37956 2.28416 2.08771 -58.37745 719.21019
5920.0000 -61.15366 -59.14575 2.00791 2.04875 -58.71941 653.30694
5925.0000 -60.87322 -58.74890 2.12432 2.04291 -58.77068 646.70900
5930.0000 -61.62286 -59.68846 1.93440 2.00415 -59.11079 629.33078
5935.0000 -61.38588 -59.02730 2.35858 1.97311 -59.38323 600.67868
5940.0000 -61.81761 -58.90194 2.91568 2.01857 -58.98430 694.99505
5945.0000 -61.35383 -58.85500 2.49883 2.07154 -58.51933 716.14096
5950.0000 -61.89123 -59.41484 2.47640 2.03233 -58.86349 698.04569
5955.0000 -60.73075 -58.62631 2.10444 1.97816 -59.33892 630.15191
5960.0000 -61.45093 -59.53479 1.91614 2.04588 -58.74457 650.80492
5965.0000 -61.47908 -59.49081 1.98826 1.92587 -59.79782 565.80456
5970.0000 -61.37182 -59.26167 2.11015 1.97643 -59.35410 643.18908
5975.0000 -62.00348 -60.05169 1.95179 1.92036 -59.84622 566.47544
5980.0000 -61.18071 -59.11732 2.06339 1.98186 -59.30641 610.67044
5985.0000 -61.35364 -59.02353 2.33012 1.99762 -59.16809 608.41306
5990.0000 -61.59664 -59.41764 2.17901 1.94665 -59.61548 592.74086
5995.0000 -60.80742 -58.55002 2.25740 1.99990 -59.14811 649.63678
6000.0000 -60.66580 -58.06991 2.59589 2.07719 -58.46982 770.25061
FREEZING PROCESS: loop number 25 T-loop= 647.00000000000000
main_MD> interactions number 25 at Temperature= 647.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.39059 -1.08646 -5.42143
force_rgl> df(natom) -0.30647 -0.56612 2.84903
6005.0000 -61.58564 -59.86328 1.72236 1.98727 -59.25899 665.82180
6010.0000 -61.53906 -59.55937 1.97969 1.95339 -59.55628 608.56374
6015.0000 -61.29322 -59.25773 2.03549 2.00175 -59.13192 623.29045
6020.0000 -61.68863 -59.13256 2.55608 1.96559 -59.44922 559.90139
6025.0000 -62.08196 -59.94909 2.13287 2.01066 -59.05371 648.99002
6030.0000 -62.02083 -59.51869 2.50215 1.96815 -59.42674 640.13507
6035.0000 -61.18427 -58.39971 2.78456 2.00991 -59.06030 692.04670
6040.0000 -61.15616 -59.40810 1.74807 2.02035 -58.96867 672.59856
6045.0000 -60.52743 -58.73964 1.78780 2.02271 -58.94789 659.05767
6050.0000 -61.40913 -59.32680 2.08232 2.02152 -58.95835 699.14799
6055.0000 -60.99996 -58.59610 2.40386 2.04819 -58.72427 704.63037
6060.0000 -61.40689 -59.70201 1.70487 2.01762 -58.99263 638.10265
6065.0000 -61.45946 -59.04684 2.41262 1.96723 -59.43482 608.14774
6070.0000 -61.00905 -58.71697 2.29207 2.07637 -58.47697 719.18300
6075.0000 -61.73931 -59.13565 2.60366 2.02650 -58.91470 650.00768
6080.0000 -61.00223 -58.17888 2.82335 2.01521 -59.01376 646.44733
6085.0000 -61.43612 -59.13299 2.30313 2.06137 -58.60861 740.41495
6090.0000 -60.49793 -58.99128 1.50665 2.03413 -58.84765 654.45836
6095.0000 -61.57085 -59.25751 2.31334 1.97528 -59.36420 612.87114
6100.0000 -61.03680 -58.96066 2.07614 1.99826 -59.16252 638.43163
6105.0000 -61.86076 -59.75454 2.10622 1.98645 -59.26619 615.04480
6110.0000 -61.81440 -59.60588 2.20852 2.01278 -59.03506 666.85546
6115.0000 -60.68778 -58.66945 2.01832 1.98530 -59.27624 651.71586
6120.0000 -60.86753 -58.38252 2.48501 2.06882 -58.54323 736.69929
6125.0000 -61.23051 -59.23899 1.99152 2.02689 -58.91127 702.71094
6130.0000 -61.66324 -59.81717 1.84607 1.96133 -59.48658 631.94939
6135.0000 -62.21192 -60.61455 1.59737 1.87893 -60.20976 520.27497
6140.0000 -61.56354 -60.04869 1.51484 1.88388 -60.16633 535.73778
6145.0000 -61.17853 -59.10557 2.07296 1.92716 -59.78649 589.03391
6150.0000 -61.13580 -58.80365 2.33215 2.00281 -59.12256 675.06114
6155.0000 -61.50134 -59.81527 1.68607 1.92410 -59.81336 581.74548
6160.0000 -61.52229 -59.73900 1.78329 1.94286 -59.64869 583.63351
6165.0000 -61.10025 -58.89352 2.20673 1.97684 -59.35051 651.86603
6170.0000 -61.92346 -59.47530 2.44816 1.99563 -59.18559 633.17268
6175.0000 -61.49956 -59.46085 2.03871 1.98490 -59.27975 605.08642
6180.0000 -61.78922 -60.14128 1.64794 1.91400 -59.90199 534.77356
6185.0000 -60.99825 -59.03037 1.96788 1.98299 -59.29656 592.31480
6190.0000 -61.05541 -59.12176 1.93365 2.04959 -58.71203 669.11995
6195.0000 -61.64798 -59.61919 2.02879 2.03305 -58.85720 608.81188
6200.0000 -61.88738 -60.06920 1.81818 1.95221 -59.56666 606.67393
6205.0000 -62.23155 -59.99202 2.23953 1.92271 -59.82553 577.21927
6210.0000 -61.98950 -59.53667 2.45283 1.95612 -59.53234 621.99549
6215.0000 -60.92286 -59.39841 1.52445 1.98638 -59.26678 675.46198
6220.0000 -61.60717 -59.88099 1.72617 1.92369 -59.81696 586.65400
6225.0000 -61.71736 -59.15994 2.55742 1.95867 -59.50996 620.16308
6230.0000 -60.98825 -58.63993 2.34832 1.99954 -59.15127 663.80252
6235.0000 -60.99052 -59.13588 1.85465 2.01167 -59.04486 653.81663
6240.0000 -61.31478 -59.01693 2.29786 2.00950 -59.06388 672.88724
6245.0000 -61.59063 -59.54844 2.04219 1.97510 -59.36574 657.19979
6250.0000 -61.43563 -59.31786 2.11777 2.00183 -59.13121 660.71117
FREEZING PROCESS: loop number 26 T-loop= 622.00000000000000
main_MD> interactions number 26 at Temperature= 622.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.32397 0.74192 1.65119
force_rgl> df(natom) -2.67596 2.05072 0.46118
6255.0000 -61.15596 -59.57341 1.58255 1.94666 -59.61533 614.02686
6260.0000 -61.43183 -59.76571 1.66612 1.94744 -59.60852 600.41048
6265.0000 -61.88451 -59.76569 2.11882 1.95386 -59.55215 599.05092
6270.0000 -62.02824 -60.34181 1.68643 1.91858 -59.86178 600.25972
6275.0000 -62.06218 -60.05573 2.00646 1.89144 -60.10003 540.29863
6280.0000 -61.96020 -59.85991 2.10029 1.90268 -60.00139 579.07399
6285.0000 -62.36605 -60.71966 1.64639 1.86477 -60.33407 535.79704
6290.0000 -61.71244 -59.89307 1.81937 1.90898 -59.94603 564.57979
6295.0000 -61.99278 -60.36690 1.62588 1.87816 -60.21654 525.36431
6300.0000 -61.91969 -60.09043 1.82927 1.89220 -60.09329 588.06474
6305.0000 -61.64998 -59.86913 1.78085 1.89798 -60.04264 571.00827
6310.0000 -61.24617 -59.21271 2.03345 1.95479 -59.54398 621.96442
6315.0000 -61.57040 -59.21178 2.35862 2.00097 -59.13868 682.84110
6320.0000 -60.96407 -58.51048 2.45359 2.03892 -58.80569 684.80556
6325.0000 -61.63309 -58.68236 2.95073 2.04455 -58.75623 723.46539
6330.0000 -62.09575 -59.84911 2.24664 1.96818 -59.42646 606.28376
6335.0000 -61.39016 -59.54531 1.84485 1.92569 -59.79942 581.08103
6340.0000 -61.47327 -59.32629 2.14698 1.98475 -59.28104 677.84875
6345.0000 -61.46717 -59.49680 1.97037 1.92822 -59.77718 595.69857
6350.0000 -61.39240 -59.41383 1.97857 1.95656 -59.52850 642.36056
6355.0000 -62.14855 -60.36652 1.78204 1.89574 -60.06225 564.59236
6360.0000 -60.99366 -58.68638 2.30728 1.94233 -59.65333 605.72568
6365.0000 -61.11498 -57.64275 3.47224 2.09764 -58.29033 749.01547
6370.0000 -61.62091 -58.66769 2.95322 2.12889 -58.01602 741.10048
6375.0000 -61.31797 -59.03009 2.28788 2.04279 -58.77167 670.05394
6380.0000 -61.99861 -59.70946 2.28915 1.96077 -59.49150 625.07086
6385.0000 -61.78799 -59.09775 2.69025 2.00804 -59.07664 666.21697
6390.0000 -61.55842 -59.47256 2.08586 1.95883 -59.50856 620.92931
6395.0000 -61.86670 -60.12440 1.74230 1.91569 -59.88721 590.46830
6400.0000 -62.44344 -60.56425 1.87919 1.88404 -60.16494 559.50633
6405.0000 -61.68666 -59.16463 2.52203 1.89483 -60.07026 556.85469
6410.0000 -61.66039 -60.22122 1.43917 1.95210 -59.56765 623.37210
6415.0000 -61.81408 -59.65265 2.16143 1.91408 -59.90129 585.61315
6420.0000 -61.54061 -59.67020 1.87041 1.91407 -59.90143 552.96248
6425.0000 -61.91865 -59.98830 1.93035 1.91791 -59.86773 525.23552
6430.0000 -62.27178 -60.17032 2.10146 1.94725 -59.61015 589.30062
6435.0000 -61.60852 -59.44760 2.16092 1.92378 -59.81620 568.80608
6440.0000 -61.58713 -59.65444 1.93268 1.99673 -59.17593 611.72190
6445.0000 -61.82005 -59.93364 1.88641 1.93360 -59.72994 590.58163
6450.0000 -61.20914 -59.31818 1.89096 1.96467 -59.45730 616.16567
6455.0000 -60.55470 -58.11256 2.44215 2.01533 -59.01268 683.02776
6460.0000 -62.26103 -59.81379 2.44725 2.02691 -58.91109 697.47208
6465.0000 -60.86935 -58.61883 2.25052 1.95859 -59.51069 616.95259
6470.0000 -61.58509 -59.29296 2.29214 2.01074 -59.05299 692.90414
6475.0000 -61.35279 -59.24497 2.10782 2.01262 -59.03651 688.75428
6480.0000 -61.00364 -59.23657 1.76707 1.98043 -59.31897 606.22116
6485.0000 -61.19741 -59.12075 2.07666 1.98564 -59.27330 604.22809
6490.0000 -61.10130 -59.04490 2.05640 2.05322 -58.68018 651.63512
6495.0000 -61.30993 -59.37537 1.93455 1.96866 -59.42226 630.99060
6500.0000 -61.20944 -59.16405 2.04539 2.00614 -59.09336 671.01895
FREEZING PROCESS: loop number 27 T-loop= 597.00000000000000
main_MD> interactions number 27 at Temperature= 597.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.13730 -0.32385 -0.61721
force_rgl> df(natom) -6.42937 -2.38725 1.83088
6505.0000 -61.31778 -59.59856 1.71922 2.00086 -59.13967 699.09512
6510.0000 -61.18528 -59.00827 2.17700 1.94884 -59.59625 620.89062
6515.0000 -61.28428 -58.71164 2.57264 2.02408 -58.93591 671.64454
6520.0000 -61.08663 -59.06551 2.02112 1.98521 -59.27705 666.54677
6525.0000 -61.31013 -59.84698 1.46315 1.94031 -59.67112 584.81518
6530.0000 -61.77238 -59.75819 2.01419 1.93499 -59.71781 529.86085
6535.0000 -61.68237 -59.74002 1.94235 1.92058 -59.84429 550.28836
6540.0000 -61.83568 -59.84346 1.99223 1.95917 -59.50560 627.70070
6545.0000 -61.54583 -59.71902 1.82682 1.94621 -59.61928 629.14223
6550.0000 -61.04842 -59.06746 1.98096 1.97340 -59.38064 635.77102
6555.0000 -61.59743 -59.82074 1.77669 1.97858 -59.33519 554.32299
6560.0000 -61.06299 -59.24971 1.81328 1.95634 -59.53042 572.82826
6565.0000 -61.27108 -59.37586 1.89523 1.98214 -59.30396 595.58228
6570.0000 -61.28259 -58.79145 2.49115 2.02451 -58.93214 626.55368
6575.0000 -60.75438 -58.75158 2.00279 2.05471 -58.66712 726.03388
6580.0000 -60.67458 -58.19477 2.47981 2.12057 -58.08903 783.33014
6585.0000 -60.31251 -58.45599 1.85652 2.06294 -58.59487 696.60713
6590.0000 -61.40839 -59.02451 2.38388 1.99409 -59.19914 601.15071
6595.0000 -61.77833 -59.65229 2.12604 1.98453 -59.28298 645.22670
6600.0000 -62.37070 -60.50459 1.86611 1.90962 -59.94043 581.46133
6605.0000 -61.53107 -59.75239 1.77868 1.86279 -60.35147 529.88656
6610.0000 -62.21570 -59.90100 2.31470 1.91174 -59.92186 590.07020
6615.0000 -61.89192 -59.88300 2.00891 1.90057 -60.01984 535.26083
6620.0000 -61.89468 -60.08452 1.81016 1.89878 -60.03555 544.17800
6625.0000 -62.01071 -60.09142 1.91929 1.87748 -60.22251 525.26647
6630.0000 -61.20877 -59.15303 2.05573 1.96598 -59.44584 640.72317
6635.0000 -61.96357 -60.12181 1.84177 1.94568 -59.62398 570.83946
6640.0000 -61.97648 -60.12615 1.85034 1.88957 -60.11637 537.50700
6645.0000 -61.86402 -59.58592 2.27810 1.93638 -59.70562 600.44846
6650.0000 -61.95520 -59.56652 2.38868 1.97822 -59.33839 631.81475
6655.0000 -61.57457 -60.00786 1.56671 1.96389 -59.46417 626.87270
6660.0000 -61.52074 -59.65839 1.86235 1.92022 -59.84737 546.45319
6665.0000 -61.21853 -59.39015 1.82838 1.94542 -59.62625 559.25620
6670.0000 -62.04299 -60.12072 1.92227 1.91531 -59.89055 523.72287
6675.0000 -61.64471 -60.10022 1.54448 1.93569 -59.71161 562.52706
6680.0000 -62.12853 -59.82030 2.30823 1.96386 -59.46441 613.34860
6685.0000 -61.28159 -59.61165 1.66994 1.98960 -59.23852 606.93476
6690.0000 -60.80183 -59.06868 1.73314 1.94560 -59.62470 533.45656
6695.0000 -61.66354 -59.40384 2.25969 2.03805 -58.81331 647.37504
6700.0000 -61.29936 -59.27576 2.02360 2.01080 -59.05243 642.99321
6705.0000 -61.05220 -58.73630 2.31589 1.98046 -59.31871 600.27063
6710.0000 -61.72256 -59.90467 1.81790 1.98792 -59.25328 635.21519
6715.0000 -61.23532 -59.13908 2.09625 1.98332 -59.29366 627.21402
6720.0000 -60.90919 -58.51678 2.39241 2.01623 -59.00478 641.76093
6725.0000 -62.20895 -59.43262 2.77633 2.02433 -58.93374 640.05608
6730.0000 -61.78683 -60.24491 1.54192 1.91272 -59.91328 580.75003
6735.0000 -61.88954 -59.96757 1.92197 1.88873 -60.12375 528.81049
6740.0000 -61.81198 -59.84882 1.96316 1.93537 -59.71443 611.69299
6745.0000 -61.36932 -59.59244 1.77688 1.95121 -59.57546 615.20061
6750.0000 -62.31545 -60.18767 2.12778 1.93689 -59.70115 597.56514
FREEZING PROCESS: loop number 28 T-loop= 572.00000000000000
main_MD> interactions number 28 at Temperature= 572.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.27348 1.75630 0.16222
force_rgl> df(natom) 1.26010 -2.23434 1.15263
6755.0000 -62.20046 -60.32490 1.87556 1.87296 -60.26217 540.97974
6760.0000 -61.59583 -59.77042 1.82542 1.88235 -60.17979 547.49500
6765.0000 -61.76341 -60.08817 1.67524 1.91018 -59.93555 543.55432
6770.0000 -61.75154 -59.76270 1.98884 1.91613 -59.88329 565.39023
6775.0000 -62.21125 -59.36354 2.84771 1.97862 -59.33489 624.10081
6780.0000 -61.70231 -59.37286 2.32944 1.92592 -59.79738 594.99443
6785.0000 -62.06767 -60.13335 1.93432 1.93033 -59.75872 571.55133
6790.0000 -61.96939 -59.92728 2.04211 1.91317 -59.90925 564.70817
6795.0000 -62.25951 -60.18555 2.07396 1.89626 -60.05773 543.61718
6800.0000 -61.53112 -59.63737 1.89375 1.95030 -59.58342 624.82600
6805.0000 -62.01592 -59.30011 2.71581 1.96596 -59.44597 600.96893
6810.0000 -61.16404 -59.32712 1.83692 1.97786 -59.34151 636.49248
6815.0000 -61.94250 -60.40328 1.53922 1.95327 -59.55734 588.35161
6820.0000 -61.86697 -60.27537 1.59160 1.88053 -60.19578 543.88787
6825.0000 -61.96224 -59.93277 2.02947 1.89091 -60.10467 547.17281
6830.0000 -62.04980 -60.38285 1.66695 1.88586 -60.14894 536.07170
6835.0000 -61.82079 -60.03046 1.79034 1.88182 -60.18443 537.78077
6840.0000 -61.69259 -59.78324 1.90935 1.92613 -59.79552 559.17664
6845.0000 -61.00946 -59.39014 1.61932 1.93300 -59.73527 593.29455
6850.0000 -61.33450 -59.40075 1.93375 1.98729 -59.25877 650.92704
6855.0000 -61.76331 -59.55764 2.20567 1.96618 -59.44408 606.80654
6860.0000 -61.88760 -59.59519 2.29241 1.92490 -59.80638 628.64338
6865.0000 -61.47969 -59.36732 2.11237 1.95912 -59.50600 604.64995
6870.0000 -61.52859 -59.53429 1.99430 1.99464 -59.19425 665.25166
6875.0000 -61.58809 -59.58021 2.00788 1.97042 -59.40684 623.55785
6880.0000 -61.37848 -59.53859 1.83990 1.92909 -59.76954 546.47555
6885.0000 -61.83223 -59.80084 2.03139 1.96966 -59.41355 641.76866
6890.0000 -61.57206 -59.65091 1.92115 1.94793 -59.60426 611.60860
6895.0000 -62.17086 -60.39281 1.77805 1.88478 -60.15843 546.24957
6900.0000 -61.11594 -59.43654 1.67940 1.90021 -60.02306 554.61568
6905.0000 -61.66270 -59.63468 2.02802 1.96179 -59.48257 610.35599
6910.0000 -61.65833 -59.91772 1.74061 1.93161 -59.74744 578.35516
6915.0000 -62.50065 -60.45527 2.04538 1.91915 -59.85679 582.94421
6920.0000 -61.27981 -59.21108 2.06874 1.92442 -59.81057 594.63549
6925.0000 -61.58016 -59.63557 1.94459 1.96251 -59.47628 621.95314
6930.0000 -61.79040 -60.31861 1.47180 1.89006 -60.11209 540.52419
6935.0000 -61.92826 -60.68458 1.24367 1.85061 -60.45832 495.56139
6940.0000 -61.76060 -59.76378 1.99682 1.89495 -60.06919 565.10176
6945.0000 -61.96966 -59.84973 2.11993 1.92026 -59.84709 600.25027
6950.0000 -61.88601 -60.07687 1.80914 1.91618 -59.88291 590.12175
6955.0000 -61.68283 -59.84863 1.83420 1.90825 -59.95246 575.92756
6960.0000 -61.98459 -59.99949 1.98510 1.92250 -59.82742 583.47770
6965.0000 -62.48882 -60.69657 1.79226 1.84973 -60.46602 526.30531
6970.0000 -62.03660 -59.79670 2.23990 1.85198 -60.44629 491.68515
6975.0000 -62.15414 -60.37787 1.77626 1.92595 -59.79711 603.08385
6980.0000 -62.53367 -60.53457 1.99909 1.85873 -60.38705 525.74627
6985.0000 -61.80869 -59.55434 2.25435 1.92634 -59.79367 585.70447
6990.0000 -61.91477 -59.94308 1.97169 1.95415 -59.54960 634.20653
6995.0000 -62.02783 -60.26739 1.76044 1.88039 -60.19700 552.41911
7000.0000 -61.15127 -59.08531 2.06595 1.96428 -59.46070 628.28915
FREEZING PROCESS: loop number 29 T-loop= 547.00000000000000
main_MD> interactions number 29 at Temperature= 547.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.03898 0.85057 0.98783
force_rgl> df(natom) 0.03190 -0.17353 -2.41574
7005.0000 -62.08903 -59.93195 2.15708 1.96347 -59.46784 608.13456
7010.0000 -61.81943 -59.30272 2.51671 1.94066 -59.66800 586.67847
7015.0000 -61.86470 -60.12249 1.74221 1.91633 -59.88157 564.39381
7020.0000 -61.37342 -60.02886 1.34456 1.88179 -60.18469 481.78719
7025.0000 -61.73936 -59.96637 1.77299 1.87394 -60.25357 509.07512
7030.0000 -61.39291 -59.74461 1.64830 1.92984 -59.76297 607.68475
7035.0000 -61.58368 -59.74816 1.83552 1.91425 -59.89977 606.90183
7040.0000 -61.99343 -60.25981 1.73362 1.87661 -60.23014 526.28657
7045.0000 -61.89824 -60.49563 1.40261 1.90794 -59.95523 591.01987
7050.0000 -61.87866 -60.54007 1.33859 1.83148 -60.62623 466.91760
7055.0000 -62.11665 -60.42925 1.68739 1.83797 -60.56923 489.91225
7060.0000 -62.10857 -60.43920 1.66936 1.84895 -60.47289 509.34779
7065.0000 -62.28853 -60.36494 1.92360 1.84357 -60.52012 509.48831
7070.0000 -61.81077 -59.79372 2.01705 1.89026 -60.11035 562.79320
7075.0000 -61.85262 -60.13273 1.71989 1.90690 -59.96431 546.38402
7080.0000 -61.86755 -60.33272 1.53483 1.85985 -60.37722 473.66876
7085.0000 -61.18615 -59.55948 1.62668 1.89288 -60.08735 533.83635
7090.0000 -61.48033 -59.74314 1.73720 1.95269 -59.56244 565.60608
7095.0000 -61.24322 -58.91462 2.32860 1.92342 -59.81935 527.76862
7100.0000 -61.06738 -59.27192 1.79546 1.97382 -59.37701 579.57452
7105.0000 -62.01868 -60.32865 1.69003 1.94264 -59.65066 592.76381
7110.0000 -61.65342 -59.73008 1.92334 1.88183 -60.18432 536.28677
7115.0000 -61.48121 -60.05411 1.42710 1.93589 -59.70990 557.82894
7120.0000 -61.40690 -59.54871 1.85819 1.91842 -59.86319 517.53612
7125.0000 -61.78127 -59.30988 2.47139 1.98974 -59.23732 640.87215
7130.0000 -61.75007 -60.16082 1.58925 1.95272 -59.56214 567.27760
7135.0000 -61.53887 -59.45031 2.08856 1.95885 -59.50834 557.93153
7140.0000 -61.65070 -59.27505 2.37565 1.94384 -59.64010 597.35465
7145.0000 -62.34593 -60.47005 1.87588 1.91013 -59.93596 572.71571
7150.0000 -62.36540 -60.42512 1.94028 1.82985 -60.64051 506.91349
7155.0000 -62.29334 -60.63979 1.65355 1.85268 -60.44014 516.53323
7160.0000 -61.96360 -59.88414 2.07946 1.83941 -60.55666 513.49392
7165.0000 -61.95567 -60.25868 1.69699 1.89024 -60.11053 551.38597
7170.0000 -61.77587 -60.61012 1.16575 1.87109 -60.27857 532.66008
7175.0000 -62.20851 -60.77844 1.43007 1.78540 -61.03063 440.59021
7180.0000 -61.73482 -60.06165 1.67316 1.87556 -60.23934 526.72471
7185.0000 -62.38020 -59.97224 2.40796 1.92068 -59.84341 590.14651
7190.0000 -62.00416 -60.50144 1.50272 1.92965 -59.76467 567.14546
7195.0000 -61.70989 -59.66992 2.03997 1.89087 -60.10503 538.39124
7200.0000 -62.09494 -59.90124 2.19370 1.92826 -59.77687 599.44378
7205.0000 -61.35350 -59.72961 1.62388 1.90927 -59.94349 566.46436
7210.0000 -61.19163 -59.49218 1.69945 1.92987 -59.76276 592.31799
7215.0000 -62.30164 -60.93782 1.36381 1.87360 -60.25661 532.88391
7220.0000 -62.82942 -60.87752 1.95189 1.79899 -60.91136 436.56032
7225.0000 -62.09876 -60.68270 1.41606 1.75878 -61.26429 408.39374
7230.0000 -62.02950 -59.85322 2.17628 1.84727 -60.48768 480.06793
7235.0000 -61.90549 -59.60195 2.30354 1.92176 -59.83386 600.70403
7240.0000 -61.60716 -59.97753 1.62963 1.92530 -59.80284 588.27367
7245.0000 -61.28492 -59.33095 1.95396 1.97958 -59.32649 627.24958
7250.0000 -61.62883 -59.86834 1.76049 1.92166 -59.83475 552.73831
FREEZING PROCESS: loop number 30 T-loop= 522.00000000000000
main_MD> interactions number 30 at Temperature= 522.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.39467 0.64147 -2.17161
force_rgl> df(natom) -0.79119 0.97584 -0.39316
7255.0000 -61.66142 -59.27679 2.38464 1.96616 -59.44424 598.45518
7260.0000 -61.07751 -59.41880 1.65871 1.97035 -59.40749 565.98103
7265.0000 -61.19304 -59.38541 1.80763 1.95728 -59.52214 554.99522
7270.0000 -61.48655 -59.79105 1.69550 1.95518 -59.54059 562.25728
7275.0000 -61.56725 -59.88536 1.68189 1.94318 -59.64594 577.73906
7280.0000 -61.89379 -59.94774 1.94605 1.96125 -59.48735 606.92207
7285.0000 -62.42194 -60.31030 2.11164 1.90049 -60.02054 560.84090
7290.0000 -61.77673 -60.21714 1.55959 1.86263 -60.35288 490.24684
7295.0000 -62.14493 -59.91768 2.22725 1.87546 -60.24021 535.46145
7300.0000 -61.48062 -59.83564 1.64498 1.91681 -59.87738 569.89297
7305.0000 -62.10867 -60.35995 1.74872 1.87732 -60.22390 520.61569
7310.0000 -62.70304 -60.46443 2.23861 1.84376 -60.51849 482.38128
7315.0000 -62.07991 -60.50599 1.57392 1.81276 -60.79053 474.66644
7320.0000 -62.13487 -60.63912 1.49575 1.88206 -60.18228 540.73346
7325.0000 -62.44591 -60.34265 2.10325 1.85293 -60.43800 524.18356
7330.0000 -61.67602 -59.96332 1.71270 1.88118 -60.19006 533.75318
7335.0000 -61.77299 -59.67126 2.10173 1.92951 -59.76590 564.91265
7340.0000 -61.77190 -59.96335 1.80856 1.91980 -59.85108 583.26545
7345.0000 -61.78689 -60.12062 1.66627 1.87411 -60.25209 530.37808
7350.0000 -61.88884 -59.51188 2.37696 1.89912 -60.03258 546.28005
7355.0000 -61.85286 -59.88910 1.96376 1.95628 -59.53095 631.14431
7360.0000 -62.16383 -60.53058 1.63325 1.84486 -60.50876 493.55079
7365.0000 -62.10529 -60.33834 1.76695 1.86323 -60.34756 528.74640
7370.0000 -62.05844 -60.07793 1.98051 1.87925 -60.20697 552.83898
7375.0000 -62.84654 -60.52953 2.31701 1.85675 -60.40443 515.30425
7380.0000 -61.98236 -60.20100 1.78135 1.89528 -60.06629 572.46895
7385.0000 -61.87097 -59.96427 1.90670 1.91697 -59.87591 597.24600
7390.0000 -62.18429 -60.72778 1.45651 1.84612 -60.49770 479.34845
7395.0000 -61.92925 -60.25450 1.67476 1.81624 -60.75997 459.01860
7400.0000 -61.75560 -60.30196 1.45364 1.89131 -60.10113 578.39112
7405.0000 -62.67718 -60.76046 1.91672 1.84170 -60.53657 475.72055
7410.0000 -62.23353 -60.18637 2.04716 1.85392 -60.42925 538.17572
7415.0000 -62.09257 -59.95894 2.13363 1.88716 -60.13754 554.19397
7420.0000 -61.96559 -59.88984 2.07575 1.88888 -60.12245 557.31144
7425.0000 -61.86408 -60.29810 1.56598 1.86561 -60.32671 543.89481
7430.0000 -62.37309 -60.47522 1.89787 1.85686 -60.40345 517.82266
7435.0000 -62.45650 -61.24110 1.21540 1.78527 -61.03182 423.70543
7440.0000 -61.84719 -60.18631 1.66088 1.80241 -60.88136 440.61403
7445.0000 -62.12170 -60.80835 1.31335 1.85054 -60.45895 527.27607
7450.0000 -62.67548 -61.13479 1.54068 1.77418 -61.12915 429.23880
7455.0000 -62.44354 -60.79241 1.65113 1.79045 -60.98630 446.25358
7460.0000 -61.65682 -59.85696 1.79986 1.87190 -60.27150 526.24682
7465.0000 -61.73888 -59.53467 2.20421 1.92017 -59.84785 579.85183
7470.0000 -62.06320 -60.42754 1.63566 1.87457 -60.24807 529.34790
7475.0000 -61.71056 -60.01520 1.69536 1.86566 -60.32628 522.78518
7480.0000 -61.73903 -60.26822 1.47080 1.88390 -60.16620 542.40023
7485.0000 -61.81858 -59.93364 1.88494 1.87424 -60.25099 527.62138
7490.0000 -61.88106 -60.40679 1.47427 1.86878 -60.29885 541.17424
7495.0000 -62.08509 -60.50648 1.57861 1.84890 -60.47337 493.32747
7500.0000 -62.27978 -60.33016 1.94963 1.86067 -60.37005 538.18484
FREEZING PROCESS: loop number 31 T-loop= 497.00000000000000
main_MD> interactions number 31 at Temperature= 497.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.19814 -0.56501 0.71862
force_rgl> df(natom) 3.31944 1.92155 -1.52608
7505.0000 -62.19338 -60.16035 2.03302 1.86825 -60.30355 532.78887
7510.0000 -62.04074 -60.02169 2.01905 1.87856 -60.21300 540.69866
7515.0000 -61.86318 -60.09351 1.76967 1.87322 -60.25987 523.19343
7520.0000 -61.78375 -59.98705 1.79670 1.87938 -60.20588 552.67718
7525.0000 -61.95608 -60.20388 1.75220 1.86177 -60.36042 531.43595
7530.0000 -62.08834 -60.37366 1.71467 1.87034 -60.28520 510.38542
7535.0000 -62.40431 -60.63808 1.76624 1.82765 -60.65985 486.53786
7540.0000 -62.58666 -61.11473 1.47193 1.80331 -60.87342 434.97955
7545.0000 -62.22476 -60.65151 1.57325 1.81523 -60.76888 468.43215
7550.0000 -62.49802 -60.86206 1.63596 1.81852 -60.74001 479.89658
7555.0000 -62.46104 -60.89421 1.56683 1.79650 -60.93326 439.62813
7560.0000 -62.19928 -60.82480 1.37447 1.78804 -61.00748 432.91974
7565.0000 -62.04916 -60.63244 1.41672 1.80671 -60.84360 445.20848
7570.0000 -62.23606 -60.25243 1.98362 1.84598 -60.49900 484.63395
7575.0000 -62.51257 -61.04660 1.46597 1.84896 -60.47279 535.42140
7580.0000 -62.32586 -60.47648 1.84938 1.80924 -60.82145 484.86589
7585.0000 -62.53135 -61.03756 1.49379 1.80556 -60.85369 462.68166
7590.0000 -62.59061 -60.59240 1.99821 1.81526 -60.76858 465.24476
7595.0000 -62.49218 -60.79011 1.70207 1.83492 -60.59607 466.81429
7600.0000 -62.18295 -60.42446 1.75849 1.83004 -60.63890 469.59099
7605.0000 -61.98268 -60.24051 1.74216 1.84014 -60.55024 497.11827
7610.0000 -62.75434 -61.57157 1.18277 1.85041 -60.46012 522.31985
7615.0000 -62.51185 -61.06892 1.44293 1.77361 -61.13412 433.48509
7620.0000 -62.09231 -60.38420 1.70811 1.81521 -60.76904 480.54664
7625.0000 -62.03995 -60.52311 1.51684 1.87244 -60.26677 525.51438
7630.0000 -62.20671 -60.13087 2.07584 1.88654 -60.14299 522.16509
7635.0000 -62.58148 -60.89288 1.68860 1.84637 -60.49557 498.53247
7640.0000 -62.16878 -60.60850 1.56028 1.84913 -60.47133 506.43672
7645.0000 -62.69536 -61.19444 1.50092 1.80499 -60.85876 457.75217
7650.0000 -62.13841 -60.63872 1.49969 1.80297 -60.87647 458.41780
7655.0000 -61.60379 -59.40072 2.20307 1.90089 -60.01707 567.91101
7660.0000 -62.03620 -60.28002 1.75618 1.89416 -60.07616 540.72915
7665.0000 -61.84169 -59.92545 1.91624 1.89600 -60.05996 570.02898
7670.0000 -62.21902 -59.71862 2.50040 1.89369 -60.08023 562.69402
7675.0000 -61.96817 -60.20005 1.76812 1.86803 -60.30547 514.45424
7680.0000 -61.72760 -60.09992 1.62768 1.87053 -60.28348 547.07499
7685.0000 -61.43781 -59.99291 1.44490 1.90471 -59.98357 552.61930
7690.0000 -61.63007 -59.89341 1.73665 1.89515 -60.06742 514.27780
7695.0000 -62.10314 -60.53260 1.57054 1.89087 -60.10504 514.76352
7700.0000 -62.08177 -60.40229 1.67948 1.85298 -60.43750 498.96512
7705.0000 -62.50743 -60.68282 1.82462 1.84596 -60.49918 493.93346
7710.0000 -62.57248 -60.74488 1.82760 1.82047 -60.72283 482.65310
7715.0000 -62.24107 -61.04036 1.20070 1.79786 -60.92130 442.46567
7720.0000 -61.75614 -59.91922 1.83692 1.83114 -60.62924 482.27532
7725.0000 -61.82393 -60.22869 1.59524 1.88809 -60.12936 551.99251
7730.0000 -62.37170 -60.68385 1.68784 1.85500 -60.41983 514.91081
7735.0000 -62.11754 -60.36742 1.75012 1.80758 -60.83599 467.95817
7740.0000 -61.79624 -60.12008 1.67615 1.86471 -60.33456 505.90671
7745.0000 -61.68095 -60.08598 1.59497 1.86691 -60.31528 505.46726
7750.0000 -62.16571 -60.39804 1.76767 1.85576 -60.41315 498.47775
FREEZING PROCESS: loop number 32 T-loop= 472.00000000000000
main_MD> interactions number 32 at Temperature= 472.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.65583 -0.32182 0.67635
force_rgl> df(natom) 1.10011 -0.95274 -1.86999
7755.0000 -62.62495 -61.15018 1.47477 1.81539 -60.76747 465.25108
7760.0000 -62.47795 -61.31507 1.16288 1.76974 -61.16805 410.13056
7765.0000 -62.27919 -60.66900 1.61019 1.79695 -60.92926 427.30585
7770.0000 -61.79596 -59.88513 1.91084 1.83762 -60.57234 487.65407
7775.0000 -61.86194 -60.01094 1.85099 1.90325 -59.99637 553.15033
7780.0000 -61.98506 -59.97247 2.01259 1.90519 -59.97928 534.70905
7785.0000 -62.31703 -60.23088 2.08614 1.90163 -60.01060 537.54843
7790.0000 -62.24077 -61.19894 1.04184 1.84004 -60.55115 501.87738
7795.0000 -62.49464 -60.78552 1.70913 1.76851 -61.17889 414.11942
7800.0000 -62.26284 -60.81600 1.44684 1.83816 -60.56761 496.08222
7805.0000 -62.02813 -60.14245 1.88568 1.83837 -60.56580 482.29357
7810.0000 -61.96110 -59.93438 2.02673 1.89201 -60.09500 555.33519
7815.0000 -62.08037 -60.53457 1.54580 1.91158 -59.92327 578.86250
7820.0000 -62.45337 -61.03778 1.41560 1.82057 -60.72201 453.16042
7825.0000 -61.98164 -60.52576 1.45588 1.84268 -60.52791 510.59767
7830.0000 -62.91518 -61.58154 1.33364 1.80329 -60.87363 457.16903
7835.0000 -63.08864 -61.78360 1.30504 1.74351 -61.39825 372.05109
7840.0000 -62.50420 -61.12831 1.37590 1.74424 -61.39184 382.21886
7845.0000 -62.42141 -61.19980 1.22162 1.76266 -61.23021 412.15290
7850.0000 -62.45690 -61.18147 1.27543 1.78746 -61.01257 425.35400
7855.0000 -62.08165 -60.98057 1.10108 1.79751 -60.92433 431.25675
7860.0000 -62.61715 -60.79433 1.82282 1.77257 -61.14325 417.37921
7865.0000 -61.98474 -60.45006 1.53468 1.79668 -60.93161 445.92273
7870.0000 -62.02126 -60.93525 1.08601 1.82476 -60.68520 478.95123
7875.0000 -61.70803 -59.97731 1.73072 1.84402 -60.51619 513.81460
7880.0000 -62.48235 -60.74786 1.73449 1.79444 -60.95130 446.59835
7885.0000 -62.25576 -60.69460 1.56117 1.83252 -60.61709 483.65874
7890.0000 -61.86591 -60.08326 1.78265 1.87803 -60.21772 524.51571
7895.0000 -61.95998 -60.57665 1.38333 1.86804 -60.30537 499.71296
7900.0000 -62.40901 -61.16808 1.24093 1.83231 -60.61895 471.06231
7905.0000 -62.57410 -61.14941 1.42469 1.76362 -61.22183 408.09453
7910.0000 -62.59760 -61.37936 1.21824 1.79675 -60.93104 451.11646
7915.0000 -62.71128 -60.82178 1.88950 1.76903 -61.17436 405.96501
7920.0000 -62.51899 -61.21985 1.29914 1.77134 -61.15400 424.40190
7925.0000 -62.22873 -60.41309 1.81564 1.78805 -61.00741 440.52305
7930.0000 -61.83246 -60.07292 1.75953 1.88698 -60.13916 514.14765
7935.0000 -61.93800 -60.39209 1.54591 1.86285 -60.35091 515.59252
7940.0000 -62.18432 -61.02325 1.16107 1.82328 -60.69816 486.60277
7945.0000 -62.39736 -60.86268 1.53469 1.78287 -61.05285 413.13280
7950.0000 -62.52762 -61.22548 1.30214 1.80943 -60.81976 460.79368
7955.0000 -62.27228 -60.96326 1.30902 1.82172 -60.71192 492.33383
7960.0000 -62.22241 -60.88897 1.33344 1.79962 -60.90585 441.59070
7965.0000 -62.56188 -60.39209 2.16978 1.81074 -60.80827 475.33662
7970.0000 -62.47524 -61.06331 1.41193 1.81060 -60.80951 465.36966
7975.0000 -62.12065 -60.68996 1.43070 1.80330 -60.87352 458.07872
7980.0000 -62.17181 -60.80595 1.36586 1.83429 -60.60155 491.64057
7985.0000 -62.57262 -61.04708 1.52554 1.80292 -60.87688 447.61284
7990.0000 -62.03569 -60.84126 1.19444 1.76801 -61.18328 391.36613
7995.0000 -62.26472 -60.22315 2.04157 1.86911 -60.29593 535.50031
8000.0000 -61.97535 -60.52356 1.45179 1.87568 -60.23829 533.55196
FREEZING PROCESS: loop number 33 T-loop= 447.00000000000000
main_MD> interactions number 33 at Temperature= 447.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.00478 -0.46250 -1.65792
force_rgl> df(natom) 0.31636 -0.45014 1.09053
8005.0000 -62.38745 -60.54837 1.83908 1.84632 -60.49595 492.37124
8010.0000 -62.60665 -61.01114 1.59552 1.82528 -60.68067 477.42236
8015.0000 -62.10983 -60.72548 1.38435 1.81107 -60.80534 435.43960
8020.0000 -62.46268 -61.32356 1.13912 1.80836 -60.82913 450.04512
8025.0000 -62.32892 -61.00154 1.32738 1.77508 -61.12122 419.22386
8030.0000 -62.03083 -60.58510 1.44574 1.81307 -60.78779 465.28906
8035.0000 -62.67032 -61.05833 1.61199 1.83871 -60.56280 505.45383
8040.0000 -61.90046 -60.47852 1.42193 1.80155 -60.88887 442.41981
8045.0000 -62.53338 -61.04122 1.49216 1.81275 -60.79064 449.96024
8050.0000 -62.68197 -61.42648 1.25549 1.75033 -61.33841 368.43885
8055.0000 -62.58358 -60.99176 1.59181 1.74677 -61.36970 369.58410
8060.0000 -62.11438 -60.96645 1.14793 1.80861 -60.82696 458.14830
8065.0000 -62.51888 -61.48136 1.03752 1.74482 -61.38676 376.40237
8070.0000 -62.64729 -61.14612 1.50118 1.78164 -61.06365 417.24386
8075.0000 -62.26165 -60.86476 1.39689 1.78722 -61.01463 422.00114
8080.0000 -62.36445 -60.62435 1.74009 1.78980 -60.99199 417.42309
8085.0000 -62.64252 -60.95120 1.69133 1.84238 -60.53053 488.29753
8090.0000 -62.05818 -60.59018 1.46800 1.80784 -60.83372 459.28741
8095.0000 -62.86674 -61.51249 1.35426 1.79522 -60.94443 453.01795
8100.0000 -62.51066 -60.97823 1.53244 1.76251 -61.23152 410.47130
8105.0000 -62.09432 -60.55516 1.53916 1.83727 -60.57545 496.28328
8110.0000 -62.67209 -60.68765 1.98444 1.83501 -60.59526 466.64753
8115.0000 -62.27582 -60.28256 1.99326 1.87293 -60.26249 530.03337
8120.0000 -62.22970 -60.57226 1.65744 1.84725 -60.48780 501.85290
8125.0000 -62.58353 -61.08127 1.50227 1.79957 -60.90632 438.28290
8130.0000 -62.60662 -61.09739 1.50923 1.76609 -61.20011 408.64510
8135.0000 -62.15208 -60.71907 1.43302 1.78419 -61.04124 438.46596
8140.0000 -62.02465 -60.70736 1.31729 1.82520 -60.68138 471.29980
8145.0000 -62.06737 -60.44266 1.62470 1.82617 -60.67287 468.90315
8150.0000 -62.12681 -60.39660 1.73022 1.85228 -60.44365 477.00567
8155.0000 -61.95088 -60.42469 1.52619 1.84343 -60.52132 498.63610
8160.0000 -62.56469 -60.88268 1.68201 1.81148 -60.80174 468.33324
8165.0000 -62.15527 -60.32109 1.83417 1.82274 -60.70295 460.87715
8170.0000 -62.27881 -60.68949 1.58932 1.81081 -60.80763 442.96832
8175.0000 -62.55938 -61.20007 1.35932 1.79438 -60.95185 443.92853
8180.0000 -62.59842 -60.90086 1.69756 1.78398 -61.04307 441.05700
8185.0000 -62.66337 -61.29706 1.36631 1.75478 -61.29933 390.16852
8190.0000 -62.04366 -60.31935 1.72431 1.79176 -60.97486 451.00484
8195.0000 -62.04474 -60.36678 1.67796 1.84941 -60.46887 494.80006
8200.0000 -62.09389 -60.69453 1.39936 1.82432 -60.68907 470.29972
8205.0000 -62.25565 -60.66302 1.59263 1.79272 -60.96638 429.14182
8210.0000 -62.14746 -60.66649 1.48097 1.81094 -60.80646 447.22033
8215.0000 -61.86174 -60.20250 1.65924 1.84422 -60.51438 503.54241
8220.0000 -62.03890 -60.55318 1.48573 1.86227 -60.35600 496.48789
8225.0000 -61.64807 -59.57380 2.07427 1.89845 -60.03847 555.16820
8230.0000 -62.27707 -60.87474 1.40233 1.89488 -60.06985 550.29914
8235.0000 -62.54138 -60.95346 1.58791 1.80940 -60.81999 433.14506
8240.0000 -62.91986 -61.54522 1.37464 1.76559 -61.20450 407.95027
8245.0000 -62.86251 -61.76112 1.10139 1.72381 -61.57119 360.09015
8250.0000 -62.48567 -61.06683 1.41884 1.75332 -61.31220 415.11727
FREEZING PROCESS: loop number 34 T-loop= 422.00000000000000
main_MD> interactions number 34 at Temperature= 422.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.41685 -1.10103 -1.02891
force_rgl> df(natom) 0.99018 -1.97451 0.57405
8255.0000 -62.69329 -61.39770 1.29559 1.75694 -61.28039 389.90079
8260.0000 -62.44246 -61.12357 1.31890 1.75035 -61.33830 374.40539
8265.0000 -62.90039 -61.65133 1.24906 1.75487 -61.29855 397.21312
8270.0000 -62.07269 -60.50010 1.57259 1.76551 -61.20524 418.10252
8275.0000 -62.01608 -60.24656 1.76952 1.88159 -60.18642 535.73106
8280.0000 -62.32949 -61.05553 1.27396 1.82821 -60.65492 493.22347
8285.0000 -62.70561 -61.29504 1.41058 1.78975 -60.99245 433.21471
8290.0000 -62.74566 -61.12548 1.62018 1.78429 -61.04043 431.06941
8295.0000 -62.25327 -60.66182 1.59145 1.81951 -60.73129 474.29917
8300.0000 -62.70245 -60.98945 1.71300 1.78835 -61.00473 416.83936
8305.0000 -62.15174 -60.57485 1.57689 1.79130 -60.97888 424.80413
8310.0000 -62.69163 -61.07279 1.61884 1.80226 -60.88267 431.07897
8315.0000 -62.73918 -61.32443 1.41475 1.78206 -61.05992 440.12515
8320.0000 -62.97320 -61.59745 1.37576 1.75512 -61.29635 396.29159
8325.0000 -62.81713 -61.77719 1.03994 1.72038 -61.60125 348.33856
8330.0000 -62.67262 -61.01646 1.65616 1.76232 -61.23318 415.39565
8335.0000 -62.43648 -61.27671 1.15977 1.76575 -61.20308 431.03720
8340.0000 -62.76773 -61.69925 1.06848 1.74256 -61.40663 386.05227
8345.0000 -62.36518 -61.12306 1.24212 1.71188 -61.67586 357.56524
8350.0000 -62.71002 -61.22862 1.48140 1.75731 -61.27718 401.92823
8355.0000 -62.55466 -61.33718 1.21748 1.75658 -61.28360 384.59167
8360.0000 -62.62822 -61.16256 1.46567 1.76651 -61.19644 408.55317
8365.0000 -61.91654 -60.59372 1.32281 1.83229 -60.61911 478.80634
8370.0000 -62.23972 -60.80989 1.42983 1.80698 -60.84126 450.15876
8375.0000 -62.60568 -60.99388 1.61180 1.79854 -60.91535 437.81629
8380.0000 -62.77291 -61.11448 1.65843 1.80225 -60.88274 458.02001
8385.0000 -62.44810 -61.18211 1.26598 1.78182 -61.06206 425.13659
8390.0000 -62.81747 -61.21029 1.60717 1.76403 -61.21821 425.10232
8395.0000 -62.76172 -61.66532 1.09640 1.72893 -61.52626 358.57343
8400.0000 -62.70518 -61.40854 1.29664 1.74509 -61.38443 387.76628
8405.0000 -62.28198 -61.15605 1.12593 1.77241 -61.14462 420.58570
8410.0000 -62.52104 -61.07719 1.44385 1.80922 -60.82162 458.11325
8415.0000 -62.55640 -60.70316 1.85324 1.77671 -61.10695 429.35955
8420.0000 -62.37573 -61.25378 1.12195 1.76707 -61.19155 421.04861
8425.0000 -62.84554 -61.59661 1.24893 1.75844 -61.26726 398.71467
8430.0000 -62.83655 -61.36646 1.47009 1.73218 -61.49771 358.89217
8435.0000 -62.78927 -61.57431 1.21496 1.73251 -61.49482 366.02677
8440.0000 -62.57052 -60.89668 1.67384 1.74180 -61.41334 396.60941
8445.0000 -62.92787 -60.86456 2.06330 1.77096 -61.15734 414.18586
8450.0000 -62.79865 -61.06344 1.73521 1.79586 -60.93887 450.94081
8455.0000 -62.74721 -61.39710 1.35011 1.79039 -60.98688 441.06596
8460.0000 -62.34165 -60.98066 1.36099 1.76472 -61.21214 402.09114
8465.0000 -62.19880 -60.86439 1.33441 1.80732 -60.83828 432.93561
8470.0000 -62.90665 -61.32525 1.58140 1.80038 -60.89917 442.62576
8475.0000 -62.20179 -60.74537 1.45641 1.77275 -61.14163 401.17845
8480.0000 -62.20903 -61.19500 1.01404 1.81152 -60.80139 418.21366
8485.0000 -62.44887 -61.03498 1.41389 1.76667 -61.19501 403.28650
8490.0000 -62.48726 -60.73159 1.75568 1.77168 -61.15104 437.13975
8495.0000 -62.58093 -61.40315 1.17778 1.75696 -61.28021 395.01564
8500.0000 -62.70958 -61.27736 1.43223 1.73189 -61.50029 366.85774
FREEZING PROCESS: loop number 35 T-loop= 397.00000000000000
main_MD> interactions number 35 at Temperature= 397.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.16969 0.61721 2.21135
force_rgl> df(natom) 0.75116 -1.32546 -0.77082
8505.0000 -62.61359 -61.36358 1.25001 1.74397 -61.39429 391.58810
8510.0000 -62.51795 -61.33831 1.17964 1.73895 -61.43829 389.30875
8515.0000 -62.70820 -61.45122 1.25698 1.76566 -61.20385 411.01771
8520.0000 -62.49821 -61.46477 1.03344 1.74455 -61.38920 392.87874
8525.0000 -62.60643 -61.45921 1.14722 1.71019 -61.69074 345.78864
8530.0000 -62.18118 -60.78616 1.39502 1.76309 -61.22648 399.12585
8535.0000 -62.55694 -61.37582 1.18112 1.75478 -61.29942 396.92666
8540.0000 -62.55876 -61.18921 1.36955 1.75649 -61.28433 402.48518
8545.0000 -62.70644 -61.56975 1.13669 1.72494 -61.56131 359.19554
8550.0000 -62.72331 -61.29797 1.42534 1.75320 -61.31323 381.60240
8555.0000 -62.19201 -60.85774 1.33428 1.75490 -61.29837 385.70613
8560.0000 -62.61492 -61.12654 1.48838 1.80320 -60.87441 457.96029
8565.0000 -62.49038 -61.42777 1.06261 1.75500 -61.29749 398.56393
8570.0000 -62.61642 -61.64829 0.96813 1.72516 -61.55936 349.94286
8575.0000 -62.59798 -61.41850 1.17949 1.72420 -61.56772 368.23402
8580.0000 -62.51900 -61.25081 1.26819 1.73844 -61.44275 381.62491
8585.0000 -62.76554 -61.27119 1.49435 1.70991 -61.69317 344.74483
8590.0000 -62.65526 -61.39151 1.26375 1.75110 -61.33167 404.37540
8595.0000 -62.96695 -61.54358 1.42337 1.71566 -61.64273 350.68511
8600.0000 -62.32911 -60.97459 1.35452 1.77446 -61.12669 403.09566
8605.0000 -62.28115 -61.18804 1.09310 1.76827 -61.18095 398.24446
8610.0000 -62.67126 -61.53128 1.13997 1.74491 -61.38599 385.06435
8615.0000 -62.43882 -61.57076 0.86806 1.73818 -61.44503 365.21359
8620.0000 -62.76308 -61.58695 1.17613 1.72960 -61.52041 359.14829
8625.0000 -62.87804 -61.86476 1.01328 1.72499 -61.56083 378.34928
8630.0000 -62.59204 -61.39067 1.20137 1.70144 -61.76752 340.38578
8635.0000 -62.54826 -61.27340 1.27486 1.75613 -61.28755 398.26400
8640.0000 -62.14457 -60.76454 1.38003 1.77745 -61.10038 415.06270
8645.0000 -62.76108 -61.07836 1.68272 1.80744 -60.83719 437.49057
8650.0000 -62.75302 -61.43929 1.31374 1.75502 -61.29727 400.05656
8655.0000 -62.78328 -61.39850 1.38477 1.73399 -61.48183 362.62819
8660.0000 -62.80484 -61.78386 1.02098 1.72334 -61.57534 356.73409
8665.0000 -62.25802 -61.04455 1.21348 1.76031 -61.25081 407.79508
8670.0000 -62.60822 -60.91958 1.68864 1.78654 -61.02065 427.89542
8675.0000 -62.57289 -61.18656 1.38633 1.80731 -60.83833 464.00694
8680.0000 -62.44095 -60.98942 1.45153 1.78695 -61.01704 434.78741
8685.0000 -62.47194 -61.19870 1.27323 1.77186 -61.14949 429.55477
8690.0000 -62.77966 -61.46257 1.31709 1.72485 -61.56205 351.08139
8695.0000 -62.80082 -61.70299 1.09783 1.72945 -61.52166 372.94731
8700.0000 -62.90538 -61.90941 0.99597 1.69391 -61.83359 322.64251
8705.0000 -62.84490 -61.90283 0.94207 1.69416 -61.83138 325.76594
8710.0000 -62.87562 -61.50822 1.36740 1.71159 -61.67844 351.57843
8715.0000 -62.73921 -61.30337 1.43584 1.75750 -61.27552 400.04296
8720.0000 -62.83611 -61.25877 1.57734 1.74824 -61.35673 389.65395
8725.0000 -62.95768 -61.62672 1.33096 1.73660 -61.45895 371.87650
8730.0000 -63.12553 -61.51497 1.61056 1.73130 -61.50546 379.28879
8735.0000 -62.62720 -61.11389 1.51330 1.73262 -61.49389 375.23867
8740.0000 -62.15756 -60.76933 1.38823 1.78666 -61.01959 426.00529
8745.0000 -62.06627 -60.66092 1.40535 1.82150 -60.71378 436.14649
8750.0000 -62.02791 -60.38593 1.64197 1.82337 -60.69740 470.63145
FREEZING PROCESS: loop number 36 T-loop= 372.00000000000000
main_MD> interactions number 36 at Temperature= 372.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.80588 -1.17091 1.50381
force_rgl> df(natom) -1.16331 2.17505 2.62367
8755.0000 -62.21970 -60.77347 1.44623 1.81812 -60.74348 458.45880
8760.0000 -62.73493 -61.40151 1.33342 1.79537 -60.94312 432.66268
8765.0000 -62.14030 -61.01031 1.12999 1.78952 -60.99450 431.29257
8770.0000 -62.48311 -61.06971 1.41340 1.77353 -61.13486 419.58727
8775.0000 -62.82159 -61.53713 1.28446 1.73452 -61.47720 377.83934
8780.0000 -62.68614 -61.43344 1.25270 1.74539 -61.38175 382.25785
8785.0000 -62.89862 -61.57243 1.32618 1.73459 -61.47660 376.60009
8790.0000 -62.90350 -61.62013 1.28337 1.72389 -61.57050 359.71987
8795.0000 -62.95296 -62.05923 0.89373 1.68199 -61.93817 302.14408
8800.0000 -62.84324 -61.94253 0.90071 1.67647 -61.98668 286.74359
8805.0000 -63.01035 -61.72505 1.28530 1.68581 -61.90471 313.20162
8810.0000 -62.59969 -61.42737 1.17232 1.72383 -61.57102 359.28641
8815.0000 -62.86845 -61.37680 1.49165 1.71694 -61.63149 356.84202
8820.0000 -63.02258 -61.77684 1.24575 1.70768 -61.71276 347.41354
8825.0000 -62.72613 -61.70904 1.01709 1.71457 -61.65228 357.35063
8830.0000 -62.87575 -61.92028 0.95548 1.68610 -61.90216 311.39194
8835.0000 -62.36931 -61.38432 0.98499 1.71391 -61.65810 349.53574
8840.0000 -62.40634 -61.30211 1.10423 1.72108 -61.59512 341.46269
8845.0000 -62.31337 -61.08274 1.23062 1.76489 -61.21068 420.83377
8850.0000 -62.65205 -61.23169 1.42036 1.76980 -61.16753 421.67184
8855.0000 -62.86748 -61.63273 1.23475 1.72491 -61.56152 359.64382
8860.0000 -62.66010 -61.52637 1.13372 1.72813 -61.53327 349.48200
8865.0000 -62.38653 -61.33464 1.05190 1.74858 -61.35376 376.50827
8870.0000 -62.61042 -61.21786 1.39256 1.73783 -61.44815 370.66432
8875.0000 -62.49427 -61.31936 1.17491 1.76993 -61.16644 424.65096
8880.0000 -62.86370 -61.85531 1.00838 1.68159 -61.94177 303.02956
8885.0000 -62.70433 -61.17572 1.52860 1.73061 -61.51151 382.75200
8890.0000 -62.77579 -61.54641 1.22938 1.73621 -61.46236 388.83812
8895.0000 -63.03312 -61.85695 1.17618 1.71713 -61.62984 341.87098
8900.0000 -62.65961 -61.50778 1.15183 1.71406 -61.65679 344.63986
8905.0000 -62.72688 -61.50142 1.22546 1.72435 -61.56644 352.69579
8910.0000 -62.82033 -61.79160 1.02873 1.70211 -61.76167 332.56551
8915.0000 -62.29704 -61.02223 1.27481 1.74798 -61.35905 391.08372
8920.0000 -62.63012 -60.90708 1.72303 1.79298 -60.96409 440.82144
8925.0000 -63.00260 -61.41417 1.58843 1.77864 -61.08998 424.35267
8930.0000 -62.67288 -61.28171 1.39117 1.74364 -61.39713 370.88859
8935.0000 -62.60078 -61.55306 1.04772 1.75137 -61.32927 374.75803
8940.0000 -62.79275 -61.61915 1.17360 1.71457 -61.65224 322.43741
8945.0000 -62.73188 -61.28303 1.44885 1.74153 -61.41563 378.41936
8950.0000 -62.73255 -61.46268 1.26987 1.77388 -61.13173 413.53367
8955.0000 -62.73730 -61.77722 0.96008 1.71029 -61.68982 344.62059
8960.0000 -62.82889 -61.76823 1.06066 1.71675 -61.63310 348.16707
8965.0000 -62.48587 -61.23267 1.25320 1.73456 -61.47684 356.16749
8970.0000 -62.33798 -61.47927 0.85871 1.75194 -61.32431 389.12347
8975.0000 -62.28129 -61.38421 0.89708 1.75225 -61.32154 380.12460
8980.0000 -62.63780 -61.26368 1.37412 1.75792 -61.27182 383.52355
8985.0000 -62.47035 -61.25819 1.21216 1.75800 -61.27114 385.34331
8990.0000 -62.57309 -60.98561 1.58748 1.75956 -61.25745 402.07179
8995.0000 -62.65925 -61.23585 1.42339 1.78759 -61.01145 436.40239
9000.0000 -62.81077 -61.09903 1.71173 1.76556 -61.20476 418.92653
FREEZING PROCESS: loop number 37 T-loop= 347.00000000000000
main_MD> interactions number 37 at Temperature= 347.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.39608 0.31705 -1.40103
force_rgl> df(natom) 0.40468 2.52223 -0.01869
9005.0000 -62.75771 -61.44720 1.31051 1.77881 -61.08849 419.42575
9010.0000 -62.66396 -61.40572 1.25824 1.73475 -61.47515 362.19932
9015.0000 -63.12133 -61.74752 1.37381 1.71358 -61.66093 354.35130
9020.0000 -62.89353 -61.89777 0.99576 1.69508 -61.82337 324.86492
9025.0000 -62.96798 -61.98281 0.98518 1.67288 -62.01820 302.14343
9030.0000 -63.01242 -62.31349 0.69893 1.66418 -62.09451 285.15380
9035.0000 -63.06478 -62.30074 0.76404 1.65817 -62.14728 275.93770
9040.0000 -63.23357 -62.14219 1.09138 1.64897 -62.22803 277.70650
9045.0000 -63.06946 -61.97111 1.09834 1.66171 -62.11622 287.66799
9050.0000 -62.86862 -61.75594 1.11267 1.68841 -61.88184 315.76900
9055.0000 -63.15257 -61.68874 1.46383 1.71137 -61.68037 348.20370
9060.0000 -62.67051 -61.51435 1.15616 1.73633 -61.46130 383.52549
9065.0000 -63.00345 -61.83671 1.16674 1.69808 -61.79702 341.18909
9070.0000 -62.89373 -61.87542 1.01830 1.71401 -61.65721 348.33227
9075.0000 -62.99608 -61.78204 1.21404 1.70196 -61.76295 333.92152
9080.0000 -62.76665 -62.03311 0.73354 1.66561 -62.08200 301.56833
9085.0000 -62.71913 -61.49719 1.22194 1.69739 -61.80305 325.74981
9090.0000 -62.58391 -61.55180 1.03210 1.73147 -61.50399 380.95480
9095.0000 -62.71807 -61.57535 1.14273 1.70906 -61.70066 350.11008
9100.0000 -63.01913 -61.99218 1.02695 1.69439 -61.82943 319.54777
9105.0000 -62.94652 -62.13712 0.80940 1.66882 -62.05382 303.55382
9110.0000 -62.92557 -62.10591 0.81967 1.67392 -62.00904 310.15635
9115.0000 -62.90125 -61.84014 1.06111 1.67442 -62.00461 307.98174
9120.0000 -62.93494 -61.64312 1.29182 1.72066 -61.59884 358.09087
9125.0000 -63.01225 -62.05912 0.95313 1.69622 -61.81333 329.36622
9130.0000 -62.63674 -61.49536 1.14137 1.71263 -61.66930 349.88151
9135.0000 -63.16657 -61.56543 1.60113 1.73197 -61.49958 375.26170
9140.0000 -62.59070 -61.50040 1.09030 1.72801 -61.53434 368.82592
9145.0000 -62.58973 -61.44004 1.14969 1.73783 -61.44814 386.70583
9150.0000 -62.36664 -61.37090 0.99574 1.72172 -61.58948 343.68554
9155.0000 -62.72824 -61.41834 1.30990 1.72658 -61.54683 363.57413
9160.0000 -62.78319 -61.45898 1.32420 1.73471 -61.47551 368.39140
9165.0000 -62.99925 -61.89068 1.10856 1.70641 -61.72389 335.05008
9170.0000 -62.71234 -61.68260 1.02974 1.70614 -61.72625 328.93538
9175.0000 -63.01513 -61.90765 1.10748 1.70081 -61.77306 322.53270
9180.0000 -62.94735 -61.91836 1.02899 1.68861 -61.88011 325.21188
9185.0000 -62.83693 -62.03658 0.80035 1.67731 -61.97925 299.87422
9190.0000 -62.80320 -62.01321 0.79000 1.70402 -61.74487 333.42047
9195.0000 -62.63078 -61.67138 0.95939 1.69447 -61.82866 321.74059
9200.0000 -62.90889 -61.59432 1.31458 1.71342 -61.66235 354.10934
9205.0000 -62.23723 -61.00971 1.22752 1.75209 -61.32294 389.66778
9210.0000 -62.51203 -61.31152 1.20051 1.77557 -61.11691 424.21292
9215.0000 -62.84812 -61.41455 1.43358 1.74044 -61.42525 380.61730
9220.0000 -63.14508 -61.99273 1.15235 1.72790 -61.53533 357.09027
9225.0000 -62.99192 -61.70883 1.28309 1.69924 -61.78681 341.71991
9230.0000 -62.57724 -61.44084 1.13639 1.69441 -61.82917 319.54531
9235.0000 -62.72372 -61.68374 1.03999 1.73618 -61.46262 372.42317
9240.0000 -62.99503 -61.86067 1.13437 1.69515 -61.82268 330.64329
9245.0000 -62.78304 -61.46287 1.32018 1.73007 -61.51621 370.62634
9250.0000 -62.75869 -61.67531 1.08338 1.72299 -61.57836 354.65185
FREEZING PROCESS: loop number 38 T-loop= 322.00000000000000
main_MD> interactions number 38 at Temperature= 322.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.32010 -0.62817 -2.33480
force_rgl> df(natom) -0.24005 2.22370 -1.49988
9255.0000 -62.96326 -61.80772 1.15554 1.70109 -61.77055 334.93760
9260.0000 -62.81779 -61.83709 0.98070 1.69507 -61.82340 316.30028
9265.0000 -62.97975 -62.18512 0.79463 1.67937 -61.96120 308.25197
9270.0000 -63.29965 -62.23836 1.06130 1.64728 -62.24283 260.02034
9275.0000 -63.10821 -62.28145 0.82676 1.65664 -62.16066 277.29216
9280.0000 -63.07596 -62.20167 0.87430 1.65242 -62.19773 277.13438
9285.0000 -63.24295 -61.89019 1.35276 1.69189 -61.85132 326.47374
9290.0000 -63.19141 -61.84057 1.35084 1.68902 -61.87650 320.35851
9295.0000 -62.86475 -61.53333 1.33142 1.70337 -61.75055 329.51784
9300.0000 -63.00769 -61.85024 1.15745 1.72437 -61.56625 359.48092
9305.0000 -62.95921 -61.89442 1.06479 1.68196 -61.93851 307.97416
9310.0000 -63.01267 -62.08858 0.92409 1.67328 -62.01469 287.80278
9315.0000 -63.05642 -62.13561 0.92081 1.66040 -62.12769 287.62698
9320.0000 -62.80266 -61.74844 1.05422 1.69443 -61.82907 322.56708
9325.0000 -62.77004 -61.45367 1.31637 1.71617 -61.63824 344.05030
9330.0000 -62.97257 -61.54497 1.42760 1.75046 -61.33727 391.23378
9335.0000 -63.05506 -61.98158 1.07348 1.69977 -61.78219 327.47569
9340.0000 -62.98497 -61.86849 1.11648 1.69074 -61.86144 313.10506
9345.0000 -63.08945 -61.97406 1.11539 1.65570 -62.16893 280.11300
9350.0000 -62.99135 -61.65905 1.33230 1.68731 -61.89148 310.13221
9355.0000 -62.84190 -61.69517 1.14674 1.70985 -61.69366 350.64076
9360.0000 -62.87836 -61.62830 1.25006 1.72701 -61.54308 370.22630
9365.0000 -62.98493 -61.66717 1.31776 1.71703 -61.63066 358.24840
9370.0000 -62.50684 -61.46530 1.04154 1.70881 -61.70286 337.37879
9375.0000 -63.00449 -61.79194 1.21255 1.69038 -61.86460 306.98171
9380.0000 -62.88103 -61.83243 1.04860 1.69854 -61.79298 319.21822
9385.0000 -62.79326 -61.86493 0.92833 1.71062 -61.68697 335.32874
9390.0000 -62.99295 -61.69258 1.30037 1.68522 -61.90983 297.81692
9395.0000 -62.63039 -61.50007 1.13031 1.71876 -61.61548 340.26262
9400.0000 -62.97870 -62.00805 0.97065 1.69262 -61.84491 323.29626
9405.0000 -62.83839 -61.73662 1.10176 1.67405 -62.00785 298.18091
9410.0000 -63.12034 -61.97944 1.14090 1.70466 -61.73924 333.44481
9415.0000 -62.62055 -61.61134 1.00921 1.68613 -61.90187 309.57383
9420.0000 -63.04643 -62.09132 0.95511 1.69435 -61.82969 332.63904
9425.0000 -62.76841 -61.90711 0.86131 1.66946 -62.04816 294.09866
9430.0000 -63.22295 -62.14945 1.07349 1.68105 -61.94650 318.77125
9435.0000 -62.95270 -61.86274 1.08996 1.68225 -61.93592 325.12724
9440.0000 -63.03995 -62.21856 0.82139 1.64658 -62.24900 263.45006
9445.0000 -63.21933 -62.48592 0.73341 1.63736 -62.32992 261.80610
9450.0000 -63.15942 -62.15188 1.00755 1.64844 -62.23264 266.77635
9455.0000 -63.16283 -62.21066 0.95218 1.66360 -62.09957 290.17509
9460.0000 -62.99271 -62.08040 0.91231 1.67054 -62.03872 303.69624
9465.0000 -63.18027 -62.06738 1.11290 1.68134 -61.94395 314.72759
9470.0000 -62.87287 -61.74132 1.13155 1.67900 -61.96446 304.73242
9475.0000 -62.89706 -61.74195 1.15511 1.68930 -61.87408 322.82841
9480.0000 -62.87101 -61.70639 1.16462 1.71208 -61.67412 341.05483
9485.0000 -63.01246 -62.12595 0.88651 1.67890 -61.96532 312.09461
9490.0000 -63.12983 -61.67237 1.45746 1.69851 -61.79326 327.87626
9495.0000 -62.55490 -61.45083 1.10407 1.72798 -61.53461 377.51441
9500.0000 -62.91169 -62.06205 0.84964 1.68540 -61.90831 305.50005
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 4 [min], 48.6079510 [s].
main_MD> Deallocating global variables
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