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nanoparticlesims/growth_Melting_Silver_ICO_2451/meltingSims/run_20/melt.log

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main_MD> Reading input file
read_input> Process type: melting
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 fromtoMelt_20.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 = 20 ntipo2 = 0
read_input> Finish reading input
main_MD> Allocating global variables
main_MD> Number of outputs that will be created: 1800
main_MD> Size of nv and nvoiz: 20 2000
main_MD> Size of nv and nvoiz: 20 2000
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 = 20
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> -1.1089514942169388E-002 -0.13804340827116873 -0.24978848034827336 initial drift of cluster / NP1 for coalescence
init> 0.39885084672960003 0.37947439640333092 0.24671638216840366 scaling for velocity /for coalescence NP1
init.f90 > facguy = 1.8315092136919719E-003
preparo> IN BIGVOI : LIMIT 1.2247448652052084 1.2247448652052084 1.2247448652052084
preparo> END t=0 TIME STEP
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.18799 0.07952 -0.34872
force_rgl> df(natom) -2.09302 -1.60865 -0.63559
preparo> THERMALIZATION PROCESS AT 293.68865133621296
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -47.024241981602415 0.58423148297877314 -47.608473464581188 3.7554728935087150E-004
preparo> END THERMALISATION ON NPAST DEFINE IN PARACLUSTER MODULE
main_MD> Time-loop is starting for melting
main_MD> Now the computation of EXECUTION TIME starts
main_MD> Running from loop 1 to 36
MELTING PROCESS: loop number 1 T-loop= 316.00000000000000
main_MD> interactions number 1 at Temperature= 316.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.50935 1.08396 -1.58432
force_rgl> df(natom) 1.26483 1.82386 1.06660
5.0000 -47.54955 -46.82765 0.72190 1.64666 -46.86729 296.01079
10.0000 -47.60738 -46.90106 0.70632 1.64468 -46.88187 291.79902
15.0000 -47.64253 -46.73701 0.90552 1.63621 -46.94429 287.14078
20.0000 -47.37788 -46.41410 0.96378 1.66210 -46.75354 319.83958
25.0000 -47.67501 -46.98467 0.69034 1.66447 -46.73608 321.26009
30.0000 -47.73031 -46.96778 0.76253 1.62835 -47.00219 272.05675
35.0000 -47.68578 -46.87839 0.80738 1.63387 -46.96153 285.87578
40.0000 -47.67919 -47.11433 0.56486 1.63607 -46.94531 280.77194
45.0000 -47.71228 -47.16477 0.54751 1.61618 -47.09192 256.44986
50.0000 -47.89073 -47.17795 0.71279 1.59923 -47.21676 230.05861
55.0000 -47.77902 -47.03357 0.74545 1.63437 -46.95786 273.47539
60.0000 -47.35122 -46.49078 0.86043 1.66219 -46.75289 312.36635
65.0000 -47.24341 -46.27893 0.96448 1.72289 -46.30562 403.81750
70.0000 -47.45115 -46.40904 1.04211 1.69445 -46.51520 366.63873
75.0000 -47.55866 -46.57890 0.97976 1.68538 -46.58198 348.01899
80.0000 -47.53048 -46.65740 0.87308 1.68851 -46.55897 347.34421
85.0000 -47.60871 -46.60056 1.00816 1.66643 -46.72166 310.81703
90.0000 -47.57091 -46.53504 1.03587 1.67875 -46.63086 343.46508
95.0000 -47.73013 -46.66135 1.06878 1.66573 -46.72679 327.96477
100.0000 -47.68133 -46.82573 0.85560 1.68025 -46.61981 338.17557
105.0000 -47.70965 -47.20476 0.50488 1.61610 -47.09247 248.29740
110.0000 -47.45412 -46.72748 0.72664 1.63093 -46.98323 268.20142
115.0000 -47.51865 -46.85337 0.66529 1.65017 -46.84145 295.45006
120.0000 -47.41422 -46.56899 0.84523 1.66899 -46.70275 321.42656
125.0000 -47.63431 -46.89942 0.73488 1.68074 -46.61623 342.15208
130.0000 -47.62445 -46.80060 0.82384 1.65467 -46.80829 305.13574
135.0000 -47.71896 -46.91818 0.80078 1.62913 -46.99647 265.39379
140.0000 -47.45133 -46.87153 0.57980 1.64567 -46.87458 284.70585
145.0000 -47.48053 -46.49196 0.98857 1.67673 -46.64578 328.82642
150.0000 -47.32876 -46.27439 1.05437 1.72382 -46.29876 407.09564
155.0000 -47.78633 -47.06063 0.72570 1.67044 -46.69210 330.21234
160.0000 -47.41836 -46.78690 0.63146 1.64065 -46.91156 277.45474
165.0000 -47.58040 -46.85566 0.72474 1.65374 -46.81515 302.57547
170.0000 -47.70919 -46.88321 0.82598 1.64188 -46.90254 292.57069
175.0000 -47.52251 -46.91042 0.61208 1.64930 -46.84782 304.94908
180.0000 -47.80922 -46.97053 0.83869 1.63095 -46.98308 268.58448
185.0000 -47.50683 -46.71515 0.79168 1.64525 -46.87772 289.99143
190.0000 -47.55772 -46.92943 0.62829 1.66674 -46.71937 320.62192
195.0000 -47.59124 -46.69176 0.89948 1.64537 -46.87679 297.62993
200.0000 -47.27537 -46.48746 0.78790 1.67403 -46.66562 332.29453
205.0000 -47.60977 -46.73161 0.87816 1.67801 -46.63633 327.51435
210.0000 -47.74379 -47.09847 0.64532 1.64679 -46.86635 289.73176
215.0000 -47.74544 -46.82662 0.91881 1.63252 -46.97152 273.30438
220.0000 -47.38094 -46.39822 0.98272 1.69733 -46.49394 377.86500
225.0000 -47.41781 -46.57104 0.84677 1.68209 -46.60629 358.20737
230.0000 -47.44341 -46.60226 0.84115 1.67173 -46.68260 335.76571
235.0000 -47.83903 -46.83335 1.00568 1.68327 -46.59757 348.34718
240.0000 -47.54234 -46.53922 1.00312 1.67519 -46.65710 335.73737
245.0000 -47.32158 -46.57810 0.74349 1.69868 -46.48401 365.70823
250.0000 -47.49462 -46.54690 0.94771 1.69732 -46.49400 347.52681
MELTING PROCESS: loop number 2 T-loop= 341.00000000000000
main_MD> interactions number 2 at Temperature= 341.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.19548 -0.15447 -1.02111
force_rgl> df(natom) 0.82939 -0.53557 -0.46918
255.0000 -47.37102 -46.70964 0.66139 1.68215 -46.60582 343.76170
260.0000 -47.49521 -46.75479 0.74043 1.66728 -46.71534 337.91954
265.0000 -47.51905 -46.59984 0.91922 1.66941 -46.69969 317.67365
270.0000 -47.71839 -46.95291 0.76548 1.64340 -46.89129 290.76086
275.0000 -47.47594 -46.74017 0.73577 1.65282 -46.82195 294.39439
280.0000 -47.23690 -46.31728 0.91962 1.67897 -46.62922 337.17628
285.0000 -47.30065 -46.34045 0.96020 1.70489 -46.43828 368.04382
290.0000 -47.45871 -46.76203 0.69668 1.67883 -46.63028 342.26458
295.0000 -47.50888 -46.59768 0.91121 1.66526 -46.73026 323.07238
300.0000 -47.29184 -46.43539 0.85645 1.67139 -46.68509 324.64743
305.0000 -47.40682 -46.75062 0.65620 1.67337 -46.67053 322.69439
310.0000 -47.51534 -46.62711 0.88823 1.66208 -46.75368 308.79648
315.0000 -47.38204 -46.43166 0.95038 1.68228 -46.60485 350.95990
320.0000 -47.60077 -46.67174 0.92903 1.68345 -46.59620 347.46154
325.0000 -47.53746 -46.61160 0.92586 1.69468 -46.51347 357.20812
330.0000 -47.15360 -46.43151 0.72209 1.72254 -46.30822 372.73448
335.0000 -47.44553 -46.64601 0.79952 1.69220 -46.53180 355.41449
340.0000 -47.74597 -46.83315 0.91282 1.65385 -46.81430 312.07791
345.0000 -47.57403 -47.02113 0.55290 1.63029 -46.98794 281.93101
350.0000 -47.59934 -47.07386 0.52548 1.62863 -47.00012 271.85776
355.0000 -47.38303 -46.54798 0.83505 1.64188 -46.90253 282.80170
360.0000 -47.35607 -46.59404 0.76203 1.69851 -46.48526 372.34904
365.0000 -47.66324 -46.49063 1.17261 1.68414 -46.59118 338.03338
370.0000 -47.51016 -46.73835 0.77181 1.68160 -46.60984 347.28057
375.0000 -47.40832 -46.83870 0.56962 1.66620 -46.72335 323.66729
380.0000 -47.25842 -46.34151 0.91690 1.70165 -46.46210 370.90449
385.0000 -47.52227 -46.52006 1.00222 1.69358 -46.52161 351.94563
390.0000 -47.59671 -46.76052 0.83619 1.66547 -46.72868 320.99884
395.0000 -47.49147 -46.75185 0.73962 1.67348 -46.66969 318.95584
400.0000 -47.54809 -46.86919 0.67890 1.64188 -46.90254 291.81904
405.0000 -47.63067 -46.84517 0.78549 1.64436 -46.88427 296.61929
410.0000 -47.43261 -46.62547 0.80714 1.65929 -46.77425 314.61641
415.0000 -47.40977 -46.69847 0.71130 1.66700 -46.71742 325.15576
420.0000 -47.72683 -46.81800 0.90883 1.66805 -46.70971 341.32682
425.0000 -47.14268 -46.39594 0.74675 1.65680 -46.79257 307.59073
430.0000 -47.39163 -46.62813 0.76351 1.68390 -46.59291 341.04287
435.0000 -47.60973 -46.88291 0.72682 1.66390 -46.74027 312.79118
440.0000 -47.62584 -46.28455 1.34129 1.69278 -46.52748 361.92209
445.0000 -47.75964 -46.86669 0.89295 1.68312 -46.59869 345.06256
450.0000 -47.81435 -47.06008 0.75427 1.64354 -46.89027 288.54190
455.0000 -47.68519 -46.82394 0.86126 1.62238 -47.04618 266.49817
460.0000 -47.38183 -46.29043 1.09140 1.69256 -46.52909 356.85424
465.0000 -47.61295 -46.65605 0.95690 1.69121 -46.53904 348.74941
470.0000 -47.41100 -46.49002 0.92097 1.67948 -46.62551 333.49680
475.0000 -47.73235 -46.89347 0.83888 1.68067 -46.61674 342.53726
480.0000 -47.30994 -46.52649 0.78345 1.66846 -46.70670 327.68324
485.0000 -47.41132 -46.58860 0.82272 1.69158 -46.53636 360.35763
490.0000 -47.45202 -46.61418 0.83784 1.68210 -46.60617 333.14860
495.0000 -47.71053 -46.73780 0.97273 1.67117 -46.68674 340.38800
500.0000 -47.68512 -46.68461 1.00051 1.66512 -46.73131 330.73925
MELTING PROCESS: loop number 3 T-loop= 366.00000000000000
main_MD> interactions number 3 at Temperature= 366.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 4.92484 1.55356 2.05438
force_rgl> df(natom) 0.02578 -0.03312 1.71974
505.0000 -47.52825 -46.50850 1.01975 1.67901 -46.62894 356.50875
510.0000 -47.49645 -46.19458 1.30187 1.71293 -46.37902 390.51255
515.0000 -47.43395 -46.46157 0.97238 1.68920 -46.55390 354.86882
520.0000 -47.33428 -45.99084 1.34344 1.73705 -46.20131 420.87149
525.0000 -47.15676 -45.83551 1.32125 1.77077 -45.95284 450.51801
530.0000 -47.39183 -46.16062 1.23121 1.78056 -45.88070 490.31732
535.0000 -47.42459 -46.62663 0.79796 1.67813 -46.63543 335.04116
540.0000 -47.48360 -46.60744 0.87615 1.68913 -46.55440 340.18289
545.0000 -47.38535 -46.85869 0.52665 1.67820 -46.63494 339.46382
550.0000 -47.59286 -46.71153 0.88133 1.63957 -46.91957 281.89787
555.0000 -47.42829 -46.53749 0.89080 1.67765 -46.63897 333.47091
560.0000 -47.40221 -46.46622 0.93600 1.68493 -46.58533 343.58089
565.0000 -47.44746 -46.60894 0.83852 1.69821 -46.48749 365.24921
570.0000 -47.25916 -46.47930 0.77985 1.72680 -46.27685 406.91165
575.0000 -46.93566 -46.10285 0.83280 1.73282 -46.23244 405.46657
580.0000 -47.48627 -46.24498 1.24129 1.70799 -46.41545 365.34916
585.0000 -47.57543 -46.79413 0.78130 1.68387 -46.59316 352.53178
590.0000 -47.79014 -46.72969 1.06045 1.65432 -46.81087 312.91932
595.0000 -47.41086 -46.51660 0.89426 1.68898 -46.55551 376.63539
600.0000 -47.45674 -46.51613 0.94060 1.70316 -46.45098 373.28508
605.0000 -47.14123 -46.11855 1.02268 1.73995 -46.17995 412.85302
610.0000 -47.45504 -46.37412 1.08092 1.73712 -46.20076 433.48078
615.0000 -47.48087 -46.44890 1.03196 1.71747 -46.34557 400.69544
620.0000 -47.22974 -45.95648 1.27326 1.73461 -46.21930 424.13983
625.0000 -47.38941 -46.57069 0.81872 1.74111 -46.17137 406.07191
630.0000 -47.28549 -46.10134 1.18414 1.73517 -46.21512 401.36032
635.0000 -47.53916 -46.75069 0.78847 1.69637 -46.50105 347.60973
640.0000 -47.38313 -46.59886 0.78426 1.68119 -46.61288 343.28049
645.0000 -47.90072 -46.73880 1.16191 1.68243 -46.60374 355.84059
650.0000 -47.39292 -46.62059 0.77232 1.66750 -46.71377 314.01704
655.0000 -47.25500 -46.35129 0.90371 1.69752 -46.49257 356.41360
660.0000 -47.45830 -46.68127 0.77704 1.68514 -46.58379 340.34258
665.0000 -47.51909 -46.55230 0.96679 1.69178 -46.53484 371.65373
670.0000 -47.98178 -46.94696 1.03482 1.66466 -46.73466 320.60791
675.0000 -47.28496 -46.33952 0.94544 1.67202 -46.68043 327.28059
680.0000 -47.50813 -46.45695 1.05118 1.69913 -46.48073 356.79885
685.0000 -47.74009 -47.07350 0.66658 1.67800 -46.63637 352.08722
690.0000 -47.65131 -46.87200 0.77931 1.63380 -46.96208 281.62512
695.0000 -47.23004 -46.54794 0.68210 1.68912 -46.55444 351.10993
700.0000 -47.20227 -46.39148 0.81080 1.68634 -46.57494 350.10074
705.0000 -47.54827 -46.12924 1.41903 1.71287 -46.37946 383.36640
710.0000 -47.29970 -46.18371 1.11599 1.76675 -45.98245 463.61912
715.0000 -47.44087 -46.28764 1.15323 1.71448 -46.36759 378.64918
720.0000 -47.13404 -46.08931 1.04474 1.75487 -46.07000 436.34578
725.0000 -47.26153 -46.24319 1.01834 1.74199 -46.16490 427.98903
730.0000 -47.42353 -46.49516 0.92837 1.70548 -46.43389 359.33940
735.0000 -47.39392 -46.65633 0.73759 1.68285 -46.60065 344.13091
740.0000 -47.34854 -46.41869 0.92985 1.70640 -46.42717 376.33622
745.0000 -47.65457 -47.00446 0.65011 1.66220 -46.75284 321.58289
750.0000 -47.39000 -46.40442 0.98558 1.67301 -46.67315 343.78158
MELTING PROCESS: loop number 4 T-loop= 391.00000000000000
main_MD> interactions number 4 at Temperature= 391.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.00294 -3.00727 -3.45281
force_rgl> df(natom) 1.81230 -1.60639 -1.65231
755.0000 -47.39161 -46.49384 0.89777 1.69231 -46.53096 361.88690
760.0000 -47.68947 -46.63498 1.05448 1.70411 -46.44403 370.76649
765.0000 -47.25688 -46.01700 1.23988 1.73443 -46.22064 401.13886
770.0000 -47.64642 -46.63596 1.01046 1.70946 -46.40460 389.50418
775.0000 -47.47150 -46.49592 0.97557 1.71528 -46.36174 392.50354
780.0000 -46.83934 -46.02696 0.81238 1.71779 -46.34323 390.05843
785.0000 -47.09093 -46.10521 0.98572 1.75422 -46.07482 433.63852
790.0000 -47.38689 -46.27670 1.11019 1.74815 -46.11951 420.23066
795.0000 -47.28308 -46.02017 1.26291 1.73388 -46.22466 395.68519
800.0000 -47.58489 -46.39361 1.19128 1.74931 -46.11097 425.84989
805.0000 -47.31293 -46.23920 1.07372 1.68968 -46.55033 363.24278
810.0000 -47.48811 -46.45743 1.03068 1.73933 -46.18454 425.01412
815.0000 -47.34591 -46.22934 1.11657 1.73131 -46.24361 401.79491
820.0000 -47.45475 -46.42008 1.03467 1.69398 -46.51866 355.36600
825.0000 -47.34771 -46.33003 1.01768 1.69404 -46.51821 355.38502
830.0000 -46.81684 -45.65002 1.16683 1.74289 -46.15831 444.84959
835.0000 -47.16113 -46.03622 1.12491 1.79554 -45.77036 520.51019
840.0000 -47.50142 -46.35368 1.14774 1.73513 -46.21542 413.25557
845.0000 -47.30644 -46.45487 0.85157 1.71727 -46.34706 398.87669
850.0000 -47.10116 -46.41829 0.68287 1.69917 -46.48042 378.94767
855.0000 -47.54791 -46.54989 0.99801 1.71369 -46.37344 388.45591
860.0000 -47.54905 -46.28705 1.26200 1.72276 -46.30659 391.35981
865.0000 -47.66536 -46.64878 1.01659 1.70949 -46.40441 375.01464
870.0000 -47.08072 -45.77064 1.31008 1.74900 -46.11323 428.27409
875.0000 -47.22203 -45.81126 1.41077 1.80626 -45.69139 480.21077
880.0000 -47.26771 -46.43833 0.82938 1.74818 -46.11928 432.74808
885.0000 -47.48347 -46.46007 1.02340 1.69862 -46.48450 366.31255
890.0000 -47.48380 -46.46382 1.01998 1.67038 -46.69253 324.63434
895.0000 -47.64761 -46.71475 0.93286 1.70809 -46.41472 383.23823
900.0000 -47.69485 -46.48375 1.21109 1.67101 -46.68787 332.48312
905.0000 -47.46826 -46.21274 1.25552 1.72604 -46.28244 416.37974
910.0000 -47.07041 -45.90283 1.16759 1.74316 -46.15627 421.80946
915.0000 -47.30353 -46.12899 1.17454 1.73748 -46.19816 421.56736
920.0000 -47.32370 -46.33870 0.98499 1.72408 -46.29689 402.17352
925.0000 -47.29212 -46.33457 0.95755 1.72690 -46.27611 389.60486
930.0000 -47.58845 -46.78655 0.80190 1.69012 -46.54707 354.10147
935.0000 -47.57602 -46.63430 0.94172 1.67155 -46.68395 340.52270
940.0000 -47.01503 -45.89218 1.12285 1.72256 -46.30809 409.95187
945.0000 -46.78327 -45.98877 0.79450 1.73683 -46.20290 419.75685
950.0000 -47.44772 -46.55582 0.89190 1.72186 -46.31325 413.22415
955.0000 -47.38545 -46.07945 1.30600 1.70257 -46.45539 369.09208
960.0000 -47.03056 -46.02889 1.00167 1.74392 -46.15070 430.18072
965.0000 -47.51766 -46.54283 0.97483 1.72831 -46.26568 411.26723
970.0000 -47.29740 -46.19897 1.09843 1.72085 -46.32064 392.44359
975.0000 -47.27434 -46.06088 1.21346 1.73857 -46.19011 410.62851
980.0000 -47.47404 -46.55639 0.91765 1.70470 -46.43970 374.28676
985.0000 -47.48469 -46.65354 0.83115 1.66939 -46.69979 333.60209
990.0000 -47.17354 -46.15335 1.02020 1.69585 -46.50489 364.47173
995.0000 -47.30507 -46.11196 1.19310 1.75798 -46.04707 447.56536
1000.0000 -47.67655 -46.88727 0.78928 1.68932 -46.55301 360.12837
MELTING PROCESS: loop number 5 T-loop= 416.00000000000000
main_MD> interactions number 5 at Temperature= 416.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.01903 -0.11896 -0.45185
force_rgl> df(natom) 0.87537 0.66135 1.02028
1005.0000 -47.47811 -46.83791 0.64020 1.66431 -46.73723 312.41856
1010.0000 -47.53869 -46.54635 0.99234 1.65074 -46.83723 298.33851
1015.0000 -47.41470 -46.43625 0.97845 1.67374 -46.66778 327.57015
1020.0000 -47.34129 -46.09571 1.24558 1.74890 -46.11401 449.49393
1025.0000 -47.33215 -46.22712 1.10502 1.77270 -45.93866 491.28321
1030.0000 -47.16170 -46.12827 1.03343 1.72821 -46.26643 398.98792
1035.0000 -46.92965 -45.70331 1.22634 1.76834 -45.97076 460.23817
1040.0000 -47.53889 -46.43016 1.10872 1.74883 -46.11447 422.47003
1045.0000 -47.18791 -46.16577 1.02214 1.72901 -46.26058 401.90965
1050.0000 -47.04624 -46.06939 0.97685 1.72816 -46.26678 396.17865
1055.0000 -47.14664 -46.05174 1.09490 1.74906 -46.11280 427.09560
1060.0000 -47.20288 -46.25849 0.94440 1.75803 -46.04670 454.28282
1065.0000 -47.23990 -46.33517 0.90474 1.73336 -46.22847 382.41309
1070.0000 -47.45714 -46.12639 1.33075 1.73258 -46.23425 409.44348
1075.0000 -47.10216 -45.87222 1.22994 1.74811 -46.11982 438.30372
1080.0000 -47.35524 -46.32801 1.02722 1.75734 -46.05184 449.91917
1085.0000 -47.24734 -46.13593 1.11141 1.73890 -46.18765 422.19102
1090.0000 -47.32117 -46.48642 0.83475 1.72057 -46.32275 393.91917
1095.0000 -47.32625 -46.25108 1.07517 1.72380 -46.29894 401.43833
1100.0000 -47.35832 -45.77592 1.58240 1.75322 -46.08217 441.88013
1105.0000 -47.25978 -45.80826 1.45152 1.79450 -45.77802 516.14397
1110.0000 -47.28756 -46.14859 1.13897 1.75389 -46.07721 432.07743
1115.0000 -47.35202 -46.08572 1.26630 1.75856 -46.04284 457.85287
1120.0000 -47.51844 -46.69494 0.82350 1.69269 -46.52814 356.88262
1125.0000 -47.43260 -46.44522 0.98738 1.67529 -46.65634 338.63837
1130.0000 -47.29898 -46.42149 0.87750 1.73013 -46.25231 408.50601
1135.0000 -47.51676 -46.42091 1.09585 1.72801 -46.26792 406.10579
1140.0000 -47.47072 -46.28257 1.18815 1.72014 -46.32590 399.73318
1145.0000 -47.31766 -45.99758 1.32008 1.73843 -46.19111 424.24945
1150.0000 -47.34930 -46.12412 1.22518 1.75252 -46.08729 441.58420
1155.0000 -47.40065 -46.63366 0.76699 1.71863 -46.33702 385.37158
1160.0000 -47.36654 -46.52973 0.83681 1.69722 -46.49476 370.43326
1165.0000 -47.60050 -46.21104 1.38946 1.71729 -46.34687 405.85844
1170.0000 -47.46128 -46.53320 0.92808 1.70310 -46.45146 396.66947
1175.0000 -47.31746 -46.16903 1.14843 1.70808 -46.41479 387.50028
1180.0000 -47.37021 -46.11045 1.25976 1.73366 -46.22626 414.68884
1185.0000 -47.09932 -45.99721 1.10211 1.76231 -46.01521 442.41603
1190.0000 -47.13856 -46.22186 0.91671 1.74889 -46.11404 417.93505
1195.0000 -47.08130 -46.19910 0.88220 1.73645 -46.20576 411.94277
1200.0000 -47.22109 -46.25869 0.96241 1.74728 -46.12591 433.18819
1205.0000 -47.48335 -46.22949 1.25386 1.73563 -46.21178 423.87826
1210.0000 -47.59789 -46.45420 1.14369 1.72700 -46.27539 398.23955
1215.0000 -47.03580 -45.83619 1.19961 1.75543 -46.06589 444.22157
1220.0000 -47.24239 -46.29599 0.94639 1.78144 -45.87421 482.48656
1225.0000 -47.34592 -46.08839 1.25753 1.74578 -46.13698 407.79611
1230.0000 -47.52618 -46.82328 0.70290 1.69497 -46.51132 365.94544
1235.0000 -47.54600 -46.08041 1.46559 1.71328 -46.37642 395.11880
1240.0000 -47.19505 -45.99676 1.19829 1.76236 -46.01479 455.93327
1245.0000 -47.29849 -46.46359 0.83490 1.70959 -46.40367 397.43256
1250.0000 -47.08689 -46.20051 0.88638 1.73047 -46.24980 392.55285
MELTING PROCESS: loop number 6 T-loop= 441.00000000000000
main_MD> interactions number 6 at Temperature= 441.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.27545 1.44911 0.43712
force_rgl> df(natom) 0.29459 3.25500 1.39907
1255.0000 -47.34600 -46.26758 1.07842 1.73419 -46.22236 399.26494
1260.0000 -47.09462 -45.71258 1.38204 1.78268 -45.86509 478.92448
1265.0000 -47.30173 -46.40348 0.89824 1.74455 -46.14608 427.35996
1270.0000 -47.40319 -46.18598 1.21721 1.71081 -46.39467 389.90849
1275.0000 -47.35856 -46.05868 1.29988 1.73587 -46.20999 417.74826
1280.0000 -47.24218 -45.90962 1.33256 1.76178 -46.01909 444.39501
1285.0000 -47.38672 -45.97779 1.40893 1.78273 -45.86476 481.00231
1290.0000 -47.16715 -45.78827 1.37888 1.77419 -45.92768 471.76534
1295.0000 -47.09228 -46.15231 0.93996 1.76345 -46.00681 467.39264
1300.0000 -47.27665 -46.45152 0.82514 1.70553 -46.43358 374.97176
1305.0000 -46.89947 -45.74726 1.15221 1.74947 -46.10977 435.85024
1310.0000 -47.31183 -46.70840 0.60343 1.70285 -46.45331 371.80058
1315.0000 -46.80498 -46.12195 0.68303 1.71414 -46.37009 382.31057
1320.0000 -47.18954 -46.02905 1.16048 1.76351 -46.00632 452.20531
1325.0000 -47.15146 -46.24419 0.90727 1.73543 -46.21321 408.45733
1330.0000 -47.08516 -45.81872 1.26645 1.77901 -45.89213 471.21814
1335.0000 -46.49421 -45.19774 1.29646 1.83727 -45.46286 529.08603
1340.0000 -47.08563 -45.39463 1.69099 1.83355 -45.49030 505.20960
1345.0000 -46.56774 -45.37990 1.18784 1.82753 -45.53461 534.44565
1350.0000 -47.00172 -46.04896 0.95276 1.77117 -45.94992 462.83611
1355.0000 -47.45778 -46.54161 0.91616 1.70264 -46.45484 374.96908
1360.0000 -46.70438 -45.77897 0.92541 1.75426 -46.07452 446.37212
1365.0000 -46.66199 -45.85464 0.80735 1.77670 -45.90919 471.16362
1370.0000 -47.05739 -45.90505 1.15233 1.80017 -45.73622 510.07488
1375.0000 -47.13317 -46.25268 0.88049 1.74304 -46.15714 428.38875
1380.0000 -47.27073 -46.01669 1.25403 1.75138 -46.09572 439.05874
1385.0000 -47.13870 -45.90784 1.23087 1.79077 -45.80551 502.07697
1390.0000 -46.62470 -45.57185 1.05285 1.77320 -45.93494 456.18943
1395.0000 -47.44957 -46.25006 1.19951 1.80076 -45.73190 504.51131
1400.0000 -47.28280 -46.03082 1.25198 1.72144 -46.31629 408.76534
1405.0000 -47.22943 -45.93776 1.29167 1.74993 -46.10642 424.94973
1410.0000 -47.23280 -46.02005 1.21275 1.78891 -45.81923 510.87209
1415.0000 -47.26050 -46.28161 0.97889 1.76075 -46.02669 405.12611
1420.0000 -47.02020 -45.87448 1.14572 1.76846 -45.96986 428.25604
1425.0000 -46.54047 -45.41587 1.12460 1.82672 -45.54061 474.64201
1430.0000 -46.63412 -45.51787 1.11626 1.81936 -45.59485 496.13686
1435.0000 -47.36429 -45.85462 1.50967 1.79004 -45.81084 493.47929
1440.0000 -47.51555 -46.47402 1.04153 1.73200 -46.23855 421.49677
1445.0000 -47.27297 -46.33293 0.94004 1.70342 -46.44909 397.22068
1450.0000 -47.05531 -45.47199 1.58333 1.83260 -45.49726 514.16315
1455.0000 -46.81441 -45.62199 1.19242 1.82498 -45.55344 516.02298
1460.0000 -47.31892 -45.97855 1.34037 1.78226 -45.86819 466.07939
1465.0000 -47.25815 -45.88344 1.37470 1.77626 -45.91240 478.91716
1470.0000 -47.15917 -45.77121 1.38796 1.78833 -45.82351 478.03163
1475.0000 -47.42400 -46.35342 1.07057 1.74417 -46.14885 410.00101
1480.0000 -47.52232 -46.24383 1.27849 1.75124 -46.09678 427.76600
1485.0000 -47.20217 -46.12916 1.07301 1.73347 -46.22771 420.35841
1490.0000 -47.06241 -45.93530 1.12711 1.76861 -45.96878 468.56164
1495.0000 -46.98413 -45.34673 1.63740 1.80060 -45.73310 509.00086
1500.0000 -46.89794 -45.92186 0.97609 1.83534 -45.47709 541.89554
MELTING PROCESS: loop number 7 T-loop= 466.00000000000000
main_MD> interactions number 7 at Temperature= 466.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.16236 -3.58504 0.81480
force_rgl> df(natom) 2.13984 2.79295 0.30229
1505.0000 -46.90611 -45.62711 1.27900 1.80933 -45.66875 524.31696
1510.0000 -47.06690 -45.57634 1.49056 1.79470 -45.77654 492.84242
1515.0000 -47.28445 -45.56090 1.72355 1.85418 -45.33828 568.84944
1520.0000 -47.27612 -46.41803 0.85809 1.76587 -45.98893 467.90411
1525.0000 -46.98176 -45.75466 1.22710 1.73892 -46.18754 415.25917
1530.0000 -47.25122 -46.20186 1.04936 1.79784 -45.75339 521.80378
1535.0000 -47.14143 -46.01924 1.12219 1.74122 -46.17057 423.34217
1540.0000 -47.03998 -45.90740 1.13258 1.78440 -45.85239 486.45352
1545.0000 -46.98803 -45.75455 1.23348 1.77938 -45.88940 469.61991
1550.0000 -47.58682 -46.16157 1.42525 1.81426 -45.63244 540.08525
1555.0000 -47.24399 -45.97635 1.26764 1.75065 -46.10108 437.59562
1560.0000 -47.07381 -45.57481 1.49900 1.78378 -45.85702 501.36942
1565.0000 -47.08268 -45.55287 1.52981 1.82788 -45.53208 537.12556
1570.0000 -47.05393 -46.01715 1.03678 1.78742 -45.83019 500.22365
1575.0000 -46.88656 -45.76914 1.11742 1.78947 -45.81509 508.23644
1580.0000 -46.94792 -46.35105 0.59687 1.76678 -45.98228 462.62126
1585.0000 -47.34634 -46.43479 0.91155 1.74754 -46.12402 424.56757
1590.0000 -47.34450 -46.18966 1.15484 1.74471 -46.14486 423.37767
1595.0000 -47.23058 -45.96147 1.26910 1.73850 -46.19064 406.93231
1600.0000 -46.60933 -45.40756 1.20176 1.76742 -45.97755 461.26898
1605.0000 -47.12537 -45.72169 1.40368 1.80531 -45.69835 506.68701
1610.0000 -46.90381 -45.76034 1.14347 1.78817 -45.82462 476.93165
1615.0000 -47.00456 -45.73676 1.26779 1.77109 -45.95050 452.51931
1620.0000 -47.57447 -46.21617 1.35829 1.78302 -45.86260 471.83254
1625.0000 -47.47520 -46.24529 1.22991 1.73528 -46.21438 420.07155
1630.0000 -46.86778 -45.62677 1.24100 1.71399 -46.37124 396.93351
1635.0000 -46.55400 -45.34125 1.21275 1.84404 -45.41300 530.92740
1640.0000 -46.79880 -45.66041 1.13839 1.84149 -45.43181 541.16123
1645.0000 -46.62437 -45.43209 1.19228 1.83852 -45.45366 533.69566
1650.0000 -46.80404 -45.87877 0.92528 1.78842 -45.82281 479.71343
1655.0000 -46.93952 -45.61708 1.32244 1.79020 -45.80972 477.76458
1660.0000 -47.41518 -46.04702 1.36816 1.76914 -45.96489 458.13229
1665.0000 -47.64238 -46.39148 1.25090 1.76717 -45.97938 450.00569
1670.0000 -47.45807 -46.31280 1.14527 1.73008 -46.25263 404.96380
1675.0000 -47.46672 -46.49648 0.97024 1.71643 -46.35325 393.55071
1680.0000 -47.36577 -46.40512 0.96065 1.73436 -46.22111 415.16210
1685.0000 -46.91266 -46.19123 0.72143 1.75029 -46.10377 439.90438
1690.0000 -47.26044 -46.13594 1.12449 1.75705 -46.05391 439.25075
1695.0000 -47.25989 -45.79587 1.46402 1.77324 -45.93464 462.78164
1700.0000 -46.93968 -45.57895 1.36073 1.81836 -45.60223 524.57790
1705.0000 -47.20039 -45.88642 1.31396 1.79119 -45.80242 501.43122
1710.0000 -47.44272 -46.62085 0.82187 1.72404 -46.29717 390.62689
1715.0000 -47.32864 -46.38734 0.94131 1.72250 -46.30850 389.06552
1720.0000 -47.28767 -45.96377 1.32390 1.74906 -46.11282 438.85811
1725.0000 -47.18948 -46.20315 0.98633 1.75839 -46.04404 458.23208
1730.0000 -47.53601 -46.04592 1.49009 1.74738 -46.12517 435.32855
1735.0000 -47.15604 -45.98099 1.17505 1.75148 -46.09496 448.01193
1740.0000 -47.29290 -46.15428 1.13861 1.74284 -46.15866 430.69933
1745.0000 -46.89100 -45.62075 1.27024 1.79227 -45.79445 484.72013
1750.0000 -46.35473 -45.29125 1.06348 1.81086 -45.65748 514.58075
MELTING PROCESS: loop number 8 T-loop= 491.00000000000000
main_MD> interactions number 8 at Temperature= 491.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 4.34002 -1.04137 -1.21422
force_rgl> df(natom) 1.17891 3.43359 3.83308
1755.0000 -46.52856 -45.44456 1.08400 1.87184 -45.20817 570.99872
1760.0000 -46.92030 -45.88530 1.03500 1.82958 -45.51956 547.69680
1765.0000 -46.96423 -45.81491 1.14931 1.78073 -45.87948 476.12747
1770.0000 -47.46309 -46.15874 1.30434 1.76970 -45.96075 458.62023
1775.0000 -46.93744 -45.70153 1.23591 1.73870 -46.18918 431.76406
1780.0000 -46.90141 -45.43037 1.47103 1.82617 -45.54470 523.78603
1785.0000 -46.70129 -45.66119 1.04010 1.83773 -45.45948 534.86401
1790.0000 -46.92195 -45.38438 1.53757 1.84766 -45.38632 592.34941
1795.0000 -46.89004 -45.55517 1.33488 1.82819 -45.52981 558.42588
1800.0000 -47.06549 -45.65886 1.40663 1.86044 -45.29218 569.00307
1805.0000 -47.04740 -45.71658 1.33081 1.84856 -45.37968 558.30039
1810.0000 -46.90120 -45.69684 1.20436 1.83516 -45.47845 545.58715
1815.0000 -47.03600 -45.78283 1.25318 1.81949 -45.59387 536.29847
1820.0000 -46.80233 -45.67639 1.12594 1.82075 -45.58461 469.18094
1825.0000 -46.78027 -45.53029 1.24999 1.81532 -45.62457 459.91099
1830.0000 -46.91868 -45.83443 1.08425 1.73859 -46.18995 358.96301
1835.0000 -47.17419 -46.07879 1.09540 1.77495 -45.92208 429.85981
1840.0000 -46.52823 -45.32418 1.20406 1.78525 -45.84617 437.15049
1845.0000 -47.05301 -45.44177 1.61123 1.84004 -45.44250 489.94132
1850.0000 -47.12853 -45.79626 1.33227 1.81328 -45.63962 534.10874
1855.0000 -47.03168 -46.08025 0.95143 1.77978 -45.88644 476.75965
1860.0000 -47.06972 -45.75865 1.31107 1.81506 -45.62652 516.82727
1865.0000 -46.84053 -45.34420 1.49633 1.84966 -45.37156 565.86275
1870.0000 -46.32849 -45.07265 1.25584 1.85047 -45.36562 558.93382
1875.0000 -46.33674 -44.93729 1.39945 1.88920 -45.08026 554.16943
1880.0000 -47.04792 -45.15276 1.89517 1.88199 -45.13341 591.33551
1885.0000 -46.75076 -45.19326 1.55750 1.87900 -45.15538 598.94692
1890.0000 -46.95156 -45.75781 1.19375 1.81676 -45.61398 524.00549
1895.0000 -47.26838 -46.18667 1.08171 1.79231 -45.79411 504.05260
1900.0000 -47.14011 -45.73747 1.40264 1.78822 -45.82428 483.39874
1905.0000 -47.37121 -46.08817 1.28305 1.77597 -45.91456 451.96392
1910.0000 -47.10893 -45.77896 1.32996 1.77747 -45.90348 463.77879
1915.0000 -47.25397 -45.96163 1.29234 1.78703 -45.83306 489.40517
1920.0000 -46.91492 -45.20851 1.70641 1.81963 -45.59283 527.70065
1925.0000 -46.67338 -45.50766 1.16572 1.86890 -45.22986 622.04525
1930.0000 -46.85200 -45.74702 1.10498 1.78733 -45.83084 494.81051
1935.0000 -47.04087 -45.70021 1.34066 1.78213 -45.86914 480.23028
1940.0000 -47.50580 -45.68198 1.82383 1.78640 -45.83770 483.63776
1945.0000 -46.93449 -46.10422 0.83027 1.77565 -45.91688 473.74070
1950.0000 -47.35202 -45.98998 1.36204 1.79506 -45.77391 485.53300
1955.0000 -47.35395 -46.19340 1.16055 1.75666 -46.05678 436.28554
1960.0000 -47.31877 -46.21186 1.10691 1.74341 -46.15442 425.88552
1965.0000 -47.06523 -46.10192 0.96332 1.74079 -46.17372 415.40845
1970.0000 -47.28728 -45.91266 1.37463 1.77550 -45.91797 477.32641
1975.0000 -46.91099 -45.07457 1.83642 1.83431 -45.48466 528.65824
1980.0000 -46.49592 -45.05584 1.44008 1.88644 -45.10062 610.82271
1985.0000 -47.41687 -45.34431 2.07255 1.80072 -45.73217 514.00387
1990.0000 -46.98507 -45.64694 1.33813 1.79937 -45.74211 490.74415
1995.0000 -46.95479 -45.79628 1.15850 1.83263 -45.49703 538.54200
2000.0000 -47.42833 -46.11631 1.31202 1.79267 -45.79152 490.61384
MELTING PROCESS: loop number 9 T-loop= 516.00000000000000
main_MD> interactions number 9 at Temperature= 516.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.04001 0.07958 -1.40405
force_rgl> df(natom) 3.17414 0.02095 -1.61203
2005.0000 -47.18096 -46.03415 1.14680 1.81051 -45.66004 506.67338
2010.0000 -47.35553 -45.50872 1.84681 1.80293 -45.71591 482.59554
2015.0000 -46.55002 -45.41229 1.13774 1.83142 -45.50599 523.65493
2020.0000 -46.73598 -45.44302 1.29296 1.85825 -45.30829 537.05238
2025.0000 -46.74045 -45.74256 0.99790 1.82548 -45.54975 527.78368
2030.0000 -46.71457 -45.86571 0.84886 1.79288 -45.78997 468.97914
2035.0000 -47.48312 -46.17815 1.30497 1.75970 -46.03445 441.39106
2040.0000 -47.15483 -45.82464 1.33019 1.76245 -46.01419 458.04578
2045.0000 -47.41129 -46.34649 1.06480 1.76214 -46.01645 478.83881
2050.0000 -47.26797 -45.78229 1.48569 1.73271 -46.23329 407.92978
2055.0000 -46.91501 -45.67975 1.23526 1.84360 -45.41623 571.01700
2060.0000 -47.28469 -46.26176 1.02293 1.77585 -45.91546 480.00754
2065.0000 -47.08441 -46.03053 1.05388 1.76237 -46.01476 446.77646
2070.0000 -46.94372 -45.41097 1.53275 1.82822 -45.52958 532.84235
2075.0000 -47.16714 -45.68981 1.47733 1.80443 -45.70484 504.41720
2080.0000 -46.82057 -45.21609 1.60448 1.81857 -45.60069 522.95795
2085.0000 -46.83638 -45.66399 1.17239 1.85433 -45.33718 593.03226
2090.0000 -47.05905 -45.65845 1.40060 1.82528 -45.55119 545.20969
2095.0000 -47.03812 -46.01263 1.02550 1.80193 -45.72324 501.89708
2100.0000 -47.43374 -46.31162 1.12212 1.74017 -46.17831 419.78204
2105.0000 -46.93818 -45.85095 1.08723 1.76824 -45.97148 448.14425
2110.0000 -47.12594 -46.06025 1.06569 1.77002 -45.95840 470.22079
2115.0000 -46.98985 -45.79351 1.19634 1.77808 -45.89897 469.34471
2120.0000 -46.75929 -45.38426 1.37503 1.82369 -45.56293 541.50918
2125.0000 -47.11094 -45.85803 1.25291 1.79095 -45.80415 489.44085
2130.0000 -47.02901 -45.76024 1.26877 1.78383 -45.85665 476.97244
2135.0000 -47.17067 -45.41754 1.75313 1.83255 -45.49763 539.18476
2140.0000 -47.18904 -45.71185 1.47719 1.82080 -45.58425 534.64326
2145.0000 -46.82370 -45.48782 1.33588 1.82173 -45.57737 526.51598
2150.0000 -47.41105 -46.01368 1.39737 1.79505 -45.77399 499.41003
2155.0000 -47.39337 -46.33632 1.05705 1.75443 -46.07326 443.47040
2160.0000 -47.13171 -45.48034 1.65137 1.76813 -45.97234 479.14348
2165.0000 -47.02982 -45.58761 1.44221 1.80105 -45.72972 496.66133
2170.0000 -46.80290 -45.60746 1.19544 1.80619 -45.69188 500.15825
2175.0000 -47.39433 -45.76858 1.62575 1.79540 -45.77141 498.16217
2180.0000 -47.01643 -45.58608 1.43036 1.79006 -45.81072 486.54294
2185.0000 -46.73558 -45.25993 1.47565 1.81060 -45.65938 511.39158
2190.0000 -46.82820 -45.55708 1.27112 1.86100 -45.28802 566.05663
2195.0000 -47.45374 -46.29301 1.16074 1.77334 -45.93395 483.21782
2200.0000 -47.02624 -45.97348 1.05276 1.73834 -46.19180 420.34596
2205.0000 -47.44950 -46.23152 1.21797 1.77300 -45.93646 470.29706
2210.0000 -47.31518 -46.11092 1.20425 1.75076 -46.10031 442.31245
2215.0000 -47.16023 -45.68199 1.47824 1.78177 -45.87181 477.10295
2220.0000 -47.01070 -45.75064 1.26006 1.79221 -45.79489 509.46576
2225.0000 -47.01704 -45.56635 1.45070 1.79324 -45.78732 498.91547
2230.0000 -47.11254 -46.09528 1.01726 1.78479 -45.84958 508.57843
2235.0000 -47.19611 -45.97496 1.22116 1.76460 -45.99828 444.84838
2240.0000 -46.74959 -45.05374 1.69585 1.82489 -45.55409 530.63503
2245.0000 -46.56393 -45.26416 1.29977 1.87223 -45.20532 606.71542
2250.0000 -46.65824 -45.22167 1.43657 1.85606 -45.32444 565.68504
MELTING PROCESS: loop number 10 T-loop= 541.00000000000000
main_MD> interactions number 10 at Temperature= 541.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.37124 -1.99496 2.33192
force_rgl> df(natom) 2.63309 -1.55139 -2.48188
2255.0000 -46.73083 -45.21771 1.51312 1.86788 -45.23733 521.63913
2260.0000 -47.01726 -45.49407 1.52319 1.86125 -45.28617 540.87505
2265.0000 -47.02104 -45.82151 1.19953 1.77604 -45.91406 470.42138
2270.0000 -46.98758 -45.82686 1.16072 1.78785 -45.82703 479.91789
2275.0000 -46.77641 -45.76012 1.01629 1.82022 -45.58852 505.67792
2280.0000 -46.88340 -45.56678 1.31662 1.81393 -45.63481 488.13341
2285.0000 -46.82328 -45.75943 1.06386 1.81970 -45.59236 526.23751
2290.0000 -47.06350 -45.37201 1.69148 1.77106 -45.95069 457.42782
2295.0000 -47.05021 -45.58441 1.46581 1.83525 -45.47780 564.72366
2300.0000 -46.32193 -44.69690 1.62502 1.88994 -45.07478 640.35072
2305.0000 -46.00840 -44.92741 1.08099 1.91821 -44.86651 605.73918
2310.0000 -46.59551 -44.96492 1.63059 1.89999 -45.00075 529.66448
2315.0000 -46.55685 -45.62362 0.93323 1.84725 -45.38932 493.08736
2320.0000 -46.49798 -45.44863 1.04935 1.84552 -45.40211 519.67131
2325.0000 -46.95040 -45.27591 1.67449 1.82641 -45.54287 517.09060
2330.0000 -46.56248 -45.32451 1.23797 1.81575 -45.62142 513.60355
2335.0000 -46.31419 -45.31106 1.00313 1.87062 -45.21713 570.49195
2340.0000 -46.90787 -45.53242 1.37545 1.86842 -45.23336 549.28230
2345.0000 -47.14905 -45.36349 1.78556 1.80448 -45.70445 492.54774
2350.0000 -46.92908 -45.43377 1.49532 1.83805 -45.45716 564.31168
2355.0000 -47.26280 -45.96955 1.29325 1.83514 -45.47861 591.74210
2360.0000 -47.15007 -45.97286 1.17721 1.76118 -46.02350 452.93103
2365.0000 -46.95427 -45.99502 0.95925 1.81917 -45.59624 506.27684
2370.0000 -47.05001 -45.59212 1.45789 1.84449 -45.40968 574.31381
2375.0000 -47.06822 -45.74912 1.31910 1.79033 -45.80872 487.26369
2380.0000 -46.66199 -45.22787 1.43412 1.83988 -45.44368 494.57684
2385.0000 -47.03456 -45.26129 1.77327 1.86766 -45.23900 507.05042
2390.0000 -46.00146 -44.96542 1.03604 1.87219 -45.20556 525.19006
2395.0000 -46.82441 -45.51193 1.31248 1.86198 -45.28079 560.93105
2400.0000 -46.63336 -45.48290 1.15046 1.84021 -45.44120 538.97978
2405.0000 -47.18683 -45.73945 1.44738 1.83817 -45.45621 562.70170
2410.0000 -46.84530 -45.53799 1.30731 1.80074 -45.73204 494.04603
2415.0000 -46.50082 -45.20018 1.30064 1.86863 -45.23183 581.73599
2420.0000 -46.61008 -44.84432 1.76576 1.88145 -45.13737 594.66824
2425.0000 -46.74061 -44.97337 1.76724 1.90378 -44.97282 662.13954
2430.0000 -46.36038 -45.08049 1.27989 1.89670 -45.02501 629.90567
2435.0000 -46.88930 -45.52971 1.35959 1.85064 -45.36437 586.86667
2440.0000 -47.17701 -45.57912 1.59789 1.85733 -45.31505 617.22728
2445.0000 -46.55530 -45.47828 1.07701 1.83757 -45.46069 512.14512
2450.0000 -46.80121 -45.23828 1.56293 1.87280 -45.20112 551.71383
2455.0000 -47.06851 -45.57873 1.48977 1.85398 -45.33974 561.20871
2460.0000 -47.02621 -45.34238 1.68383 1.85707 -45.31702 552.29425
2465.0000 -46.90562 -45.50923 1.39639 1.86371 -45.26810 576.36259
2470.0000 -46.88983 -45.51580 1.37404 1.83303 -45.49409 531.22965
2475.0000 -47.37441 -45.98463 1.38978 1.81950 -45.59380 527.39719
2480.0000 -46.66908 -45.91535 0.75373 1.77436 -45.92637 480.59447
2485.0000 -47.13794 -45.56549 1.57245 1.77860 -45.89518 461.77677
2490.0000 -47.12422 -45.95114 1.17309 1.77860 -45.89517 468.78464
2495.0000 -46.71357 -45.12487 1.58870 1.80953 -45.66724 503.64479
2500.0000 -46.03437 -44.56629 1.46809 1.91161 -44.91515 572.05237
MELTING PROCESS: loop number 11 T-loop= 566.00000000000000
main_MD> interactions number 11 at Temperature= 566.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.24805 1.96354 0.59087
force_rgl> df(natom) -5.05652 3.32627 -5.87113
2505.0000 -46.00902 -44.20715 1.80186 1.95833 -44.57091 675.14923
2510.0000 -46.28544 -44.99391 1.29152 1.94866 -44.64212 615.61214
2515.0000 -46.48938 -44.98715 1.50223 1.91996 -44.85358 561.58690
2520.0000 -46.19630 -44.43902 1.75728 1.92125 -44.84411 583.30649
2525.0000 -46.38190 -45.01185 1.37005 1.90183 -44.98720 596.37720
2530.0000 -47.07704 -45.70836 1.36868 1.84514 -45.40490 544.65468
2535.0000 -46.84717 -45.57185 1.27532 1.81571 -45.62174 522.35806
2540.0000 -46.83577 -45.54736 1.28841 1.81353 -45.63779 534.57583
2545.0000 -46.99788 -45.83682 1.16106 1.82618 -45.54462 533.85503
2550.0000 -46.90375 -45.63912 1.26463 1.80895 -45.67157 524.26420
2555.0000 -46.37039 -45.25168 1.11871 1.84952 -45.37259 540.90892
2560.0000 -46.80556 -45.13198 1.67358 1.84798 -45.38400 558.12589
2565.0000 -46.62026 -45.00934 1.61093 1.91641 -44.87976 635.58203
2570.0000 -46.92110 -45.37081 1.55028 1.84874 -45.37839 535.54293
2575.0000 -47.19066 -45.99195 1.19871 1.78827 -45.82392 490.96939
2580.0000 -47.12732 -45.90235 1.22497 1.77917 -45.89099 474.77183
2585.0000 -46.51725 -45.03886 1.47839 1.84856 -45.37972 575.00936
2590.0000 -46.68589 -45.19897 1.48692 1.87742 -45.16706 531.75633
2595.0000 -46.37092 -44.52765 1.84327 1.89171 -45.06177 533.88973
2600.0000 -46.30665 -44.93708 1.36957 1.93843 -44.71750 612.26589
2605.0000 -46.53930 -44.79693 1.74238 1.91252 -44.90842 593.04065
2610.0000 -45.60014 -44.06430 1.53584 1.99075 -44.33202 643.28889
2615.0000 -46.43541 -45.07810 1.35731 1.97303 -44.46257 684.79863
2620.0000 -47.32318 -45.70523 1.61795 1.86020 -45.29390 578.94122
2625.0000 -46.99913 -45.26507 1.73406 1.82878 -45.52540 541.43505
2630.0000 -46.81976 -45.30317 1.51658 1.88571 -45.10598 601.70833
2635.0000 -46.63274 -44.89255 1.74019 1.85205 -45.35396 599.47085
2640.0000 -47.03520 -45.41968 1.61551 1.88651 -45.10007 622.14083
2645.0000 -46.85396 -44.86271 1.99124 1.88455 -45.11450 596.00856
2650.0000 -46.46029 -44.72308 1.73721 1.88501 -45.11112 542.95779
2655.0000 -46.63336 -44.81936 1.81400 1.90029 -44.99852 626.57015
2660.0000 -47.01016 -44.84338 2.16677 1.91563 -44.88555 635.54197
2665.0000 -46.80831 -45.03004 1.77827 1.92399 -44.82391 663.67223
2670.0000 -46.84674 -45.39868 1.44806 1.88253 -45.12943 596.77932
2675.0000 -46.27307 -44.83147 1.44160 1.88411 -45.11779 604.22121
2680.0000 -46.46698 -44.52588 1.94110 1.95785 -44.57445 673.41114
2685.0000 -46.39532 -44.54987 1.84544 1.98403 -44.38153 672.33057
2690.0000 -46.49014 -44.92202 1.56812 1.90124 -44.99155 562.44500
2695.0000 -46.47182 -44.83025 1.64156 1.95287 -44.61111 621.29221
2700.0000 -46.14851 -44.49135 1.65717 1.98745 -44.35636 650.09530
2705.0000 -46.35176 -44.66853 1.68323 1.97868 -44.42094 648.46698
2710.0000 -46.71791 -45.02492 1.69299 1.91695 -44.87578 589.40350
2715.0000 -46.01207 -44.34074 1.67133 1.93393 -44.75066 625.59073
2720.0000 -46.84805 -44.93547 1.91258 1.94422 -44.67490 652.67862
2725.0000 -46.77181 -45.56737 1.20443 1.84748 -45.38767 554.92996
2730.0000 -47.13920 -45.53616 1.60304 1.83261 -45.49720 512.68472
2735.0000 -46.46399 -45.49716 0.96683 1.85074 -45.36365 527.83198
2740.0000 -46.40500 -44.90377 1.50123 1.87867 -45.15785 571.13462
2745.0000 -46.57508 -44.55867 2.01642 1.90679 -44.95065 611.52638
2750.0000 -46.18800 -44.98577 1.20223 1.91880 -44.86216 631.39274
MELTING PROCESS: loop number 12 T-loop= 591.00000000000000
main_MD> interactions number 12 at Temperature= 591.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.96197 1.22997 -1.40978
force_rgl> df(natom) 0.58663 1.59382 0.28656
2755.0000 -46.35400 -44.88566 1.46834 1.91539 -44.88728 584.37913
2760.0000 -46.53707 -45.13015 1.40691 1.89078 -45.06864 552.35494
2765.0000 -46.38778 -44.96704 1.42074 1.88237 -45.13060 562.90518
2770.0000 -46.67224 -44.98442 1.68782 1.94549 -44.66551 642.48928
2775.0000 -46.49305 -45.05456 1.43848 1.90911 -44.93353 608.53889
2780.0000 -47.04193 -45.69141 1.35053 1.80502 -45.70049 484.97919
2785.0000 -46.79588 -45.23348 1.56240 1.80485 -45.70174 507.86710
2790.0000 -46.57618 -45.32144 1.25475 1.83385 -45.48810 535.99455
2795.0000 -47.21498 -45.54236 1.67262 1.83584 -45.47342 573.99235
2800.0000 -47.26134 -45.34314 1.91820 1.86114 -45.28698 600.67056
2805.0000 -47.16237 -45.97941 1.18296 1.82207 -45.57488 537.86132
2810.0000 -47.00239 -45.64186 1.36053 1.80718 -45.68462 501.55743
2815.0000 -47.29104 -45.73075 1.56028 1.84889 -45.37729 537.96704
2820.0000 -47.16389 -45.92120 1.24269 1.79890 -45.74560 518.39167
2825.0000 -46.53188 -45.18304 1.34884 1.89020 -45.07291 597.10898
2830.0000 -46.80904 -45.44453 1.36451 1.85199 -45.35441 532.64056
2835.0000 -46.62087 -45.62900 0.99187 1.85380 -45.34109 564.26536
2840.0000 -46.87263 -45.36192 1.51071 1.83895 -45.45047 541.25652
2845.0000 -46.56880 -45.09183 1.47698 1.88693 -45.09702 601.98166
2850.0000 -46.17380 -44.06526 2.10853 1.93617 -44.73417 669.36947
2855.0000 -46.29679 -44.46441 1.83238 1.99414 -44.30703 692.90392
2860.0000 -46.86304 -44.54432 2.31872 1.93799 -44.72075 681.55122
2865.0000 -46.75863 -45.18899 1.56964 1.96243 -44.54066 695.52728
2870.0000 -46.10809 -44.37858 1.72951 1.91817 -44.86679 634.69469
2875.0000 -46.02178 -43.93737 2.08440 1.99762 -44.28137 682.93974
2880.0000 -46.63810 -45.25006 1.38804 1.93064 -44.77489 654.23254
2885.0000 -47.26884 -46.08576 1.18308 1.84428 -45.41121 565.05434
2890.0000 -46.81206 -45.27433 1.53774 1.84566 -45.40110 568.15612
2895.0000 -46.91834 -45.18616 1.73218 1.83376 -45.48876 534.61135
2900.0000 -47.28984 -45.83982 1.45002 1.84788 -45.38473 539.08287
2905.0000 -46.91930 -45.21456 1.70474 1.84300 -45.42064 564.00000
2910.0000 -46.02171 -44.38008 1.64163 1.90173 -44.98793 625.09124
2915.0000 -45.95599 -43.63033 2.32566 2.06441 -43.78927 735.38779
2920.0000 -45.83408 -44.23557 1.59851 2.03779 -43.98545 730.60267
2925.0000 -46.43552 -45.19131 1.24421 1.92092 -44.84656 585.41724
2930.0000 -46.40781 -45.02907 1.37874 1.88838 -45.08628 544.48571
2935.0000 -46.84222 -45.43516 1.40706 1.87965 -45.15062 539.32895
2940.0000 -46.30870 -44.88143 1.42727 1.91232 -44.90988 577.77986
2945.0000 -46.16035 -44.69714 1.46321 1.93856 -44.71657 580.43947
2950.0000 -46.64223 -45.28682 1.35541 1.89147 -45.06354 552.00388
2955.0000 -46.46668 -45.00738 1.45930 1.85577 -45.32654 556.33892
2960.0000 -46.34721 -44.59189 1.75532 1.92458 -44.81957 647.83069
2965.0000 -46.10898 -44.25458 1.85440 1.96824 -44.49787 641.87893
2970.0000 -46.14388 -44.33303 1.81085 1.99017 -44.33631 617.34331
2975.0000 -46.59998 -45.38414 1.21584 1.94983 -44.63353 631.96810
2980.0000 -46.64371 -45.26078 1.38293 1.86232 -45.27832 548.71443
2985.0000 -46.76538 -45.17884 1.58654 1.85937 -45.30001 584.17878
2990.0000 -46.41268 -45.13375 1.27893 1.86331 -45.27103 562.79847
2995.0000 -47.19771 -45.27798 1.91972 1.87176 -45.20875 593.38975
3000.0000 -47.04258 -45.52210 1.52048 1.89478 -45.03912 634.90939
MELTING PROCESS: loop number 13 T-loop= 616.00000000000000
main_MD> interactions number 13 at Temperature= 616.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.35235 2.47498 0.23974
force_rgl> df(natom) 4.20566 -6.62238 1.59538
3005.0000 -46.68981 -45.35236 1.33745 1.84521 -45.40435 595.32713
3010.0000 -46.84239 -45.55743 1.28496 1.82112 -45.58184 515.84437
3015.0000 -45.77066 -44.20077 1.56990 1.88943 -45.07853 648.78144
3020.0000 -45.92715 -44.46143 1.46572 1.95471 -44.59760 649.81211
3025.0000 -46.40347 -44.71995 1.68351 1.94649 -44.65811 649.49405
3030.0000 -47.00452 -45.48509 1.51943 1.89752 -45.01898 639.66234
3035.0000 -46.79012 -45.57792 1.21220 1.80146 -45.72670 497.01010
3040.0000 -46.65581 -45.47368 1.18213 1.80777 -45.68027 496.82717
3045.0000 -46.85544 -45.44427 1.41117 1.84976 -45.37082 554.46060
3050.0000 -47.23353 -45.31042 1.92311 1.84926 -45.37452 568.05175
3055.0000 -46.54500 -45.37889 1.16612 1.87817 -45.16153 640.98028
3060.0000 -47.19842 -45.38480 1.81362 1.86947 -45.22561 582.19406
3065.0000 -46.64647 -45.22772 1.41876 1.86315 -45.27221 572.34664
3070.0000 -47.00205 -44.88726 2.11479 1.85698 -45.31765 580.15863
3075.0000 -46.74977 -45.18971 1.56007 1.87107 -45.21382 616.64262
3080.0000 -46.92494 -45.04024 1.88470 1.89217 -45.05838 602.68533
3085.0000 -46.76311 -45.07777 1.68534 1.89318 -45.05095 620.16960
3090.0000 -46.76716 -45.06992 1.69724 1.92927 -44.78505 622.36726
3095.0000 -46.95053 -45.12341 1.82712 1.92520 -44.81498 603.67708
3100.0000 -46.69968 -44.91787 1.78181 1.92563 -44.81184 641.76036
3105.0000 -46.78234 -45.52080 1.26154 1.90200 -44.98598 632.09026
3110.0000 -46.93284 -45.58902 1.34382 1.85743 -45.31435 607.60881
3115.0000 -47.24507 -46.16131 1.08376 1.83194 -45.50213 566.47504
3120.0000 -47.22053 -45.91265 1.30788 1.79274 -45.79099 486.58191
3125.0000 -47.11692 -45.73729 1.37963 1.82745 -45.53522 561.38778
3130.0000 -47.15504 -45.29581 1.85923 1.83101 -45.50900 542.21394
3135.0000 -46.64860 -45.32788 1.32072 1.83245 -45.49839 559.76170
3140.0000 -46.73559 -45.27552 1.46007 1.85264 -45.34962 543.56847
3145.0000 -46.20520 -44.79996 1.40525 1.87902 -45.15523 609.69959
3150.0000 -46.97661 -45.54677 1.42984 1.86105 -45.28767 582.86494
3155.0000 -46.94029 -45.52291 1.41738 1.83484 -45.48080 537.99475
3160.0000 -46.45871 -45.25753 1.20118 1.81316 -45.64055 492.01462
3165.0000 -46.05659 -44.14096 1.91563 1.93644 -44.73216 659.37025
3170.0000 -46.23398 -44.62450 1.60948 1.97279 -44.46433 635.75226
3175.0000 -45.32893 -43.50947 1.81947 2.03691 -43.99193 706.09152
3180.0000 -46.48407 -44.65573 1.82834 1.99527 -44.29870 676.17300
3185.0000 -46.27128 -44.85770 1.41359 1.92295 -44.83157 610.17585
3190.0000 -46.08772 -44.44485 1.64287 1.93841 -44.71768 620.67603
3195.0000 -46.20734 -44.58558 1.62176 1.97219 -44.46879 612.59980
3200.0000 -45.95989 -44.53371 1.42618 1.95934 -44.56344 641.53093
3205.0000 -46.37807 -44.62320 1.75487 1.96851 -44.49591 663.25573
3210.0000 -46.68160 -44.32116 2.36044 1.98517 -44.37316 730.25868
3215.0000 -46.67516 -44.58461 2.09055 1.93657 -44.73122 660.07436
3220.0000 -47.12382 -45.44617 1.67765 1.92827 -44.79237 655.99366
3225.0000 -46.91568 -44.98650 1.92917 1.88106 -45.14026 612.28699
3230.0000 -46.31895 -44.72333 1.59561 1.97079 -44.47909 681.29700
3235.0000 -46.71836 -45.39425 1.32411 1.89141 -45.06398 594.41113
3240.0000 -46.63299 -44.69200 1.94099 1.87588 -45.17840 613.04379
3245.0000 -46.92742 -45.12566 1.80175 1.91634 -44.88029 649.62267
3250.0000 -46.41927 -45.17930 1.23997 1.88183 -45.13452 586.96737
MELTING PROCESS: loop number 14 T-loop= 641.00000000000000
main_MD> interactions number 14 at Temperature= 641.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.47926 -0.33702 3.50934
force_rgl> df(natom) 2.89872 -1.54758 -2.01917
3255.0000 -46.67432 -44.84617 1.82815 1.90332 -44.97624 620.99685
3260.0000 -46.26222 -44.78496 1.47726 1.89841 -45.01240 615.94652
3265.0000 -46.24551 -45.12710 1.11840 1.86962 -45.22452 562.55518
3270.0000 -45.75205 -44.13891 1.61314 1.93878 -44.71492 654.83818
3275.0000 -46.27508 -44.36682 1.90826 1.99331 -44.31314 751.64629
3280.0000 -45.82399 -44.27822 1.54577 2.02655 -44.06826 745.38525
3285.0000 -46.05099 -44.58160 1.46939 1.99191 -44.32351 660.18398
3290.0000 -46.21255 -44.80161 1.41094 1.92971 -44.78177 602.52356
3295.0000 -46.54336 -45.07992 1.46344 1.88647 -45.10035 536.79996
3300.0000 -46.46798 -44.87866 1.58932 1.89437 -45.04216 539.88282
3305.0000 -46.56295 -44.76450 1.79845 1.95626 -44.58613 688.13741
3310.0000 -46.48724 -45.43190 1.05534 1.87870 -45.15759 603.00667
3315.0000 -46.74434 -45.09590 1.64844 1.85666 -45.32002 559.72750
3320.0000 -46.79579 -45.07372 1.72207 1.86095 -45.28843 538.38068
3325.0000 -46.85061 -45.81525 1.03536 1.85538 -45.32946 555.10850
3330.0000 -46.11620 -44.56600 1.55021 1.84705 -45.39082 552.37322
3335.0000 -46.81765 -45.77626 1.04139 1.91647 -44.87933 652.09570
3340.0000 -46.12355 -44.62331 1.50024 1.88090 -45.14138 592.33169
3345.0000 -46.01872 -44.74434 1.27438 1.93536 -44.74017 609.19492
3350.0000 -46.14385 -44.87081 1.27304 1.91364 -44.90021 593.15142
3355.0000 -46.56455 -45.13338 1.43117 1.89446 -45.04151 560.17623
3360.0000 -46.50562 -44.50414 2.00148 1.94428 -44.67445 695.04392
3365.0000 -45.93229 -44.39753 1.53476 1.96267 -44.53891 654.20288
3370.0000 -46.15019 -45.00817 1.14202 1.93797 -44.72091 651.56770
3375.0000 -46.59691 -45.03398 1.56293 1.89027 -45.07240 597.56707
3380.0000 -46.57502 -44.85610 1.71892 1.94745 -44.65109 618.87903
3385.0000 -46.21117 -44.75879 1.45238 1.91966 -44.85581 607.39478
3390.0000 -46.80042 -45.81547 0.98495 1.87577 -45.17924 533.41447
3395.0000 -46.71199 -45.40932 1.30267 1.81527 -45.62500 523.88123
3400.0000 -46.71983 -45.48292 1.23691 1.81531 -45.62468 525.73671
3405.0000 -46.65942 -44.48724 2.17218 1.89448 -45.04134 657.10685
3410.0000 -46.88106 -45.23700 1.64406 1.91100 -44.91962 602.28068
3415.0000 -46.61769 -44.91179 1.70590 1.91360 -44.90046 611.80251
3420.0000 -46.40691 -44.93410 1.47281 1.92069 -44.84823 637.47610
3425.0000 -46.14477 -44.81163 1.33315 1.92568 -44.81149 631.74297
3430.0000 -46.31573 -44.91797 1.39776 1.97623 -44.43900 651.52337
3435.0000 -46.00264 -44.38995 1.61269 1.93275 -44.75938 582.74998
3440.0000 -46.06905 -44.29799 1.77106 1.96213 -44.54289 649.04467
3445.0000 -45.54239 -43.94893 1.59346 2.03510 -44.00525 702.45675
3450.0000 -45.61920 -43.79154 1.82766 2.02504 -44.07937 670.90012
3455.0000 -45.51045 -43.91584 1.59461 2.06268 -43.80205 798.97676
3460.0000 -45.97596 -44.41883 1.55713 2.03569 -44.00091 756.97328
3465.0000 -46.25530 -44.03312 2.22218 1.99470 -44.30295 671.46217
3470.0000 -45.98555 -43.89856 2.08699 2.08853 -43.61160 739.56709
3475.0000 -45.71052 -44.15417 1.55635 2.00359 -44.23744 717.07891
3480.0000 -45.82137 -44.29071 1.53066 2.00098 -44.25663 741.68193
3485.0000 -45.94208 -44.08453 1.85755 1.97698 -44.43351 676.68443
3490.0000 -46.05340 -43.96779 2.08562 2.03960 -43.97209 808.61698
3495.0000 -46.06398 -44.46119 1.60280 1.98091 -44.40456 646.71846
3500.0000 -45.83574 -44.12606 1.70968 2.01257 -44.17128 705.48774
MELTING PROCESS: loop number 15 T-loop= 666.00000000000000
main_MD> interactions number 15 at Temperature= 666.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.36063 -0.75273 1.38292
force_rgl> df(natom) -0.35892 -1.07280 -1.42444
3505.0000 -45.55629 -44.22993 1.32636 1.96932 -44.48994 652.01312
3510.0000 -46.22513 -45.10267 1.12246 1.91764 -44.87067 590.65053
3515.0000 -46.06033 -44.41278 1.64755 1.92430 -44.82163 593.82030
3520.0000 -45.72935 -44.12774 1.60162 1.96922 -44.49065 688.37054
3525.0000 -46.58169 -44.58501 1.99669 1.97717 -44.43212 663.90875
3530.0000 -46.89935 -45.01097 1.88838 1.93151 -44.76851 621.86885
3535.0000 -46.40047 -44.44306 1.95741 1.91703 -44.87520 683.53318
3540.0000 -46.25030 -43.79161 2.45870 2.05324 -43.87159 759.19937
3545.0000 -46.24416 -44.31889 1.92527 2.05457 -43.86178 799.01256
3550.0000 -46.44133 -44.26440 2.17693 1.96299 -44.53658 673.96167
3555.0000 -46.67403 -45.00677 1.66725 1.94234 -44.68872 708.19649
3560.0000 -46.34637 -44.32533 2.02104 1.92681 -44.80317 605.38376
3565.0000 -46.33455 -44.86052 1.47402 2.01082 -44.18419 750.13170
3570.0000 -46.43806 -44.91259 1.52547 1.91621 -44.88124 662.98358
3575.0000 -46.24394 -44.96252 1.28142 1.93142 -44.76918 677.62354
3580.0000 -46.64135 -45.32728 1.31407 1.91698 -44.87557 613.97616
3585.0000 -46.37120 -45.29455 1.07665 1.85263 -45.34972 590.48175
3590.0000 -47.10396 -45.64706 1.45691 1.84483 -45.40714 568.65748
3595.0000 -46.60945 -45.05507 1.55438 1.84199 -45.42808 565.61566
3600.0000 -46.56977 -44.81500 1.75477 1.92640 -44.80619 662.36897
3605.0000 -46.25331 -44.84858 1.40473 1.95342 -44.60709 683.94253
3610.0000 -46.42832 -44.30329 2.12503 1.96494 -44.52219 649.33397
3615.0000 -45.77971 -43.78659 1.99312 2.00668 -44.21466 703.72299
3620.0000 -46.02030 -44.51804 1.50226 2.01484 -44.15453 693.46716
3625.0000 -46.53792 -45.01955 1.51837 1.90729 -44.94697 611.98900
3630.0000 -45.70609 -44.24327 1.46282 1.95485 -44.59657 594.23125
3635.0000 -45.34145 -43.88699 1.45446 2.00831 -44.20263 677.69336
3640.0000 -46.72990 -44.97919 1.75070 1.97278 -44.46443 669.46168
3645.0000 -46.34233 -44.48641 1.85592 1.93454 -44.74618 650.53756
3650.0000 -46.52726 -44.69498 1.83228 1.92771 -44.79648 561.90272
3655.0000 -46.17032 -44.48938 1.68094 1.93290 -44.75826 538.72962
3660.0000 -46.42549 -45.12927 1.29622 1.95789 -44.57415 625.32494
3665.0000 -46.21789 -44.54590 1.67199 1.92445 -44.82052 588.70024
3670.0000 -46.66280 -44.83544 1.82737 1.94960 -44.63522 628.10462
3675.0000 -46.18937 -44.45944 1.72994 1.91448 -44.89401 595.55060
3680.0000 -46.53776 -44.45733 2.08043 1.96143 -44.54804 701.59725
3685.0000 -45.59199 -43.77759 1.81440 2.00468 -44.22936 654.86653
3690.0000 -47.02266 -45.55862 1.46404 1.93440 -44.74722 656.82191
3695.0000 -46.45779 -44.95322 1.50457 1.89367 -45.04732 640.16765
3700.0000 -47.05104 -45.46733 1.58371 1.86982 -45.22307 580.67993
3705.0000 -46.99039 -45.06186 1.92853 1.92022 -44.85173 648.34760
3710.0000 -46.61546 -45.23365 1.38180 1.84906 -45.37603 559.57019
3715.0000 -46.25133 -44.27397 1.97736 1.95746 -44.57732 689.16085
3720.0000 -46.52916 -44.69853 1.83063 1.99364 -44.31073 666.52691
3725.0000 -46.01584 -44.62128 1.39456 1.92826 -44.79243 611.76509
3730.0000 -46.48359 -44.52128 1.96230 1.96677 -44.50872 649.67207
3735.0000 -46.05791 -44.02646 2.03145 2.01963 -44.11924 758.10454
3740.0000 -46.65554 -45.06856 1.58698 1.93553 -44.73893 675.14017
3745.0000 -46.72426 -45.02700 1.69726 1.90436 -44.96854 629.12016
3750.0000 -46.60354 -44.56067 2.04287 1.87571 -45.17963 603.28894
MELTING PROCESS: loop number 16 T-loop= 691.00000000000000
main_MD> interactions number 16 at Temperature= 691.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.76798 -0.65777 0.77244
force_rgl> df(natom) 3.49184 -0.56637 -6.63385
3755.0000 -46.46228 -44.40877 2.05352 1.98616 -44.36583 699.74563
3760.0000 -45.31733 -43.44474 1.87259 2.01498 -44.15349 701.57807
3765.0000 -46.10227 -43.80526 2.29701 2.06624 -43.77578 774.83733
3770.0000 -45.84087 -44.28720 1.55367 2.01141 -44.17981 688.19262
3775.0000 -46.13425 -44.64299 1.49126 1.97159 -44.47321 655.62181
3780.0000 -46.28115 -44.78963 1.49152 1.96601 -44.51434 633.22893
3785.0000 -46.51332 -44.77131 1.74201 1.92814 -44.79332 605.18688
3790.0000 -46.34932 -44.20625 2.14307 1.95453 -44.59891 584.42017
3795.0000 -45.42717 -43.30687 2.12030 2.08036 -43.67181 769.67562
3800.0000 -45.71868 -43.66035 2.05833 2.07249 -43.72973 794.52503
3805.0000 -46.20025 -43.82185 2.37839 2.09994 -43.52751 797.26721
3810.0000 -45.17895 -43.89891 1.28004 2.04923 -43.90117 754.33627
3815.0000 -45.41397 -43.34095 2.07302 2.02447 -44.08354 657.00140
3820.0000 -45.62096 -43.75238 1.86858 2.05631 -43.84896 725.15581
3825.0000 -45.72115 -43.72334 1.99781 2.08186 -43.66069 790.13053
3830.0000 -46.16438 -44.14578 2.01860 2.06483 -43.78619 762.25957
3835.0000 -46.07548 -44.13573 1.93975 2.03830 -43.98169 780.99086
3840.0000 -46.40864 -44.48195 1.92669 1.97564 -44.44337 692.18084
3845.0000 -46.41898 -44.78658 1.63240 1.95396 -44.60308 686.99318
3850.0000 -46.47364 -44.55404 1.91960 1.99807 -44.27809 727.81496
3855.0000 -46.71539 -45.19341 1.52198 1.88883 -45.08295 614.84445
3860.0000 -45.66332 -44.09611 1.56721 1.96676 -44.50878 653.52753
3865.0000 -46.17619 -44.11610 2.06008 2.04912 -43.90198 745.09684
3870.0000 -46.48194 -44.57275 1.90920 1.97867 -44.42105 683.88417
3875.0000 -45.41594 -43.77991 1.63602 1.95310 -44.60942 627.25285
3880.0000 -45.62638 -44.27907 1.34731 1.98174 -44.39842 720.19936
3885.0000 -46.41539 -45.17599 1.23939 1.91186 -44.91329 584.60353
3890.0000 -46.35853 -44.75068 1.60785 1.90340 -44.97566 542.58372
3895.0000 -46.72628 -45.23047 1.49581 1.92366 -44.82632 577.43617
3900.0000 -46.21812 -44.67214 1.54597 1.92333 -44.82881 625.32624
3905.0000 -46.65810 -44.81456 1.84354 1.89138 -45.06419 613.42281
3910.0000 -46.68447 -45.09560 1.58886 1.90244 -44.98267 557.76908
3915.0000 -46.47221 -44.89132 1.58089 1.95048 -44.62876 588.91506
3920.0000 -46.72121 -44.78460 1.93661 1.92058 -44.84904 588.79326
3925.0000 -46.36704 -44.66466 1.70238 1.94878 -44.64129 639.40422
3930.0000 -46.67287 -45.29681 1.37606 1.92651 -44.80537 647.90571
3935.0000 -46.67449 -45.38026 1.29423 1.84861 -45.37934 543.92563
3940.0000 -46.43044 -44.27991 2.15053 1.87911 -45.15461 600.66909
3945.0000 -46.50079 -44.79872 1.70207 1.99396 -44.30837 698.28812
3950.0000 -46.50960 -45.29593 1.21366 1.95214 -44.61650 687.13658
3955.0000 -46.54697 -44.69075 1.85622 1.86717 -45.24257 609.29246
3960.0000 -47.17218 -45.51028 1.66190 1.89889 -45.00883 603.50039
3965.0000 -46.90447 -45.33460 1.56987 1.85162 -45.35718 569.46025
3970.0000 -46.72631 -44.89506 1.83125 1.88029 -45.14589 608.07043
3975.0000 -46.79058 -45.00598 1.78460 1.91058 -44.92270 631.44631
3980.0000 -46.97349 -44.92923 2.04426 1.89881 -45.00944 588.26881
3985.0000 -46.57174 -44.84676 1.72497 1.93302 -44.75737 649.93721
3990.0000 -46.14569 -44.71718 1.42851 1.94428 -44.67441 673.24164
3995.0000 -46.26306 -44.40827 1.85479 1.93151 -44.76854 666.46210
4000.0000 -46.20921 -44.48625 1.72296 1.94666 -44.65691 678.17291
MELTING PROCESS: loop number 17 T-loop= 716.00000000000000
main_MD> interactions number 17 at Temperature= 716.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.89796 -2.45884 -0.98298
force_rgl> df(natom) -1.87815 0.77040 3.80328
4005.0000 -46.45687 -44.23827 2.21860 2.01196 -44.17577 693.16616
4010.0000 -46.25417 -44.56688 1.68730 1.94338 -44.68108 597.41654
4015.0000 -46.24892 -44.04674 2.20218 1.96216 -44.54269 671.30324
4020.0000 -45.82773 -43.94202 1.88570 2.07416 -43.71746 803.02372
4025.0000 -46.56843 -45.01912 1.54931 1.97266 -44.46535 702.00192
4030.0000 -46.16859 -44.25389 1.91470 1.97761 -44.42881 663.61368
4035.0000 -46.94362 -44.65268 2.29095 1.98244 -44.39323 658.44196
4040.0000 -46.88489 -45.11576 1.76913 1.91873 -44.86264 602.83654
4045.0000 -45.77453 -43.98938 1.78516 1.96258 -44.53962 650.52417
4050.0000 -46.35117 -44.75987 1.59130 2.00681 -44.21366 668.39140
4055.0000 -46.36400 -44.34990 2.01410 1.96369 -44.53140 669.98623
4060.0000 -45.85626 -43.91783 1.93843 2.04438 -43.93690 741.28448
4065.0000 -45.75633 -43.98358 1.77275 2.03480 -44.00747 716.59386
4070.0000 -45.84633 -43.99855 1.84778 2.02450 -44.08333 698.73506
4075.0000 -44.35574 -42.23351 2.12223 2.12376 -43.35201 767.80446
4080.0000 -46.20181 -43.29020 2.91162 2.20100 -42.78292 882.44756
4085.0000 -45.81958 -43.89157 1.92801 2.04475 -43.93419 723.24316
4090.0000 -46.24931 -44.62299 1.62632 1.98813 -44.35130 711.20333
4095.0000 -46.18885 -44.49779 1.69106 2.04260 -43.94997 791.43644
4100.0000 -45.86140 -44.05180 1.80960 1.96432 -44.52677 642.07620
4105.0000 -45.29979 -43.21949 2.08030 2.08839 -43.61263 774.49888
4110.0000 -44.70115 -42.79060 1.91055 2.13062 -43.30145 810.93103
4115.0000 -45.62377 -43.50713 2.11664 2.14283 -43.21149 825.16244
4120.0000 -45.85604 -43.76612 2.08992 2.07783 -43.69040 771.65500
4125.0000 -45.69848 -44.15572 1.54275 2.03472 -44.00805 715.13665
4130.0000 -45.89193 -44.15786 1.73407 2.02113 -44.10816 705.23387
4135.0000 -45.46639 -43.54574 1.92065 2.08070 -43.66928 770.15539
4140.0000 -45.31717 -43.68738 1.62979 2.09887 -43.53538 815.17814
4145.0000 -45.21289 -43.91359 1.29931 2.06056 -43.81764 734.68980
4150.0000 -46.41114 -44.67329 1.73785 2.01980 -44.11801 684.54426
4155.0000 -46.49793 -44.18059 2.31734 1.95145 -44.62160 662.04101
4160.0000 -46.64890 -45.02994 1.61896 1.97802 -44.42583 694.19680
4165.0000 -46.98873 -45.54100 1.44773 1.88732 -45.09407 611.88466
4170.0000 -46.31049 -44.37526 1.93523 1.89150 -45.06331 603.67607
4175.0000 -46.23866 -44.00170 2.23696 1.98921 -44.34335 757.23622
4180.0000 -46.10957 -44.40971 1.69987 1.99661 -44.28882 695.43251
4185.0000 -45.92266 -43.73614 2.18652 2.01207 -44.17492 763.08656
4190.0000 -46.05776 -43.86919 2.18857 2.03992 -43.96972 747.68967
4195.0000 -44.75983 -42.25094 2.50889 2.11496 -43.41687 792.78580
4200.0000 -45.36566 -43.26678 2.09888 2.22352 -42.61696 885.32860
4205.0000 -45.96342 -44.32805 1.63537 2.04639 -43.92206 714.55495
4210.0000 -46.29635 -45.38871 0.90764 1.97368 -44.45780 668.21001
4215.0000 -46.62885 -45.33029 1.29855 1.87973 -45.15004 570.04602
4220.0000 -46.74320 -44.84210 1.90110 1.94698 -44.65453 656.10006
4225.0000 -46.64299 -44.56867 2.07433 1.91845 -44.86476 643.54548
4230.0000 -45.45699 -43.97472 1.48227 2.03703 -43.99100 769.35923
4235.0000 -46.25828 -44.92808 1.33020 1.96598 -44.51456 638.55431
4240.0000 -46.25625 -44.61751 1.63873 1.94090 -44.69935 639.53058
4245.0000 -45.68460 -44.33463 1.34997 1.96079 -44.55278 668.39599
4250.0000 -45.86809 -44.05203 1.81606 2.01997 -44.11675 724.53328
MELTING PROCESS: loop number 18 T-loop= 741.00000000000000
main_MD> interactions number 18 at Temperature= 741.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.62847 1.84310 -4.14252
force_rgl> df(natom) -2.95784 -0.18759 -2.60589
4255.0000 -46.33843 -44.37824 1.96019 2.01817 -44.12997 753.72467
4260.0000 -45.56873 -43.46294 2.10578 2.09649 -43.55293 844.17355
4265.0000 -46.27815 -43.96789 2.31026 2.08855 -43.61142 836.49323
4270.0000 -45.51375 -43.63308 1.88067 2.06283 -43.80096 769.85974
4275.0000 -45.72996 -43.63545 2.09451 2.09123 -43.59167 812.37160
4280.0000 -46.22616 -44.27052 1.95564 2.08216 -43.65851 788.45523
4285.0000 -45.65520 -43.97101 1.68418 2.05440 -43.86308 715.74447
4290.0000 -45.91886 -44.29294 1.62593 2.06477 -43.78662 725.64932
4295.0000 -45.61035 -43.92225 1.68809 2.01261 -44.17095 693.46528
4300.0000 -46.19140 -44.24666 1.94474 2.02428 -44.08501 696.74326
4305.0000 -45.49180 -43.85001 1.64180 1.98819 -44.35086 682.46010
4310.0000 -45.81791 -43.95457 1.86334 1.98046 -44.40783 706.36813
4315.0000 -46.94368 -44.55764 2.38604 1.98283 -44.39042 703.51811
4320.0000 -46.26600 -44.50571 1.76029 1.98648 -44.36351 711.60483
4325.0000 -45.75168 -43.58897 2.16271 2.05996 -43.82209 779.91621
4330.0000 -46.07117 -44.03364 2.03753 2.04061 -43.96468 688.39247
4335.0000 -45.15654 -42.67107 2.48546 2.11572 -43.41128 787.13861
4340.0000 -45.18761 -42.66006 2.52755 2.18909 -42.87065 932.18642
4345.0000 -45.67197 -43.87290 1.79907 2.16997 -43.01155 945.23283
4350.0000 -45.68597 -43.72871 1.95726 2.06849 -43.75927 765.50154
4355.0000 -46.46418 -44.62359 1.84059 2.03150 -44.03179 790.29446
4360.0000 -46.62355 -44.92305 1.70049 1.89496 -45.03783 579.81349
4365.0000 -46.69401 -45.29577 1.39824 1.84094 -45.43584 543.04261
4370.0000 -46.30069 -44.47522 1.82547 1.92122 -44.84434 645.30130
4375.0000 -46.36577 -44.90100 1.46477 1.90255 -44.98187 629.95740
4380.0000 -46.92642 -45.11831 1.80810 1.94807 -44.64646 686.49222
4385.0000 -46.16622 -44.10856 2.05766 1.95999 -44.55869 682.74506
4390.0000 -46.24968 -44.04201 2.20768 2.02423 -44.08537 745.88491
4395.0000 -45.47875 -43.26993 2.20882 2.06132 -43.81209 770.03054
4400.0000 -45.34209 -43.41778 1.92431 2.08243 -43.65650 780.62556
4405.0000 -45.74077 -44.20904 1.53173 2.04987 -43.89643 771.51044
4410.0000 -45.08312 -43.21097 1.87215 2.03779 -43.98540 700.92052
4415.0000 -44.61522 -42.55708 2.05814 2.22082 -42.63688 925.95786
4420.0000 -45.24145 -43.32457 1.91687 2.20128 -42.78080 897.26252
4425.0000 -45.36495 -43.60083 1.76412 2.06734 -43.76771 709.68756
4430.0000 -45.58845 -43.30210 2.28635 2.12021 -43.37817 787.37989
4435.0000 -45.94272 -43.81102 2.13169 2.02844 -44.05435 735.90578
4440.0000 -45.96783 -44.61291 1.35492 1.98368 -44.38415 666.37742
4445.0000 -45.88775 -43.79955 2.08820 1.97680 -44.43484 655.11131
4450.0000 -46.68990 -44.57978 2.11011 2.02459 -44.08266 725.36629
4455.0000 -46.98270 -45.19472 1.78798 1.91502 -44.89003 613.38354
4460.0000 -46.18469 -44.62064 1.56405 1.98193 -44.39699 751.48949
4465.0000 -46.30242 -44.63928 1.66314 1.92610 -44.80840 625.22770
4470.0000 -46.16424 -44.28190 1.88233 1.94145 -44.69529 667.19223
4475.0000 -46.48161 -44.32518 2.15643 1.96841 -44.49663 701.62763
4480.0000 -46.03003 -43.80449 2.22554 2.05810 -43.83582 846.02146
4485.0000 -46.42076 -44.66275 1.75801 2.01343 -44.16491 756.89967
4490.0000 -45.88664 -43.89159 1.99505 2.01863 -44.12659 721.87088
4495.0000 -45.80878 -44.02469 1.78409 2.02739 -44.06209 742.01709
4500.0000 -46.17115 -43.78082 2.39033 2.03011 -44.04201 724.32077
MELTING PROCESS: loop number 19 T-loop= 766.00000000000000
main_MD> interactions number 19 at Temperature= 766.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.80467 3.41961 0.33007
force_rgl> df(natom) -1.00320 1.10628 1.82141
4505.0000 -45.22937 -42.81971 2.40966 2.11456 -43.41980 817.72333
4510.0000 -46.17909 -44.22579 1.95330 2.10389 -43.49843 879.84319
4515.0000 -45.16334 -43.50799 1.65535 2.02604 -44.07199 705.17844
4520.0000 -46.40338 -44.15442 2.24896 2.04798 -43.91035 760.12969
4525.0000 -46.11584 -44.79663 1.31921 1.97354 -44.45883 700.31174
4530.0000 -46.27473 -43.81443 2.46030 1.92944 -44.78379 604.22338
4535.0000 -46.30174 -44.10311 2.19863 2.02953 -44.04632 775.55593
4540.0000 -46.32420 -44.81253 1.51168 1.94163 -44.69397 703.50737
4545.0000 -45.08415 -43.49048 1.59367 2.00158 -44.25220 727.62638
4550.0000 -45.16011 -43.29089 1.86922 2.12734 -43.32562 798.19774
4555.0000 -45.33053 -43.09566 2.23487 2.12576 -43.33724 797.10582
4560.0000 -46.72707 -44.42173 2.30534 2.02567 -44.07471 767.12791
4565.0000 -46.04620 -44.49936 1.54684 1.98090 -44.40457 668.45688
4570.0000 -45.44782 -43.58710 1.86072 2.02929 -44.04804 734.76423
4575.0000 -45.52430 -43.25210 2.27220 2.10330 -43.50274 768.44661
4580.0000 -45.59893 -43.61244 1.98649 2.09810 -43.54106 796.76283
4585.0000 -46.06598 -44.35892 1.70707 2.07034 -43.74557 754.22727
4590.0000 -46.19207 -44.18684 2.00522 2.03805 -43.98354 713.79630
4595.0000 -44.84669 -43.30383 1.54286 2.06439 -43.78941 702.50702
4600.0000 -46.07862 -43.83255 2.24606 2.02439 -44.08419 725.61405
4605.0000 -44.98672 -43.21056 1.77616 2.07049 -43.74452 732.87186
4610.0000 -45.76625 -43.76108 2.00517 2.08653 -43.62635 737.57779
4615.0000 -45.42101 -43.52532 1.89569 2.10494 -43.49066 774.19065
4620.0000 -45.49505 -43.69310 1.80194 2.12492 -43.34343 802.06133
4625.0000 -46.03235 -44.01720 2.01516 2.00338 -44.23895 682.43730
4630.0000 -45.94052 -44.16515 1.77537 2.04066 -43.96427 703.72727
4635.0000 -45.99757 -44.49532 1.50225 1.98763 -44.35502 718.30321
4640.0000 -45.63451 -43.35894 2.27557 2.04336 -43.94438 798.67716
4645.0000 -46.56800 -44.84857 1.71943 1.98622 -44.36540 708.29257
4650.0000 -46.15372 -44.67094 1.48278 1.95470 -44.59762 691.25510
4655.0000 -46.12358 -44.40993 1.71365 1.94405 -44.67613 678.01345
4660.0000 -45.94121 -43.80794 2.13327 2.03214 -44.02710 738.26782
4665.0000 -45.17711 -43.26773 1.90939 2.12459 -43.34591 858.12627
4670.0000 -45.39084 -42.42395 2.96688 2.16604 -43.04045 935.57707
4675.0000 -45.21181 -42.68196 2.52985 2.20037 -42.78757 938.71123
4680.0000 -45.03082 -43.26488 1.76593 2.12137 -43.36965 798.65429
4685.0000 -45.65089 -43.38981 2.26108 2.10408 -43.49703 784.72843
4690.0000 -45.61049 -43.50944 2.10105 2.12654 -43.33150 802.60208
4695.0000 -45.86982 -44.13001 1.73981 2.11863 -43.38977 801.82417
4700.0000 -46.46948 -44.36214 2.10735 2.04343 -43.94385 771.41260
4705.0000 -45.15314 -43.11707 2.03607 2.04320 -43.94556 778.73756
4710.0000 -46.42047 -44.64240 1.77807 2.02139 -44.10628 731.96403
4715.0000 -45.33330 -43.18196 2.15134 2.02278 -44.09604 689.95927
4720.0000 -45.09937 -43.50892 1.59044 2.13111 -43.29782 845.03149
4725.0000 -45.19675 -43.88148 1.31526 2.05696 -43.84416 762.39778
4730.0000 -46.09760 -44.25367 1.84392 2.05067 -43.89054 778.72861
4735.0000 -45.52684 -43.73883 1.78801 2.03937 -43.97378 678.71686
4740.0000 -44.87563 -42.93136 1.94426 2.10037 -43.52435 780.69264
4745.0000 -45.18648 -43.24290 1.94358 2.19821 -42.80344 858.48493
4750.0000 -45.36449 -42.96673 2.39776 2.16953 -43.01479 874.70783
MELTING PROCESS: loop number 20 T-loop= 791.00000000000000
main_MD> interactions number 20 at Temperature= 791.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.95808 -0.89721 2.43555
force_rgl> df(natom) 0.99334 0.78780 -0.52724
4755.0000 -44.91134 -43.04057 1.87076 2.18536 -42.89814 886.67420
4760.0000 -46.17106 -44.18381 1.98725 2.03177 -44.02981 728.02255
4765.0000 -45.35857 -43.68176 1.67681 2.07489 -43.71206 761.84229
4770.0000 -46.26114 -44.25386 2.00728 2.02036 -44.11382 702.25245
4775.0000 -45.13331 -43.49162 1.64169 2.03184 -44.02928 718.55625
4780.0000 -45.53959 -43.23281 2.30678 2.12124 -43.37056 781.89310
4785.0000 -45.65266 -43.41711 2.23555 2.14056 -43.22823 859.69591
4790.0000 -45.30330 -43.33701 1.96629 2.10323 -43.50326 750.90950
4795.0000 -45.78521 -43.58589 2.19933 2.09649 -43.55295 825.22804
4800.0000 -44.83351 -42.73416 2.09936 2.16829 -43.02387 865.64974
4805.0000 -44.98286 -42.54140 2.44146 2.22260 -42.62374 916.08729
4810.0000 -44.92196 -42.97780 1.94416 2.21435 -42.68455 889.80337
4815.0000 -45.18505 -42.76349 2.42156 2.18575 -42.89524 881.50762
4820.0000 -45.37481 -43.07109 2.30372 2.13357 -43.27975 800.26674
4825.0000 -45.00116 -42.74182 2.25934 2.22604 -42.59837 1007.50252
4830.0000 -45.97445 -43.92604 2.04841 2.13726 -43.25257 847.89477
4835.0000 -45.47237 -43.52381 1.94855 2.05892 -43.82972 738.97947
4840.0000 -46.29937 -44.13263 2.16674 2.06048 -43.81826 775.38249
4845.0000 -45.24112 -43.56937 1.67174 2.09501 -43.56380 784.96500
4850.0000 -45.60620 -42.88456 2.72164 2.15024 -43.15687 881.73085
4855.0000 -45.69598 -43.52313 2.17285 2.15687 -43.10805 883.38798
4860.0000 -45.20595 -43.61655 1.58941 2.11314 -43.43023 787.76593
4865.0000 -45.61330 -43.00460 2.60870 2.10918 -43.45942 802.98879
4870.0000 -45.22446 -43.16762 2.05683 2.11829 -43.39228 861.25240
4875.0000 -45.90591 -43.76641 2.13951 2.10311 -43.50417 814.33704
4880.0000 -46.31346 -44.06709 2.24637 2.04278 -43.94864 770.35995
4885.0000 -45.35692 -43.53067 1.82625 2.08133 -43.66460 750.54399
4890.0000 -45.99657 -44.18642 1.81015 2.09218 -43.58469 746.93739
4895.0000 -45.33915 -43.54586 1.79329 2.05156 -43.88400 747.60612
4900.0000 -44.42578 -42.37833 2.04744 2.15479 -43.12336 851.23997
4905.0000 -44.87850 -42.25165 2.62685 2.30045 -42.05017 1004.02405
4910.0000 -45.21084 -43.37104 1.83979 2.19193 -42.84973 950.24440
4915.0000 -45.70010 -43.72717 1.97293 2.09184 -43.58718 781.77980
4920.0000 -45.94696 -43.62975 2.31721 2.05419 -43.86462 784.83968
4925.0000 -44.85619 -42.70713 2.14906 2.11989 -43.38055 794.59421
4930.0000 -45.43669 -43.05458 2.38210 2.20089 -42.78369 929.01481
4935.0000 -46.11802 -44.02210 2.09593 2.08273 -43.65434 813.50908
4940.0000 -45.76561 -44.08331 1.68230 2.02285 -44.09553 745.98838
4945.0000 -45.25506 -43.33715 1.91791 2.06091 -43.81509 772.83102
4950.0000 -46.56172 -44.30889 2.25284 2.03485 -44.00710 792.22211
4955.0000 -45.99261 -43.52112 2.47150 2.01027 -44.18819 764.58816
4960.0000 -46.17819 -43.90770 2.27049 2.03646 -43.99523 750.88742
4965.0000 -45.87963 -44.05561 1.82401 2.03366 -44.01590 755.95601
4970.0000 -46.08081 -44.21546 1.86535 2.03886 -43.97755 798.78305
4975.0000 -46.44831 -44.24804 2.20027 2.00312 -44.24085 746.41337
4980.0000 -46.19736 -44.60403 1.59333 1.94265 -44.68645 674.94095
4985.0000 -45.73544 -43.90460 1.83084 2.01071 -44.18493 703.59451
4990.0000 -45.72362 -43.99225 1.73137 2.05002 -43.89535 716.80141
4995.0000 -46.15660 -44.80785 1.34875 1.96661 -44.50988 685.30396
5000.0000 -45.50208 -43.68629 1.81579 2.00720 -44.21079 746.85163
MELTING PROCESS: loop number 21 T-loop= 816.00000000000000
main_MD> interactions number 21 at Temperature= 816.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.41640 6.60806 3.33411
force_rgl> df(natom) -1.41386 -0.23914 -0.31144
5005.0000 -45.89137 -44.19708 1.69429 2.07904 -43.68153 817.08616
5010.0000 -45.61822 -43.79972 1.81851 2.05011 -43.89467 809.98926
5015.0000 -45.84598 -43.09275 2.75323 2.17172 -42.99864 899.01590
5020.0000 -45.72091 -43.77537 1.94555 2.09673 -43.55116 795.80277
5025.0000 -46.51936 -44.36667 2.15269 1.99374 -44.30997 684.35442
5030.0000 -46.10112 -43.82636 2.27476 2.03700 -43.99127 762.61952
5035.0000 -45.06319 -43.12686 1.93632 2.16803 -43.02578 863.10655
5040.0000 -45.59459 -43.32124 2.27335 2.15018 -43.15731 836.81093
5045.0000 -45.21984 -42.74032 2.47953 2.19780 -42.80648 888.43228
5050.0000 -46.01970 -43.92414 2.09556 2.11517 -43.41532 865.73136
5055.0000 -45.81982 -43.84038 1.97944 2.08869 -43.61040 790.38075
5060.0000 -45.83602 -44.25535 1.58067 2.08243 -43.65649 809.99250
5065.0000 -45.93815 -43.37523 2.56292 2.04466 -43.93482 807.53181
5070.0000 -45.78746 -43.98656 1.80090 2.11174 -43.44055 822.37246
5075.0000 -45.89011 -43.51446 2.37565 2.01548 -44.14979 693.92438
5080.0000 -45.31656 -43.32428 1.99228 2.16574 -43.04269 836.99521
5085.0000 -46.03993 -43.87386 2.16607 2.08991 -43.60139 797.23134
5090.0000 -45.12176 -43.40802 1.71374 2.08525 -43.63575 788.96522
5095.0000 -45.80301 -44.58031 1.22270 2.02568 -44.07469 656.82169
5100.0000 -45.13222 -43.54656 1.58566 2.02322 -44.09275 729.93217
5105.0000 -45.31841 -44.00550 1.31290 2.13128 -43.29657 829.07901
5110.0000 -45.12122 -43.31178 1.80944 2.15073 -43.15330 825.49349
5115.0000 -44.49961 -42.20871 2.29090 2.16259 -43.06587 875.04201
5120.0000 -45.39155 -43.31603 2.07552 2.23522 -42.53073 886.64442
5125.0000 -45.58617 -43.21495 2.37122 2.12526 -43.34093 880.80997
5130.0000 -44.48153 -42.31721 2.16432 2.21847 -42.65421 921.57938
5135.0000 -44.21274 -42.29808 1.91466 2.28587 -42.15755 975.64127
5140.0000 -45.34887 -43.07477 2.27411 2.17297 -42.98942 961.83041
5145.0000 -46.16234 -43.01223 3.15011 2.14968 -43.16102 889.27831
5150.0000 -46.17505 -44.26423 1.91082 2.11800 -43.39446 847.83013
5155.0000 -45.61999 -43.94698 1.67301 2.05281 -43.87479 740.88867
5160.0000 -46.23982 -44.32018 1.91964 2.01715 -44.13753 736.96745
5165.0000 -45.53676 -44.04562 1.49114 2.01396 -44.16100 698.85823
5170.0000 -45.47684 -43.36623 2.11061 2.04244 -43.95118 713.54263
5175.0000 -45.35960 -42.44067 2.91893 2.23213 -42.55354 1043.70380
5180.0000 -44.95268 -42.52400 2.42868 2.19655 -42.81566 890.88874
5185.0000 -45.44911 -43.31803 2.13107 2.18334 -42.91304 858.84398
5190.0000 -45.37475 -44.06713 1.30762 2.14114 -43.22396 855.20813
5195.0000 -46.20452 -43.44907 2.75544 1.99660 -44.28892 712.69783
5200.0000 -45.14836 -43.16273 1.98563 2.15026 -43.15672 855.07679
5205.0000 -45.35002 -42.64960 2.70042 2.17839 -42.94948 886.32499
5210.0000 -45.43853 -43.82913 1.60940 2.10156 -43.51560 817.54065
5215.0000 -46.03674 -43.91748 2.11926 2.06592 -43.77819 757.63570
5220.0000 -45.91573 -43.99480 1.92093 2.04577 -43.92662 750.07058
5225.0000 -46.33261 -43.66338 2.66923 2.06570 -43.77980 792.71233
5230.0000 -46.14897 -43.90125 2.24772 2.07591 -43.70459 850.28393
5235.0000 -44.85208 -41.89821 2.95387 2.17538 -42.97166 885.33095
5240.0000 -45.37778 -43.01231 2.36547 2.22348 -42.61725 904.82736
5245.0000 -45.77914 -43.83017 1.94897 2.10379 -43.49912 819.24745
5250.0000 -44.76218 -42.45637 2.30581 2.13977 -43.23403 826.16321
MELTING PROCESS: loop number 22 T-loop= 841.00000000000000
main_MD> interactions number 22 at Temperature= 841.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.42449 0.34650 -0.50574
force_rgl> df(natom) 1.58800 -0.05157 4.05346
5255.0000 -44.59530 -41.69728 2.89802 2.34757 -41.70298 1042.82328
5260.0000 -44.98877 -42.69251 2.29626 2.29290 -42.10576 983.16512
5265.0000 -44.86537 -42.32209 2.54327 2.28360 -42.17429 959.23136
5270.0000 -45.22478 -43.00623 2.21855 2.24378 -42.46771 970.98122
5275.0000 -45.12030 -42.71227 2.40803 2.12233 -43.36253 798.61648
5280.0000 -45.34087 -42.93001 2.41086 2.20226 -42.77362 937.57195
5285.0000 -44.85528 -43.03729 1.81798 2.24397 -42.46632 980.65091
5290.0000 -44.76166 -42.81499 1.94668 2.15775 -43.10154 797.98271
5295.0000 -45.29602 -42.70127 2.59474 2.18694 -42.88647 914.36602
5300.0000 -44.57864 -42.55125 2.02739 2.17742 -42.95663 909.34292
5305.0000 -45.00547 -42.02238 2.98309 2.32101 -41.89867 1023.92713
5310.0000 -44.63743 -42.43284 2.20459 2.22980 -42.57073 942.69967
5315.0000 -44.83433 -43.15633 1.67800 2.21049 -42.71296 874.89489
5320.0000 -44.67155 -43.02555 1.64600 2.16467 -43.05060 840.11885
5325.0000 -45.65233 -43.50281 2.14953 2.14407 -43.20238 803.53355
5330.0000 -46.15520 -44.02292 2.13229 2.05945 -43.82587 742.18904
5335.0000 -44.98803 -43.27898 1.70906 2.08628 -43.62816 794.17504
5340.0000 -45.65079 -43.74379 1.90700 2.10843 -43.46496 826.50641
5345.0000 -45.65367 -43.65969 1.99398 2.12882 -43.31469 857.70465
5350.0000 -45.26117 -43.56191 1.69926 2.08481 -43.63900 773.20917
5355.0000 -45.87334 -43.94581 1.92754 2.10650 -43.47915 813.12192
5360.0000 -46.02811 -43.90167 2.12644 2.11788 -43.39532 856.60997
5365.0000 -46.23270 -44.37640 1.85630 2.02823 -44.05591 693.02618
5370.0000 -45.58885 -43.09514 2.49371 2.07368 -43.72103 770.49120
5375.0000 -46.02010 -44.23736 1.78274 2.09155 -43.58936 859.51498
5380.0000 -45.66646 -44.28937 1.37709 1.98169 -44.39877 732.82355
5385.0000 -45.20386 -43.14510 2.05876 2.08169 -43.66195 804.85048
5390.0000 -45.80115 -42.70628 3.09487 2.11120 -43.44453 843.87064
5395.0000 -45.10955 -43.08749 2.02206 2.23192 -42.55504 912.29082
5400.0000 -45.73234 -43.38373 2.34861 2.18150 -42.92653 879.07572
5405.0000 -45.93988 -43.31444 2.62544 2.06984 -43.74932 772.11186
5410.0000 -45.63934 -43.83296 1.80638 2.10268 -43.50730 860.58241
5415.0000 -46.14338 -44.31423 1.82915 2.05155 -43.88403 800.50441
5420.0000 -45.06263 -42.54293 2.51970 2.08438 -43.64214 768.52775
5425.0000 -45.11053 -42.97710 2.13343 2.21859 -42.65327 911.16320
5430.0000 -45.01097 -43.02854 1.98243 2.20633 -42.74365 844.91251
5435.0000 -45.39614 -42.91391 2.48223 2.16126 -43.07573 875.86799
5440.0000 -45.13164 -42.65548 2.47616 2.20286 -42.76918 937.61377
5445.0000 -45.27812 -42.88730 2.39082 2.22792 -42.58456 898.73064
5450.0000 -45.06890 -43.00998 2.05891 2.14820 -43.17196 909.15662
5455.0000 -44.78225 -42.30436 2.47788 2.19042 -42.86082 876.72379
5460.0000 -45.50187 -43.53644 1.96543 2.19426 -42.83257 881.00081
5465.0000 -45.16814 -42.96175 2.20639 2.13548 -43.26565 822.58113
5470.0000 -45.55253 -43.76096 1.79158 2.12533 -43.34047 844.39644
5475.0000 -45.72494 -43.22829 2.49665 2.07550 -43.70762 799.23907
5480.0000 -45.36414 -43.39357 1.97057 2.17853 -42.94843 872.77260
5485.0000 -45.88121 -43.00276 2.87845 2.13323 -43.28222 815.70754
5490.0000 -45.47011 -43.73623 1.73388 2.14428 -43.20082 799.87316
5495.0000 -45.95266 -44.07300 1.87966 2.08108 -43.66645 773.93717
5500.0000 -45.37822 -43.56918 1.80904 2.07192 -43.73395 800.36522
MELTING PROCESS: loop number 23 T-loop= 866.00000000000000
main_MD> interactions number 23 at Temperature= 866.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.96112 0.32978 -2.36119
force_rgl> df(natom) -0.41994 -0.80422 -2.07663
5505.0000 -45.16647 -43.47054 1.69594 2.07411 -43.71785 773.05429
5510.0000 -44.76460 -42.98492 1.77968 2.09884 -43.53565 756.38526
5515.0000 -45.46913 -43.26951 2.19962 2.14531 -43.19319 812.23173
5520.0000 -46.02704 -43.04030 2.98674 2.19739 -42.80949 992.80517
5525.0000 -44.60396 -42.85268 1.75128 2.23831 -42.50797 931.94224
5530.0000 -44.99906 -41.79255 3.20651 2.24957 -42.42502 920.99467
5535.0000 -45.19401 -42.91052 2.28349 2.25474 -42.38697 998.13302
5540.0000 -45.51431 -42.97376 2.54055 2.13941 -43.23669 806.34573
5545.0000 -43.99571 -41.87574 2.11997 2.28629 -42.15444 969.90601
5550.0000 -45.81492 -42.74197 3.07294 2.20066 -42.78540 856.95331
5555.0000 -45.15415 -42.88076 2.27339 2.19511 -42.82628 957.83518
5560.0000 -45.81204 -43.54791 2.26414 2.13001 -43.30599 783.07885
5565.0000 -46.05979 -43.77814 2.28165 2.05671 -43.84601 739.62507
5570.0000 -45.70032 -43.08505 2.61527 2.10027 -43.52506 799.31976
5575.0000 -45.21633 -43.30615 1.91018 2.17086 -43.00498 877.68657
5580.0000 -44.50823 -42.40977 2.09847 2.22364 -42.61609 971.13560
5585.0000 -45.89723 -43.81295 2.08428 2.19247 -42.84573 881.88534
5590.0000 -45.76547 -43.68368 2.08179 2.04067 -43.96418 754.76943
5595.0000 -44.61007 -42.67113 1.93894 2.12477 -43.34453 843.80371
5600.0000 -44.09981 -41.94602 2.15379 2.30059 -42.04910 997.71442
5605.0000 -45.20522 -41.83892 3.36630 2.28140 -42.19054 1006.96247
5610.0000 -44.38849 -42.81158 1.57691 2.28358 -42.17446 1018.22480
5615.0000 -44.06459 -42.00668 2.05790 2.23997 -42.49573 968.19884
5620.0000 -45.16762 -43.53872 1.62889 2.18533 -42.89836 879.79011
5625.0000 -45.88475 -44.01099 1.87375 2.05063 -43.89081 726.98373
5630.0000 -44.78507 -42.94563 1.83945 2.14103 -43.22472 854.99936
5635.0000 -45.55572 -43.26836 2.28736 2.12533 -43.34041 824.59308
5640.0000 -46.09089 -44.04174 2.04916 2.07629 -43.70176 787.37350
5645.0000 -45.31475 -42.54629 2.76846 2.12084 -43.37352 854.29187
5650.0000 -45.28035 -43.09771 2.18263 2.16564 -43.04340 884.45787
5655.0000 -46.26778 -44.58847 1.67931 2.04409 -43.93901 733.62699
5660.0000 -46.00162 -44.46701 1.53461 1.94724 -44.65260 654.74559
5665.0000 -45.40142 -43.77446 1.62696 2.04057 -43.96492 784.34153
5670.0000 -46.32484 -44.11393 2.21092 2.02216 -44.10061 746.82052
5675.0000 -46.49408 -44.65668 1.83740 1.95184 -44.61873 671.32463
5680.0000 -46.60226 -44.24264 2.35962 1.99522 -44.29909 759.07883
5685.0000 -45.64621 -43.51323 2.13298 2.09644 -43.55331 843.87969
5690.0000 -44.81710 -42.62231 2.19479 2.14251 -43.21386 879.91403
5695.0000 -45.09323 -42.41314 2.68009 2.25883 -42.35683 978.18430
5700.0000 -44.91560 -42.49886 2.41674 2.34556 -41.71775 1074.24461
5705.0000 -45.50680 -43.48541 2.02139 2.12507 -43.34233 851.16487
5710.0000 -46.12809 -43.95685 2.17124 2.11373 -43.42589 820.09453
5715.0000 -45.86232 -43.84191 2.02041 2.07395 -43.71904 790.63490
5720.0000 -46.41998 -44.19517 2.22481 2.06455 -43.78828 767.34674
5725.0000 -44.34382 -42.05778 2.28604 2.14900 -43.16602 881.25564
5730.0000 -45.38198 -42.68325 2.69873 2.23703 -42.51741 924.43278
5735.0000 -44.01855 -41.88722 2.13133 2.28842 -42.13879 981.42867
5740.0000 -45.19405 -43.54928 1.64477 2.22392 -42.61400 939.54162
5745.0000 -46.56136 -44.24897 2.31239 2.08436 -43.64229 834.55874
5750.0000 -45.95004 -43.48144 2.46860 2.04215 -43.95328 798.08732
MELTING PROCESS: loop number 24 T-loop= 891.00000000000000
main_MD> interactions number 24 at Temperature= 891.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.06533 2.54480 -1.45417
force_rgl> df(natom) -1.07013 1.84199 1.73473
5755.0000 -45.25643 -43.19900 2.05743 2.09166 -43.58851 813.05429
5760.0000 -45.14353 -42.02238 3.12114 2.21594 -42.67281 967.40802
5765.0000 -45.06498 -42.99092 2.07406 2.24386 -42.46713 983.70797
5770.0000 -44.65481 -42.40671 2.24810 2.15428 -43.12715 861.18847
5775.0000 -45.18464 -43.02283 2.16182 2.23816 -42.50907 943.38409
5780.0000 -45.13975 -42.82632 2.31343 2.11796 -43.39473 824.59582
5785.0000 -45.49422 -42.75807 2.73616 2.22101 -42.63546 880.32929
5790.0000 -45.34766 -41.99377 3.35389 2.29746 -42.07219 997.83633
5795.0000 -45.35295 -41.77789 3.57506 2.30390 -42.02470 1052.94492
5800.0000 -45.65473 -42.95545 2.69929 2.29158 -42.11550 1001.25340
5805.0000 -45.60956 -42.78436 2.82520 2.18219 -42.92152 967.80716
5810.0000 -44.25501 -41.93084 2.32417 2.24247 -42.47732 964.15313
5815.0000 -44.48745 -42.31362 2.17383 2.28701 -42.14919 980.75447
5820.0000 -46.14736 -42.80187 3.34549 2.27579 -42.23181 1020.34230
5825.0000 -44.29702 -42.15533 2.14169 2.26848 -42.28571 996.76346
5830.0000 -44.49449 -41.90896 2.58553 2.24784 -42.43777 923.75774
5835.0000 -45.72070 -43.73167 1.98903 2.21483 -42.68099 910.79508
5840.0000 -45.48277 -43.62634 1.85643 2.11218 -43.43733 790.68739
5845.0000 -45.50378 -43.13703 2.36676 2.14747 -43.17730 848.53834
5850.0000 -45.44463 -43.42287 2.02176 2.14659 -43.18379 832.40001
5855.0000 -45.63492 -43.27063 2.36428 2.14376 -43.20465 857.44418
5860.0000 -46.25276 -44.11498 2.13778 2.06598 -43.77771 828.40740
5865.0000 -45.92826 -43.70128 2.22698 2.09766 -43.54429 829.54688
5870.0000 -45.40277 -43.77536 1.62741 2.06877 -43.75717 808.59105
5875.0000 -45.33987 -43.57543 1.76443 2.09393 -43.57181 837.57065
5880.0000 -46.02318 -43.68267 2.34052 2.05237 -43.87798 789.49657
5885.0000 -45.09167 -42.71282 2.37886 2.24527 -42.45667 949.42009
5890.0000 -44.79791 -42.02621 2.77170 2.26712 -42.29574 950.77921
5895.0000 -44.52854 -42.30958 2.21895 2.34715 -41.70604 1043.45526
5900.0000 -45.18187 -42.78334 2.39853 2.26485 -42.31244 969.23865
5905.0000 -45.56846 -42.58030 2.98817 2.20132 -42.78054 916.47315
5910.0000 -45.18355 -42.46342 2.72013 2.26033 -42.34573 955.10597
5915.0000 -45.33473 -42.42022 2.91450 2.33354 -41.80637 1049.84205
5920.0000 -44.69773 -42.30492 2.39282 2.23848 -42.50671 897.95518
5925.0000 -44.85990 -42.52903 2.33087 2.25230 -42.40490 1028.23420
5930.0000 -45.42722 -42.97015 2.45706 2.23814 -42.50923 953.00910
5935.0000 -45.27511 -43.42325 1.85186 2.15099 -43.15134 869.07534
5940.0000 -44.85287 -42.41844 2.43443 2.15346 -43.13315 880.24534
5945.0000 -45.35495 -43.24781 2.10714 2.17511 -42.97364 977.26516
5950.0000 -45.29361 -42.65859 2.63502 2.15844 -43.09651 878.96939
5955.0000 -44.25520 -42.03509 2.22011 2.22006 -42.64249 882.07425
5960.0000 -45.23796 -42.52285 2.71511 2.24236 -42.47815 965.82479
5965.0000 -46.17164 -43.29689 2.87475 2.19982 -42.79159 973.54458
5970.0000 -45.61819 -42.69157 2.92663 2.14748 -43.17722 928.76958
5975.0000 -44.69367 -42.64136 2.05231 2.22676 -42.59311 941.16041
5980.0000 -45.71071 -43.19230 2.51841 2.16136 -43.07496 887.71184
5985.0000 -46.05275 -43.00071 3.05203 2.12969 -43.30833 843.12339
5990.0000 -45.28357 -42.34706 2.93651 2.22945 -42.57330 883.77202
5995.0000 -45.07949 -42.82622 2.25327 2.20451 -42.75703 882.14581
6000.0000 -43.96734 -41.28820 2.67914 2.31899 -41.91352 1046.57884
MELTING PROCESS: loop number 25 T-loop= 916.00000000000000
main_MD> interactions number 25 at Temperature= 916.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.20418 1.66330 -0.05789
force_rgl> df(natom) 2.34764 -1.64509 0.93715
6005.0000 -42.94170 -40.56994 2.37176 2.44170 -41.00939 1133.70602
6010.0000 -44.94545 -41.56433 3.38111 2.42720 -41.11625 1137.02575
6015.0000 -44.30129 -42.49080 1.81049 2.33230 -41.81550 1028.79920
6020.0000 -44.89920 -42.62886 2.27034 2.22167 -42.63061 947.74001
6025.0000 -46.21587 -43.38542 2.83045 2.12467 -43.34529 900.23211
6030.0000 -45.64109 -43.41825 2.22285 2.10859 -43.46378 845.20805
6035.0000 -45.30676 -43.23667 2.07009 2.15173 -43.14589 854.63084
6040.0000 -45.25389 -43.04307 2.21083 2.15085 -43.15243 812.93756
6045.0000 -45.27245 -42.99779 2.27466 2.17791 -42.95300 853.09223
6050.0000 -45.56378 -42.89224 2.67153 2.20630 -42.74385 909.23751
6055.0000 -45.59363 -43.44961 2.14402 2.10656 -43.47873 763.83423
6060.0000 -45.39949 -42.15983 3.23966 2.23931 -42.50065 1011.41707
6065.0000 -44.80291 -41.78352 3.01939 2.21667 -42.66745 958.51074
6070.0000 -45.13346 -43.04146 2.09200 2.24591 -42.45197 955.27880
6075.0000 -45.32917 -42.85561 2.47356 2.19838 -42.80217 920.25222
6080.0000 -45.13231 -43.29619 1.83612 2.12886 -43.31442 847.52374
6085.0000 -45.25017 -43.41746 1.83271 2.16402 -43.05536 884.80896
6090.0000 -45.99392 -42.91698 3.07694 2.13970 -43.23455 806.57865
6095.0000 -45.24914 -43.05753 2.19161 2.22208 -42.62755 907.44361
6100.0000 -45.98920 -43.78615 2.20305 2.08940 -43.60514 788.42675
6105.0000 -45.50039 -43.33850 2.16189 2.10989 -43.45423 870.67599
6110.0000 -45.51692 -42.98877 2.52815 2.22353 -42.61692 935.74563
6115.0000 -44.29991 -42.03659 2.26331 2.20134 -42.78040 930.38241
6120.0000 -45.16033 -42.88003 2.28030 2.27433 -42.24259 942.40560
6125.0000 -44.94595 -42.37686 2.56908 2.19900 -42.79766 948.65306
6130.0000 -45.33015 -43.39674 1.93341 2.17658 -42.96283 819.98523
6135.0000 -44.67409 -43.03631 1.63778 2.16024 -43.08325 843.79373
6140.0000 -45.73180 -44.28141 1.45039 2.04253 -43.95054 701.73357
6145.0000 -44.84781 -42.49413 2.35368 2.08967 -43.60317 787.39427
6150.0000 -44.76441 -41.82081 2.94360 2.25446 -42.38901 934.30457
6155.0000 -45.13479 -42.46314 2.67165 2.30955 -41.98308 1021.06169
6160.0000 -44.95804 -42.25751 2.70053 2.20030 -42.78808 909.94524
6165.0000 -45.81309 -43.27646 2.53663 2.11716 -43.40062 818.73996
6170.0000 -45.28511 -42.70661 2.57850 2.16476 -43.04989 835.80423
6175.0000 -45.05377 -42.06374 2.99003 2.27672 -42.22501 1059.85709
6180.0000 -45.28766 -42.87869 2.40897 2.22146 -42.63211 946.60630
6185.0000 -45.67376 -43.42784 2.24592 2.20344 -42.76495 943.84429
6190.0000 -44.83747 -42.27030 2.56717 2.18254 -42.91893 892.57523
6195.0000 -45.27049 -42.36649 2.90400 2.23343 -42.54392 947.72869
6200.0000 -44.79626 -42.38836 2.40790 2.21208 -42.70124 901.37793
6205.0000 -45.01219 -41.83154 3.18065 2.26421 -42.31713 977.29285
6210.0000 -43.84126 -41.83042 2.01084 2.29551 -42.08652 1042.90761
6215.0000 -44.67023 -42.08488 2.58535 2.41259 -41.22388 1049.88303
6220.0000 -45.01500 -42.47688 2.53812 2.27722 -42.22131 978.34655
6225.0000 -44.27932 -41.98119 2.29813 2.28062 -42.19625 992.93581
6230.0000 -44.71542 -42.73402 1.98140 2.27235 -42.25719 897.88836
6235.0000 -45.40755 -42.38617 3.02138 2.26508 -42.31074 1006.77898
6240.0000 -45.56885 -43.22437 2.34448 2.17360 -42.98478 869.84852
6245.0000 -44.63319 -41.95472 2.67846 2.20598 -42.74621 944.65479
6250.0000 -44.80935 -42.27411 2.53524 2.27930 -42.20598 959.47067
MELTING PROCESS: loop number 26 T-loop= 941.00000000000000
main_MD> interactions number 26 at Temperature= 941.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.40597 -1.60593 3.87785
force_rgl> df(natom) 1.52288 0.25467 -0.31802
6255.0000 -45.34853 -43.15369 2.19484 2.24104 -42.48789 901.51266
6260.0000 -44.96306 -42.73106 2.23200 2.16382 -43.05686 927.75673
6265.0000 -43.89602 -41.13530 2.76072 2.28901 -42.13442 1013.22462
6270.0000 -44.13762 -41.99882 2.13880 2.27660 -42.22587 989.90702
6275.0000 -44.38203 -41.95882 2.42321 2.28024 -42.19901 964.57992
6280.0000 -44.57272 -42.17831 2.39441 2.31561 -41.93845 1056.00776
6285.0000 -44.55325 -42.24995 2.30330 2.25324 -42.39801 966.56886
6290.0000 -44.92471 -42.22356 2.70114 2.22559 -42.60172 930.38508
6295.0000 -44.75313 -43.05957 1.69356 2.23404 -42.53944 962.17782
6300.0000 -45.58364 -43.63037 1.95328 2.14508 -43.19493 794.88970
6305.0000 -46.00039 -43.97604 2.02435 2.07244 -43.73017 797.22884
6310.0000 -44.55025 -42.13140 2.41885 2.15874 -43.09424 862.13081
6315.0000 -44.90759 -42.84017 2.06742 2.26179 -42.33499 976.66888
6320.0000 -45.54523 -43.54874 1.99649 2.06710 -43.76948 809.94528
6325.0000 -45.08373 -43.61038 1.47335 2.08620 -43.62875 814.76755
6330.0000 -45.23848 -43.36528 1.87321 2.06778 -43.76446 788.04011
6335.0000 -45.48846 -42.59774 2.89072 2.18356 -42.91140 933.96805
6340.0000 -45.21165 -42.75658 2.45507 2.31946 -41.91006 1028.13388
6345.0000 -44.83006 -42.62602 2.20404 2.24638 -42.44856 921.56002
6350.0000 -45.07540 -42.81971 2.25569 2.19083 -42.85781 902.49063
6355.0000 -45.40328 -43.49450 1.90878 2.11847 -43.39094 766.75558
6360.0000 -44.62470 -42.71531 1.90938 2.12896 -43.31369 885.74871
6365.0000 -45.10838 -41.55515 3.55323 2.27228 -42.25769 976.84288
6370.0000 -44.72746 -42.35986 2.36761 2.25052 -42.41804 909.84884
6375.0000 -45.12667 -41.86764 3.25903 2.30188 -42.03960 1014.04194
6380.0000 -44.15009 -41.91160 2.23849 2.30169 -42.04097 1024.18805
6385.0000 -44.54056 -41.91308 2.62748 2.27262 -42.25517 1022.28407
6390.0000 -45.43760 -42.42784 3.00977 2.25270 -42.40200 965.68068
6395.0000 -44.65473 -42.97461 1.68012 2.21713 -42.66402 914.53934
6400.0000 -44.84938 -42.69752 2.15187 2.20395 -42.76114 847.65808
6405.0000 -45.21266 -43.13560 2.07706 2.20989 -42.71738 862.37169
6410.0000 -45.29214 -43.25968 2.03245 2.14163 -43.22036 840.52396
6415.0000 -45.81521 -43.02764 2.78756 2.15829 -43.09758 841.85071
6420.0000 -45.36100 -43.21272 2.14828 2.16715 -43.03232 847.13545
6425.0000 -45.18621 -43.03225 2.15395 2.11834 -43.39194 814.04462
6430.0000 -45.51585 -43.55534 1.96051 2.16933 -43.01622 860.93370
6435.0000 -45.74737 -43.81694 1.93043 2.13758 -43.25014 855.46238
6440.0000 -44.51981 -41.90032 2.61949 2.18541 -42.89775 861.50275
6445.0000 -44.43035 -40.91751 3.51284 2.34033 -41.75632 1054.57817
6450.0000 -43.90222 -41.55572 2.34650 2.39810 -41.33065 1166.35085
6455.0000 -44.84169 -41.83083 3.01086 2.31542 -41.93982 1037.51837
6460.0000 -45.47398 -42.39237 3.08161 2.21845 -42.65435 983.18351
6465.0000 -44.26964 -41.61661 2.65303 2.25796 -42.36324 972.45331
6470.0000 -45.12927 -42.59609 2.53318 2.32942 -41.83667 1091.91272
6475.0000 -46.11932 -44.14960 1.96971 2.09224 -43.58421 839.82845
6480.0000 -45.16507 -42.80843 2.35665 2.04218 -43.95309 750.70343
6485.0000 -45.44039 -43.56612 1.87427 2.23181 -42.55585 996.99602
6490.0000 -44.74955 -43.40173 1.34783 2.16025 -43.08315 939.72461
6495.0000 -45.44211 -43.24273 2.19937 2.15040 -43.15569 853.66532
6500.0000 -45.16324 -42.63338 2.52987 2.16441 -43.05247 875.97618
MELTING PROCESS: loop number 27 T-loop= 966.00000000000000
main_MD> interactions number 27 at Temperature= 966.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.15898 -1.36336 -1.99870
force_rgl> df(natom) 1.88475 2.62628 -1.76050
6505.0000 -45.69401 -43.40730 2.28671 2.21466 -42.68225 927.47632
6510.0000 -45.46855 -43.05119 2.41736 2.13995 -43.23274 853.47238
6515.0000 -45.46078 -43.62030 1.84048 2.16032 -43.08264 896.17134
6520.0000 -45.10949 -43.00207 2.10743 2.11608 -43.40858 848.68852
6525.0000 -45.74461 -42.92908 2.81553 2.17579 -42.96864 885.67555
6530.0000 -45.38485 -42.39013 2.99472 2.23823 -42.50856 962.05980
6535.0000 -44.74757 -43.10316 1.64441 2.17149 -43.00036 944.89459
6540.0000 -44.96356 -42.51266 2.45091 2.18994 -42.86439 948.73073
6545.0000 -44.36279 -41.61050 2.75229 2.28561 -42.15949 959.64420
6550.0000 -43.60918 -41.15044 2.45874 2.38441 -41.43150 1106.80323
6555.0000 -44.45008 -41.75273 2.69736 2.41185 -41.22935 1070.38291
6560.0000 -44.47401 -41.97057 2.50344 2.36986 -41.53870 1064.52371
6565.0000 -44.98255 -41.74502 3.23753 2.32964 -41.83509 1047.20531
6570.0000 -44.24019 -42.31087 1.92932 2.31954 -41.90946 1015.47853
6575.0000 -45.52292 -42.76740 2.75552 2.20797 -42.73157 913.40007
6580.0000 -45.47677 -42.62962 2.84715 2.15516 -43.12061 882.78219
6585.0000 -45.35666 -43.11931 2.23735 2.21662 -42.66779 897.13326
6590.0000 -45.07305 -43.34394 1.72911 2.12943 -43.31026 848.87111
6595.0000 -44.41291 -42.33290 2.08001 2.22897 -42.57682 967.58744
6600.0000 -45.34372 -42.23646 3.10726 2.29978 -42.05505 1043.31148
6605.0000 -45.47893 -42.60933 2.86960 2.20125 -42.78109 914.63942
6610.0000 -45.16541 -42.85250 2.31291 2.17683 -42.96099 875.41989
6615.0000 -45.25568 -42.27752 2.97816 2.19856 -42.80087 931.31559
6620.0000 -45.18171 -42.52079 2.66092 2.22744 -42.58809 930.84897
6625.0000 -45.33232 -42.44733 2.88500 2.21073 -42.71120 936.27465
6630.0000 -45.78272 -43.88117 1.90155 2.18527 -42.89878 879.88420
6635.0000 -44.83985 -42.85443 1.98543 2.10851 -43.46440 783.55738
6640.0000 -45.08827 -43.22430 1.86397 2.15547 -43.11838 824.41962
6645.0000 -46.33342 -44.56415 1.76926 2.07016 -43.74691 782.00920
6650.0000 -45.78284 -43.31182 2.47102 2.03499 -44.00606 789.92546
6655.0000 -45.67553 -43.51992 2.15561 2.10397 -43.49778 814.15867
6660.0000 -44.98120 -42.34463 2.63657 2.22443 -42.61024 914.12626
6665.0000 -45.23151 -43.18197 2.04955 2.18740 -42.88312 949.17649
6670.0000 -45.35854 -43.42724 1.93130 2.16300 -43.06290 860.54334
6675.0000 -45.13004 -42.93428 2.19576 2.12999 -43.30607 864.85398
6680.0000 -43.77878 -41.54386 2.23492 2.31860 -41.91641 1051.80346
6685.0000 -43.88574 -41.56468 2.32106 2.40601 -41.27236 1129.76642
6690.0000 -45.27231 -42.84139 2.43092 2.25261 -42.40260 965.35525
6695.0000 -45.17907 -43.09083 2.08824 2.15902 -43.09221 902.72528
6700.0000 -44.21342 -41.50579 2.70763 2.18715 -42.88492 852.91342
6705.0000 -44.12515 -41.13920 2.98595 2.36111 -41.60323 1084.49253
6710.0000 -45.28126 -42.67980 2.60146 2.41994 -41.16973 1156.04537
6715.0000 -44.83729 -43.08727 1.75002 2.20746 -42.73530 904.94649
6720.0000 -44.80710 -42.03185 2.77526 2.22629 -42.59656 985.56010
6725.0000 -44.85045 -42.18813 2.66233 2.30623 -42.00756 993.82869
6730.0000 -44.63384 -41.74176 2.89208 2.30700 -42.00187 1069.10798
6735.0000 -43.66144 -40.82700 2.83444 2.43150 -41.08454 1121.14900
6740.0000 -45.25776 -42.50496 2.75280 2.37280 -41.51705 1058.55955
6745.0000 -44.60948 -42.03118 2.57830 2.24943 -42.42606 942.49796
6750.0000 -45.61027 -43.18121 2.42906 2.26625 -42.30214 991.21463
MELTING PROCESS: loop number 28 T-loop= 991.00000000000000
main_MD> interactions number 28 at Temperature= 991.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.07039 -0.94311 0.81646
force_rgl> df(natom) 3.23454 5.00484 -0.66490
6755.0000 -44.94511 -42.95338 1.99173 2.17227 -42.99458 893.87375
6760.0000 -45.24831 -42.69170 2.55661 2.18031 -42.93537 942.28586
6765.0000 -44.77882 -42.26806 2.51076 2.24890 -42.42994 964.43653
6770.0000 -45.20604 -43.13517 2.07087 2.20970 -42.71879 1012.35371
6775.0000 -45.91336 -43.64541 2.26795 2.10829 -43.46597 824.06821
6780.0000 -45.22382 -42.83002 2.39380 2.20319 -42.76672 882.28494
6785.0000 -45.59521 -43.67729 1.91792 2.12258 -43.36073 768.71931
6790.0000 -45.01467 -42.84284 2.17183 2.19242 -42.84612 877.79813
6795.0000 -44.61902 -42.73854 1.88048 2.28416 -42.17018 1018.33403
6800.0000 -45.10623 -41.96280 3.14343 2.22405 -42.61308 910.56328
6805.0000 -45.42467 -42.76488 2.65979 2.21139 -42.70632 929.91504
6810.0000 -44.18872 -42.15667 2.03205 2.29198 -42.11253 1024.86375
6815.0000 -43.85386 -41.31410 2.53976 2.33249 -41.81407 972.01301
6820.0000 -44.90663 -42.26338 2.64325 2.39982 -41.31795 1093.35453
6825.0000 -44.45163 -41.05194 3.39969 2.27795 -42.21595 959.92788
6830.0000 -43.86717 -40.58790 3.27927 2.47178 -40.78779 1210.83792
6835.0000 -45.22946 -41.72743 3.50204 2.38991 -41.39103 1100.05308
6840.0000 -45.38316 -42.66759 2.71556 2.16363 -43.05825 860.78930
6845.0000 -45.06880 -42.39052 2.67829 2.18912 -42.87045 900.54622
6850.0000 -46.13231 -43.41053 2.72178 2.12865 -43.31597 834.50430
6855.0000 -45.00511 -42.57081 2.43430 2.17918 -42.94365 904.53637
6860.0000 -44.55542 -41.22998 3.32544 2.36488 -41.57543 1039.21012
6865.0000 -43.69229 -41.81862 1.87367 2.38352 -41.43811 1081.57632
6870.0000 -43.70126 -41.79958 1.90168 2.37092 -41.53091 1043.51007
6875.0000 -44.80159 -42.40550 2.39610 2.30010 -42.05274 937.88692
6880.0000 -44.97208 -42.45617 2.51591 2.23642 -42.52191 1023.39245
6885.0000 -43.79764 -41.58299 2.21465 2.33310 -41.80954 1075.39139
6890.0000 -45.64393 -42.67435 2.96958 2.33158 -41.82076 1003.75981
6895.0000 -44.49990 -42.45081 2.04909 2.14344 -43.20701 873.51954
6900.0000 -43.79687 -41.07370 2.72317 2.36887 -41.54598 1131.25256
6905.0000 -43.72564 -40.90996 2.81568 2.41642 -41.19564 1136.07232
6910.0000 -44.29188 -41.32699 2.96489 2.46502 -40.83757 1186.29364
6915.0000 -44.23363 -41.00376 3.22987 2.46643 -40.82722 1114.58611
6920.0000 -44.99786 -42.34275 2.65511 2.38510 -41.42647 1106.95218
6925.0000 -44.63152 -41.99424 2.63728 2.27581 -42.23170 981.70273
6930.0000 -44.88705 -42.63001 2.25704 2.24372 -42.46815 933.84864
6935.0000 -44.85039 -42.34088 2.50951 2.27758 -42.21864 981.60343
6940.0000 -42.95547 -40.15796 2.79751 2.39951 -41.32025 1070.75916
6945.0000 -44.67415 -41.48089 3.19326 2.50172 -40.56717 1228.54984
6950.0000 -44.09788 -41.84548 2.25240 2.41280 -41.22233 1197.09224
6955.0000 -44.56324 -41.63051 2.93274 2.29108 -42.11916 996.77517
6960.0000 -44.89233 -42.32718 2.56515 2.30495 -42.01701 986.51862
6965.0000 -45.31711 -43.19864 2.11847 2.19445 -42.83118 889.15635
6970.0000 -45.26061 -43.53589 1.72472 2.15695 -43.10746 867.28601
6975.0000 -46.00074 -43.51860 2.48214 2.05433 -43.86356 741.65187
6980.0000 -44.65306 -41.70603 2.94704 2.22328 -42.61876 932.58378
6985.0000 -44.28987 -41.82001 2.46985 2.34925 -41.69057 1041.33496
6990.0000 -44.11516 -41.19999 2.91517 2.47701 -40.74925 1210.49029
6995.0000 -44.81026 -42.12284 2.68742 2.28517 -42.16271 1002.44336
7000.0000 -45.51487 -43.13174 2.38312 2.26564 -42.30663 978.03983
MELTING PROCESS: loop number 29 T-loop= 1016.0000000000000
main_MD> interactions number 29 at Temperature= 1016.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.83606 -0.25652 0.42342
force_rgl> df(natom) -1.46790 -3.17364 -0.75744
7005.0000 -44.82909 -42.75514 2.07395 2.16356 -43.05874 864.13532
7010.0000 -44.37619 -42.10002 2.27616 2.23119 -42.56044 885.40581
7015.0000 -43.93699 -41.85663 2.08036 2.34611 -41.71368 1037.61403
7020.0000 -44.14281 -40.96188 3.18093 2.38515 -41.42606 1122.41678
7025.0000 -44.44383 -41.76210 2.68173 2.41150 -41.23189 1118.69137
7030.0000 -45.14988 -42.98768 2.16219 2.24321 -42.47191 981.40788
7035.0000 -44.87184 -42.70063 2.17122 2.18433 -42.90573 911.74874
7040.0000 -45.65968 -42.25722 3.40246 2.22974 -42.57111 965.85817
7045.0000 -45.01477 -42.76104 2.25373 2.30962 -41.98258 1063.39574
7050.0000 -43.95573 -40.33868 3.61705 2.37990 -41.46477 1078.58312
7055.0000 -44.40292 -41.75603 2.64689 2.33784 -41.77463 934.73850
7060.0000 -45.11421 -41.72622 3.38799 2.33539 -41.79269 1069.27115
7065.0000 -45.00259 -41.93142 3.07117 2.32597 -41.86212 1056.52339
7070.0000 -44.36971 -43.15021 1.21950 2.24213 -42.47984 989.03535
7075.0000 -45.71886 -42.87328 2.84558 2.16852 -43.02219 871.52907
7080.0000 -45.35310 -43.16577 2.18733 2.21202 -42.70169 895.96328
7085.0000 -44.66798 -41.08905 3.57893 2.39404 -41.36054 1199.34886
7090.0000 -44.03542 -41.70057 2.33486 2.33519 -41.79418 1065.13404
7095.0000 -44.06803 -41.51307 2.55497 2.33162 -41.82050 1106.29495
7100.0000 -45.02160 -41.29227 3.72934 2.35985 -41.61251 1099.62794
7105.0000 -44.09505 -41.48618 2.60887 2.39144 -41.37969 1205.09255
7110.0000 -43.79213 -40.43263 3.35950 2.44552 -40.98124 1191.04543
7115.0000 -45.18582 -41.99573 3.19009 2.31338 -41.95487 1089.60525
7120.0000 -45.18372 -42.71458 2.46914 2.22092 -42.63614 935.30033
7125.0000 -44.91584 -42.74957 2.16627 2.27844 -42.21230 962.64372
7130.0000 -45.56892 -43.39700 2.17192 2.24135 -42.48557 979.33803
7135.0000 -44.63249 -42.15835 2.47414 2.20917 -42.72268 918.71556
7140.0000 -45.56654 -42.68448 2.88206 2.25354 -42.39581 972.30090
7145.0000 -44.35438 -41.55433 2.80005 2.34818 -41.69844 1070.64096
7150.0000 -44.70143 -41.50276 3.19866 2.42842 -41.10725 1123.35245
7155.0000 -44.11475 -42.15806 1.95669 2.37928 -41.46930 1149.12334
7160.0000 -44.71158 -40.84453 3.86705 2.41947 -41.17322 1064.51832
7165.0000 -44.95680 -40.63910 4.31770 2.43650 -41.04772 1180.66446
7170.0000 -43.68332 -40.36859 3.31474 2.49058 -40.64926 1223.70107
7175.0000 -43.74143 -39.64984 4.09159 2.62550 -39.65518 1385.26260
7180.0000 -43.15269 -39.81884 3.33386 2.61307 -39.74673 1375.41112
7185.0000 -45.01213 -41.81683 3.19530 2.44001 -41.02188 1162.73308
7190.0000 -44.89950 -42.64799 2.25151 2.27827 -42.21353 994.75839
7195.0000 -43.91145 -41.77797 2.13348 2.33161 -41.82053 1022.68952
7200.0000 -45.60209 -42.95493 2.64716 2.28145 -42.19012 1011.13888
7205.0000 -45.25476 -42.50552 2.74923 2.22022 -42.64128 997.46145
7210.0000 -44.41588 -42.15122 2.26466 2.27550 -42.23396 1050.69819
7215.0000 -45.13917 -42.45925 2.67992 2.26766 -42.29172 1015.70740
7220.0000 -44.90542 -42.13977 2.76565 2.29684 -42.07677 981.41785
7225.0000 -43.49382 -41.23193 2.26189 2.30331 -42.02905 1025.22457
7230.0000 -44.24660 -41.74736 2.49924 2.38538 -41.42438 1082.78370
7235.0000 -44.28337 -41.51580 2.76757 2.39042 -41.38726 1022.00076
7240.0000 -44.05152 -42.10330 1.94822 2.33032 -41.83006 1027.56923
7245.0000 -43.79800 -41.74436 2.05364 2.31229 -41.96287 966.84462
7250.0000 -44.74703 -42.10572 2.64131 2.32944 -41.83652 1055.27448
MELTING PROCESS: loop number 30 T-loop= 1041.0000000000000
main_MD> interactions number 30 at Temperature= 1041.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.72388 3.96223 -2.88881
force_rgl> df(natom) -2.58096 1.49621 -0.25443
7255.0000 -44.68134 -41.90710 2.77423 2.35040 -41.68208 1133.15174
7260.0000 -45.17136 -42.34708 2.82428 2.30910 -41.98641 1025.65495
7265.0000 -44.38905 -41.86667 2.52239 2.33611 -41.78738 1079.67726
7270.0000 -44.46445 -41.70600 2.75845 2.32914 -41.83877 989.07975
7275.0000 -44.92786 -42.54526 2.38261 2.31690 -41.92894 1020.90615
7280.0000 -44.81215 -42.20250 2.60965 2.27800 -42.21558 1023.56600
7285.0000 -44.29055 -42.01746 2.27310 2.27443 -42.24189 951.68163
7290.0000 -44.72997 -42.32116 2.40882 2.33742 -41.77776 1077.45120
7295.0000 -45.41931 -42.68420 2.73511 2.24440 -42.46316 993.55593
7300.0000 -44.23067 -41.13412 3.09655 2.24460 -42.46165 924.77379
7305.0000 -43.90421 -41.72187 2.18233 2.39647 -41.34269 1132.53039
7310.0000 -44.43096 -41.95810 2.47286 2.28770 -42.14411 998.08131
7315.0000 -44.86423 -42.48416 2.38007 2.25725 -42.36843 942.18510
7320.0000 -44.56880 -42.14435 2.42445 2.26933 -42.27942 967.83377
7325.0000 -45.02245 -42.48980 2.53265 2.17659 -42.96273 888.94388
7330.0000 -45.03476 -43.24219 1.79257 2.20394 -42.76123 887.21959
7335.0000 -43.16671 -40.32109 2.84561 2.32485 -41.87032 1061.15332
7340.0000 -43.48193 -40.25941 3.22252 2.53250 -40.34039 1219.47751
7345.0000 -43.37894 -39.98556 3.39338 2.56887 -40.07240 1228.61296
7350.0000 -43.74678 -41.00593 2.74085 2.44947 -40.95216 1150.53843
7355.0000 -43.01194 -40.81714 2.19480 2.44236 -41.00454 1158.80884
7360.0000 -44.42139 -41.73496 2.68643 2.43166 -41.08341 1175.58725
7365.0000 -44.96393 -42.14943 2.81451 2.23783 -42.51151 950.05600
7370.0000 -44.42026 -41.29491 3.12535 2.28485 -42.16511 1006.89499
7375.0000 -44.24398 -41.32105 2.92293 2.39354 -41.36425 1077.36215
7380.0000 -44.17182 -41.23917 2.93265 2.33744 -41.77762 1053.70232
7385.0000 -44.30705 -41.49057 2.81648 2.40268 -41.29689 1065.46463
7390.0000 -43.62541 -40.51014 3.11527 2.47872 -40.73660 1201.85721
7395.0000 -44.45812 -41.42663 3.03149 2.41874 -41.17858 1187.72148
7400.0000 -44.16929 -41.25105 2.91823 2.38373 -41.43654 1115.90552
7405.0000 -45.00283 -42.35427 2.64855 2.37348 -41.51201 1021.63723
7410.0000 -44.73430 -42.32314 2.41116 2.26250 -42.32973 1002.80527
7415.0000 -44.77125 -42.52573 2.24552 2.26386 -42.31974 1026.02112
7420.0000 -44.46535 -41.79803 2.66732 2.32540 -41.86628 1129.47482
7425.0000 -44.19547 -41.43187 2.76360 2.38681 -41.41384 1072.88269
7430.0000 -43.75352 -41.40458 2.34894 2.45667 -40.89911 1129.85747
7435.0000 -44.66679 -41.18216 3.48462 2.41685 -41.19252 1128.38850
7440.0000 -45.49978 -42.83137 2.66840 2.34882 -41.69378 1168.79893
7445.0000 -44.61762 -41.86840 2.74921 2.19021 -42.86240 912.72855
7450.0000 -44.60732 -41.66136 2.94596 2.44283 -41.00106 1186.52995
7455.0000 -45.09720 -42.38921 2.70799 2.30541 -42.01362 993.23002
7460.0000 -44.00265 -41.03179 2.97087 2.27981 -42.20221 999.68376
7465.0000 -44.16489 -40.61083 3.55405 2.46963 -40.80357 1197.18082
7470.0000 -44.62940 -42.15816 2.47124 2.36795 -41.55283 1078.41448
7475.0000 -43.00164 -41.31618 1.68547 2.40619 -41.27104 1077.53727
7480.0000 -44.83408 -41.33629 3.49779 2.40708 -41.26450 1082.25698
7485.0000 -45.35842 -42.92083 2.43759 2.25158 -42.41022 968.86033
7490.0000 -44.82924 -42.36406 2.46519 2.22137 -42.63280 935.79391
7495.0000 -44.50398 -42.01087 2.49310 2.32630 -41.85968 1082.42094
7500.0000 -44.24305 -41.32037 2.92268 2.32828 -41.84506 953.28550
MELTING PROCESS: loop number 31 T-loop= 1066.0000000000000
main_MD> interactions number 31 at Temperature= 1066.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.26583 -1.83007 2.41662
force_rgl> df(natom) -3.42100 2.58732 -0.73970
7505.0000 -44.55361 -41.73594 2.81766 2.29286 -42.10608 991.31066
7510.0000 -44.08287 -40.93215 3.15072 2.38363 -41.43727 1067.93842
7515.0000 -45.48357 -42.14196 3.34161 2.40205 -41.30154 1091.79177
7520.0000 -44.63098 -42.26294 2.36804 2.34897 -41.69266 1127.12023
7525.0000 -44.15459 -41.94528 2.20930 2.28886 -42.13551 1009.05276
7530.0000 -45.33442 -43.01013 2.32429 2.27456 -42.24092 991.75652
7535.0000 -44.53333 -42.21144 2.32189 2.25869 -42.35784 1005.03620
7540.0000 -44.59117 -41.21076 3.38040 2.32132 -41.89633 999.30748
7545.0000 -42.84065 -39.77540 3.06525 2.53680 -40.30871 1330.82437
7550.0000 -43.07944 -40.39001 2.68943 2.44655 -40.97363 1163.17367
7555.0000 -45.57703 -42.30359 3.27344 2.35757 -41.62925 1030.02095
7560.0000 -45.43260 -42.34622 3.08638 2.29114 -42.11872 1006.36191
7565.0000 -44.76535 -41.94047 2.82487 2.28773 -42.14387 931.12765
7570.0000 -44.64542 -41.92998 2.71544 2.24967 -42.42431 931.41266
7575.0000 -45.04210 -43.06178 1.98032 2.23477 -42.53410 920.69248
7580.0000 -44.88853 -42.78392 2.10461 2.24574 -42.45322 926.55358
7585.0000 -45.46211 -43.27232 2.18979 2.22752 -42.58749 938.57621
7590.0000 -44.72986 -42.60119 2.12867 2.19384 -42.83568 909.22406
7595.0000 -44.45984 -42.01659 2.44325 2.24313 -42.47247 910.22950
7600.0000 -44.46528 -41.66011 2.80517 2.39118 -41.38161 1051.97742
7605.0000 -43.50277 -40.09378 3.40899 2.43696 -41.04435 1151.48879
7610.0000 -43.70504 -41.01374 2.69130 2.52266 -40.41289 1251.86411
7615.0000 -44.66957 -41.26489 3.40468 2.34811 -41.69896 1098.39765
7620.0000 -44.36157 -41.23119 3.13038 2.44147 -41.01109 1134.04054
7625.0000 -43.96128 -40.22136 3.73992 2.48495 -40.69073 1325.88193
7630.0000 -44.63026 -41.04606 3.58420 2.56845 -40.07551 1284.73878
7635.0000 -44.99420 -41.55385 3.44035 2.34789 -41.70062 1139.28210
7640.0000 -45.34179 -42.59528 2.74652 2.30605 -42.00889 1042.48735
7645.0000 -44.47915 -40.89698 3.58217 2.38701 -41.41235 1141.25765
7650.0000 -44.92766 -40.13623 4.79144 2.53584 -40.31574 1320.53198
7655.0000 -44.30348 -41.18770 3.11577 2.45221 -40.93197 1169.44988
7660.0000 -44.22848 -41.47781 2.75067 2.36345 -41.58594 1061.56996
7665.0000 -43.41012 -40.39666 3.01345 2.38597 -41.42006 1076.34572
7670.0000 -44.53535 -40.43996 4.09539 2.50786 -40.52193 1249.69414
7675.0000 -45.17048 -41.96708 3.20340 2.39704 -41.33843 1145.77869
7680.0000 -44.80533 -41.86888 2.93645 2.31624 -41.93382 1007.27890
7685.0000 -44.60063 -42.43120 2.16942 2.35409 -41.65494 1077.37011
7690.0000 -44.70264 -41.48266 3.21998 2.30848 -41.99096 973.31183
7695.0000 -44.78392 -41.75282 3.03111 2.38344 -41.43865 1126.43952
7700.0000 -44.98151 -41.69565 3.28586 2.30344 -42.02808 965.67836
7705.0000 -43.59353 -40.91544 2.67809 2.35673 -41.63546 1067.89922
7710.0000 -44.31399 -41.67608 2.63791 2.45938 -40.87913 1199.46426
7715.0000 -44.92834 -41.86958 3.05876 2.32775 -41.84897 1070.72790
7720.0000 -43.81581 -40.86452 2.95129 2.37815 -41.47762 1133.70843
7725.0000 -44.10499 -40.64143 3.46356 2.45785 -40.89038 1137.71443
7730.0000 -44.22484 -40.91156 3.31328 2.43233 -41.07847 1244.54074
7735.0000 -44.42618 -40.94301 3.48317 2.52264 -40.41300 1198.85421
7740.0000 -43.70888 -40.63941 3.06946 2.51689 -40.45542 1259.50527
7745.0000 -44.09870 -40.63100 3.46771 2.48545 -40.68704 1275.04485
7750.0000 -44.88505 -42.77815 2.10690 2.27148 -42.26361 930.44921
MELTING PROCESS: loop number 32 T-loop= 1091.0000000000000
main_MD> interactions number 32 at Temperature= 1091.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.65952 1.00254 -0.73016
force_rgl> df(natom) -3.75003 2.08452 3.25802
7755.0000 -45.25482 -42.97018 2.28463 2.24539 -42.45580 985.76572
7760.0000 -44.24148 -40.94322 3.29826 2.31121 -41.97085 1029.50532
7765.0000 -45.37130 -41.68632 3.68498 2.39633 -41.34370 1104.86137
7770.0000 -43.59363 -40.49167 3.10196 2.44355 -40.99578 1199.55110
7775.0000 -43.50576 -40.28012 3.22564 2.50279 -40.55925 1229.89707
7780.0000 -43.88006 -40.67000 3.21006 2.55966 -40.14028 1316.29311
7785.0000 -43.48365 -40.70427 2.77938 2.45837 -40.88656 1140.09799
7790.0000 -43.21966 -40.81878 2.40088 2.48351 -40.70135 1174.26312
7795.0000 -44.22355 -41.57355 2.64999 2.41765 -41.18657 1144.36353
7800.0000 -43.84130 -41.04171 2.79959 2.36536 -41.57187 1094.72693
7805.0000 -44.44190 -40.40031 4.04159 2.46767 -40.81807 1186.66535
7810.0000 -44.85568 -41.98955 2.86613 2.39323 -41.36653 1128.52693
7815.0000 -44.17007 -41.03607 3.13400 2.36147 -41.60055 1030.72010
7820.0000 -44.33578 -41.05157 3.28421 2.37003 -41.53749 1108.13129
7825.0000 -44.78916 -41.33494 3.45422 2.49503 -40.61646 1156.43470
7830.0000 -43.80676 -40.51100 3.29577 2.52351 -40.40661 1224.74434
7835.0000 -43.23526 -40.18606 3.04920 2.43231 -41.07862 1158.94306
7840.0000 -43.24158 -38.46662 4.77496 2.59766 -39.86024 1312.32990
7845.0000 -42.93207 -39.32197 3.61010 2.59860 -39.85332 1279.98767
7850.0000 -43.35700 -40.28341 3.07359 2.65224 -39.45810 1457.78355
7855.0000 -42.74369 -40.06229 2.68140 2.52378 -40.40460 1218.59040
7860.0000 -44.65137 -41.34483 3.30654 2.53594 -40.31504 1273.95061
7865.0000 -44.16952 -41.15401 3.01552 2.41226 -41.22632 1100.60126
7870.0000 -42.46822 -40.24252 2.22570 2.47796 -40.74220 1180.33231
7875.0000 -44.62308 -42.13231 2.49077 2.34810 -41.69908 1034.20108
7880.0000 -44.97094 -42.45979 2.51114 2.28543 -42.16077 1013.78960
7885.0000 -44.27812 -42.05223 2.22589 2.36840 -41.54946 1160.03859
7890.0000 -44.44000 -40.70150 3.73850 2.39319 -41.36684 1117.68918
7895.0000 -43.78398 -40.40781 3.37617 2.51042 -40.50303 1237.80766
7900.0000 -43.32073 -41.06262 2.25811 2.44983 -40.94949 1210.16677
7905.0000 -44.60357 -41.47671 3.12686 2.40112 -41.30843 1085.63273
7910.0000 -44.27234 -41.54758 2.72477 2.52868 -40.36853 1222.96801
7915.0000 -44.52986 -41.65936 2.87050 2.32720 -41.85308 945.14829
7920.0000 -44.90455 -42.20424 2.70032 2.27406 -42.24462 973.81401
7925.0000 -44.14383 -40.77703 3.36680 2.40619 -41.27100 1172.21025
7930.0000 -43.99478 -41.76174 2.23305 2.44839 -40.96009 1205.17754
7935.0000 -43.93510 -41.21798 2.71712 2.37512 -41.49994 1073.66086
7940.0000 -42.84439 -40.40236 2.44203 2.43859 -41.03232 1164.77228
7945.0000 -44.45724 -40.86468 3.59257 2.51433 -40.47428 1232.62089
7950.0000 -44.37320 -41.31593 3.05726 2.42297 -41.14737 1084.21060
7955.0000 -45.09690 -42.41541 2.68149 2.32176 -41.89316 1039.24032
7960.0000 -43.99483 -41.66046 2.33437 2.38304 -41.44162 1047.47152
7965.0000 -44.93176 -40.77589 4.15587 2.35030 -41.68281 1109.57826
7970.0000 -44.20905 -41.33780 2.87125 2.41375 -41.21531 1183.44287
7975.0000 -45.05945 -42.16821 2.89125 2.35872 -41.62079 1059.00292
7980.0000 -44.74034 -42.17145 2.56889 2.34866 -41.69495 1103.35725
7985.0000 -44.57888 -41.11518 3.46370 2.38925 -41.39588 1155.77626
7990.0000 -43.66373 -40.85125 2.81249 2.37044 -41.53444 1088.05596
7995.0000 -43.50481 -40.86823 2.63658 2.43474 -41.06067 1105.88525
8000.0000 -44.05260 -41.15721 2.89540 2.38474 -41.42911 1093.32632
MELTING PROCESS: loop number 33 T-loop= 1116.0000000000000
main_MD> interactions number 33 at Temperature= 1116.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.62463 0.55660 3.33420
force_rgl> df(natom) -2.90437 0.25162 -3.51271
8005.0000 -45.18218 -42.05164 3.13054 2.34054 -41.75476 1027.12371
8010.0000 -44.57337 -41.54423 3.02913 2.33490 -41.79634 1116.76903
8015.0000 -44.25585 -41.10274 3.15311 2.47904 -40.73426 1212.71486
8020.0000 -44.00845 -40.80416 3.20430 2.40155 -41.30521 1175.28195
8025.0000 -44.44234 -41.22723 3.21510 2.41778 -41.18568 1083.22151
8030.0000 -44.42039 -41.46212 2.95827 2.45223 -40.93181 1171.51618
8035.0000 -44.80810 -41.80617 3.00193 2.41694 -41.19182 1133.55276
8040.0000 -43.75108 -40.33600 3.41508 2.38393 -41.43505 1084.77379
8045.0000 -44.10245 -41.93684 2.16561 2.36090 -41.60474 1068.83684
8050.0000 -44.80119 -42.03798 2.76321 2.32628 -41.85983 1070.62841
8055.0000 -45.55055 -42.81279 2.73777 2.30587 -42.01019 1022.57641
8060.0000 -44.99753 -42.65811 2.33942 2.21577 -42.67404 980.92364
8065.0000 -43.85799 -41.31859 2.53939 2.26503 -42.31114 961.23465
8070.0000 -44.06377 -40.74664 3.31712 2.47477 -40.76576 1170.84943
8075.0000 -44.29018 -41.26744 3.02274 2.38350 -41.43823 1089.77718
8080.0000 -45.03980 -41.17678 3.86302 2.40063 -41.31198 1058.08420
8085.0000 -44.51609 -42.11120 2.40489 2.32990 -41.83314 1096.73092
8090.0000 -44.69306 -41.18207 3.51099 2.30739 -41.99904 1090.79383
8095.0000 -44.45266 -41.77671 2.67595 2.30547 -42.01314 988.27853
8100.0000 -44.69295 -41.29368 3.39927 2.37424 -41.50643 1073.56824
8105.0000 -44.75284 -42.38922 2.36363 2.27725 -42.22109 962.56195
8110.0000 -44.21555 -41.39823 2.81733 2.28426 -42.16943 986.41499
8115.0000 -44.49470 -41.24391 3.25079 2.39790 -41.33213 1081.37796
8120.0000 -43.53015 -40.87987 2.65027 2.45381 -40.92014 1234.64446
8125.0000 -43.56454 -40.53734 3.02720 2.47616 -40.75546 1201.36176
8130.0000 -44.69850 -40.64807 4.05044 2.45923 -40.88021 1175.80783
8135.0000 -43.49945 -40.67363 2.82583 2.47077 -40.79519 1226.24264
8140.0000 -44.65621 -41.94384 2.71237 2.41845 -41.18069 1103.45699
8145.0000 -43.94995 -41.09356 2.85639 2.42643 -41.12192 1090.02471
8150.0000 -45.09315 -41.99683 3.09632 2.36372 -41.58398 1091.64355
8155.0000 -45.06872 -42.34133 2.72740 2.24105 -42.48781 998.65528
8160.0000 -44.17964 -41.38837 2.79127 2.40891 -41.25099 1171.15406
8165.0000 -43.98873 -40.83230 3.15643 2.40163 -41.30463 1117.25807
8170.0000 -43.72864 -40.75967 2.96897 2.46696 -40.82327 1097.93395
8175.0000 -45.58922 -42.60641 2.98281 2.39215 -41.37450 1091.60047
8180.0000 -43.95730 -41.30001 2.65729 2.35919 -41.61733 1043.83616
8185.0000 -44.83425 -40.99511 3.83914 2.42048 -41.16571 1006.34778
8190.0000 -44.76726 -41.51213 3.25514 2.38805 -41.40472 1118.75303
8195.0000 -43.79586 -41.58147 2.21439 2.33604 -41.78792 987.48955
8200.0000 -44.70292 -42.24773 2.45518 2.36524 -41.57273 1145.75335
8205.0000 -44.46888 -40.46823 4.00065 2.36465 -41.57710 1027.48938
8210.0000 -44.23415 -40.90112 3.33303 2.52457 -40.39884 1290.64298
8215.0000 -43.48039 -41.26801 2.21237 2.38773 -41.40705 1056.54328
8220.0000 -43.00840 -40.60394 2.40447 2.40362 -41.28999 1091.87143
8225.0000 -44.02040 -41.31745 2.70295 2.40772 -41.25977 1097.19372
8230.0000 -44.74972 -41.80447 2.94525 2.29638 -42.08013 943.33804
8235.0000 -43.15765 -40.53061 2.62704 2.43972 -41.02398 1158.81424
8240.0000 -43.63475 -40.62567 3.00908 2.47300 -40.77877 1165.78241
8245.0000 -44.05460 -40.52555 3.52904 2.58126 -39.98112 1342.35178
8250.0000 -43.94779 -41.82335 2.12445 2.44842 -40.95991 1166.01209
MELTING PROCESS: loop number 34 T-loop= 1141.0000000000000
main_MD> interactions number 34 at Temperature= 1141.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -4.59997 -1.13395 1.17639
force_rgl> df(natom) -7.19514 2.20466 3.64067
8255.0000 -44.36417 -40.88251 3.48166 2.44995 -40.94859 1170.90080
8260.0000 -45.08601 -42.54231 2.54370 2.29253 -42.10851 1025.27123
8265.0000 -44.65994 -42.30696 2.35298 2.36853 -41.54851 1083.63230
8270.0000 -43.38759 -40.85102 2.53657 2.28627 -42.15464 906.32810
8275.0000 -44.18031 -40.99812 3.18220 2.38834 -41.40259 1074.01493
8280.0000 -44.47382 -41.76801 2.70582 2.47054 -40.79692 1163.26957
8285.0000 -44.23509 -41.10127 3.13382 2.39155 -41.37889 1150.40200
8290.0000 -44.04608 -41.32774 2.71834 2.39852 -41.32755 1109.82768
8295.0000 -43.99453 -40.74252 3.25201 2.46591 -40.83106 1182.31657
8300.0000 -43.36866 -40.25540 3.11326 2.49234 -40.63630 1186.44161
8305.0000 -44.38034 -41.74839 2.63195 2.50886 -40.51455 1262.74137
8310.0000 -44.46112 -41.81308 2.64804 2.33753 -41.77692 1109.29530
8315.0000 -43.81197 -41.19899 2.61298 2.44184 -41.00839 1198.24477
8320.0000 -43.29734 -40.64225 2.65510 2.44465 -40.98766 1154.27790
8325.0000 -43.33233 -39.36715 3.96518 2.62212 -39.68007 1329.07480
8330.0000 -44.50471 -41.78118 2.72353 2.51435 -40.47410 1187.30962
8335.0000 -45.35230 -41.96019 3.39211 2.38925 -41.39582 1111.24657
8340.0000 -44.56759 -41.69413 2.87346 2.25875 -42.35741 969.30677
8345.0000 -43.86388 -40.19293 3.67095 2.48973 -40.65551 1163.87346
8350.0000 -43.99114 -40.23121 3.75993 2.64123 -39.53922 1436.79606
8355.0000 -44.50948 -41.66109 2.84840 2.53049 -40.35523 1232.71765
8360.0000 -44.11505 -40.67253 3.44252 2.43975 -41.02375 1159.44459
8365.0000 -43.40927 -39.47067 3.93859 2.55826 -40.15058 1297.45824
8370.0000 -44.39321 -41.74141 2.65180 2.49218 -40.63749 1154.29839
8375.0000 -44.51975 -41.27198 3.24777 2.35317 -41.66171 1104.05121
8380.0000 -44.03549 -41.59290 2.44260 2.42581 -41.12647 1152.03117
8385.0000 -44.96249 -42.57355 2.38894 2.26777 -42.29089 939.24990
8390.0000 -44.70827 -41.97196 2.73631 2.31460 -41.94588 1048.00936
8395.0000 -44.13321 -40.74102 3.39219 2.42854 -41.10640 1188.83538
8400.0000 -44.66586 -42.44122 2.22464 2.35538 -41.64544 1078.07746
8405.0000 -44.85647 -42.13265 2.72382 2.24494 -42.45913 968.58938
8410.0000 -43.85198 -41.84441 2.00757 2.29080 -42.12120 1002.37688
8415.0000 -44.67475 -41.35794 3.31682 2.32246 -41.88800 995.20897
8420.0000 -45.65304 -42.86732 2.78572 2.31983 -41.90737 1137.38377
8425.0000 -45.83315 -43.45261 2.38054 2.17428 -42.97978 963.71911
8430.0000 -45.77390 -43.64175 2.13215 2.08995 -43.60113 801.74220
8435.0000 -44.23851 -42.32457 1.91394 2.21888 -42.65118 939.91051
8440.0000 -43.81396 -40.54096 3.27300 2.33670 -41.78304 1080.71607
8445.0000 -44.02745 -41.98548 2.04196 2.29244 -42.10914 1042.12690
8450.0000 -44.98646 -42.25629 2.73016 2.28074 -42.19535 977.79566
8455.0000 -44.04795 -40.77592 3.27204 2.26368 -42.32107 952.45790
8460.0000 -44.43163 -41.97309 2.45854 2.30544 -42.01340 1094.39580
8465.0000 -44.61338 -42.46527 2.14811 2.33560 -41.79114 1056.46393
8470.0000 -45.44262 -42.89391 2.54871 2.19983 -42.79154 922.18805
8475.0000 -43.00278 -40.35178 2.65100 2.36354 -41.58528 1064.81922
8480.0000 -43.20844 -39.89566 3.31278 2.53252 -40.34027 1302.76251
8485.0000 -43.93541 -40.59557 3.33984 2.45540 -40.90849 1247.44659
8490.0000 -45.50043 -42.14950 3.35093 2.34274 -41.73853 1137.69192
8495.0000 -44.57544 -41.04903 3.52641 2.36524 -41.57278 1095.95291
8500.0000 -44.73939 -41.74466 2.99472 2.36523 -41.57282 1134.30268
MELTING PROCESS: loop number 35 T-loop= 1166.0000000000000
main_MD> interactions number 35 at Temperature= 1166.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.19123 0.11942 0.80133
force_rgl> df(natom) -2.97562 1.44039 -0.22919
8505.0000 -44.32434 -41.00802 3.31632 2.38350 -41.43822 1164.81458
8510.0000 -43.34967 -39.68094 3.66873 2.47098 -40.79369 1192.35419
8515.0000 -44.16860 -41.17201 2.99659 2.58813 -39.93052 1380.04389
8520.0000 -43.92220 -41.30113 2.62107 2.37613 -41.49252 1055.58827
8525.0000 -43.24281 -39.92779 3.31502 2.49823 -40.59287 1199.41859
8530.0000 -43.14548 -40.51987 2.62561 2.49444 -40.62083 1216.71028
8535.0000 -44.44943 -40.92901 3.52042 2.61038 -39.76653 1374.48348
8540.0000 -44.48463 -41.67694 2.80768 2.27696 -42.22322 969.37895
8545.0000 -43.39317 -41.71319 1.67997 2.38038 -41.46124 1082.58925
8550.0000 -43.32790 -40.18609 3.14181 2.37112 -41.52946 1132.66509
8555.0000 -43.59734 -40.14125 3.45609 2.56614 -40.09249 1258.88008
8560.0000 -43.72642 -40.01494 3.71147 2.55031 -40.20914 1302.58151
8565.0000 -43.69977 -39.84228 3.85749 2.49332 -40.62906 1304.68041
8570.0000 -43.16336 -40.52946 2.63390 2.49331 -40.62914 1196.19889
8575.0000 -42.80347 -39.87758 2.92589 2.56107 -40.12987 1239.71579
8580.0000 -44.12423 -40.22000 3.90423 2.59205 -39.90163 1322.09522
8585.0000 -44.24224 -40.19582 4.04642 2.57991 -39.99108 1303.73442
8590.0000 -44.10172 -41.24025 2.86146 2.50915 -40.51240 1201.94759
8595.0000 -44.07073 -41.01481 3.05592 2.43030 -41.09340 1139.82557
8600.0000 -44.06556 -41.11295 2.95261 2.41995 -41.16963 1021.26121
8605.0000 -45.17064 -41.92328 3.24736 2.37974 -41.46590 1101.18737
8610.0000 -44.46927 -41.15949 3.30978 2.37145 -41.52702 1083.72575
8615.0000 -43.87797 -41.21240 2.66558 2.40958 -41.24605 1101.19869
8620.0000 -44.75058 -41.59923 3.15135 2.36940 -41.54211 1139.78194
8625.0000 -44.16141 -41.68078 2.48063 2.33908 -41.76553 1059.84083
8630.0000 -42.61608 -39.35149 3.26459 2.47595 -40.75705 1163.21058
8635.0000 -44.15443 -41.52877 2.62566 2.44503 -40.98489 1143.59151
8640.0000 -45.01166 -42.37584 2.63582 2.33651 -41.78447 1005.68014
8645.0000 -43.71727 -41.60396 2.11331 2.28048 -42.19730 1064.06139
8650.0000 -43.78714 -41.38517 2.40197 2.37239 -41.52010 1075.41073
8655.0000 -43.46890 -39.89966 3.56924 2.47563 -40.75938 1183.69483
8660.0000 -43.33964 -39.68706 3.65258 2.59432 -39.88491 1244.56731
8665.0000 -42.47662 -38.68858 3.78805 2.71965 -38.96144 1484.04695
8670.0000 -42.79755 -39.90958 2.88798 2.71585 -38.98944 1484.12305
8675.0000 -42.60984 -38.29603 4.31381 2.72805 -38.89954 1438.95498
8680.0000 -42.64040 -38.33208 4.30832 2.81384 -38.26744 1646.56665
8685.0000 -42.70049 -39.43844 3.26205 2.77704 -38.53862 1562.95304
8690.0000 -42.67766 -40.09155 2.58611 2.55305 -40.18897 1347.16683
8695.0000 -43.54770 -39.45536 4.09234 2.57180 -40.05079 1246.10914
8700.0000 -43.54236 -40.85332 2.68903 2.68171 -39.24100 1398.83610
8705.0000 -44.08600 -41.01102 3.07498 2.40857 -41.25351 1105.43262
8710.0000 -43.37561 -40.49298 2.88262 2.45846 -40.88588 1181.80282
8715.0000 -44.24978 -40.83565 3.41413 2.53957 -40.28828 1331.12815
8720.0000 -44.59746 -40.33295 4.26451 2.54087 -40.27875 1303.45997
8725.0000 -43.37849 -39.72556 3.65293 2.53618 -40.31329 1220.59318
8730.0000 -44.67216 -41.64345 3.02871 2.52957 -40.36197 1268.79771
8735.0000 -43.19117 -40.32394 2.86723 2.42101 -41.16187 1143.31878
8740.0000 -44.51604 -40.88332 3.63271 2.54533 -40.24587 1267.45983
8745.0000 -44.59858 -42.02379 2.57479 2.42879 -41.10455 1108.44620
8750.0000 -44.73960 -39.91083 4.82877 2.37257 -41.51877 1062.97476
MELTING PROCESS: loop number 36 T-loop= 1191.0000000000000
main_MD> interactions number 36 at Temperature= 1191.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.22986 0.85071 -0.87764
force_rgl> df(natom) -1.15464 0.45824 -0.86551
8755.0000 -44.18611 -40.79190 3.39420 2.50868 -40.51590 1227.89634
8760.0000 -43.23764 -40.41568 2.82196 2.48502 -40.69019 1199.90716
8765.0000 -43.24647 -39.88210 3.36438 2.56093 -40.13092 1223.40161
8770.0000 -43.69990 -40.86548 2.83443 2.51298 -40.48421 1150.38384
8775.0000 -43.74994 -41.11067 2.63927 2.40583 -41.27371 1149.07113
8780.0000 -44.15082 -41.07561 3.07521 2.42934 -41.10049 1193.20819
8785.0000 -44.35183 -41.12260 3.22923 2.46613 -40.82937 1223.37479
8790.0000 -43.67717 -40.60661 3.07056 2.51372 -40.47872 1228.04093
8795.0000 -43.03080 -40.05244 2.97836 2.56839 -40.07594 1213.40725
8800.0000 -43.07459 -40.01349 3.06110 2.52989 -40.35958 1310.45485
8805.0000 -43.63378 -38.79386 4.83992 2.61283 -39.74853 1376.47725
8810.0000 -41.59488 -38.95452 2.64036 2.66574 -39.35865 1362.11598
8815.0000 -43.36346 -40.93809 2.42537 2.55133 -40.20165 1213.37402
8820.0000 -44.69429 -42.43172 2.26256 2.36195 -41.59703 1098.59779
8825.0000 -44.96525 -42.44190 2.52335 2.25171 -42.40925 915.00681
8830.0000 -43.92855 -40.86518 3.06337 2.42123 -41.16024 1085.61578
8835.0000 -44.02453 -41.45450 2.57003 2.34995 -41.68540 1060.11209
8840.0000 -43.97716 -40.31183 3.66532 2.41287 -41.22182 1144.17102
8845.0000 -44.12282 -40.60486 3.51796 2.52010 -40.43173 1336.10442
8850.0000 -44.86325 -40.60375 4.25950 2.46800 -40.81562 1219.58818
8855.0000 -44.10336 -40.80333 3.30003 2.38597 -41.42004 1150.09811
8860.0000 -44.31315 -41.57663 2.73652 2.43035 -41.09302 1109.71337
8865.0000 -45.36584 -41.44309 3.92275 2.29449 -42.09403 991.43646
8870.0000 -44.59029 -40.87119 3.71909 2.45766 -40.89184 1187.35502
8875.0000 -43.08745 -39.62028 3.46717 2.55424 -40.18018 1258.87567
8880.0000 -43.25561 -40.00093 3.25469 2.55804 -40.15219 1271.23873
8885.0000 -43.05240 -38.51209 4.54032 2.69527 -39.14111 1435.03634
8890.0000 -43.08472 -40.06609 3.01864 2.63250 -39.60360 1382.78972
8895.0000 -44.46757 -41.94692 2.52064 2.44506 -40.98466 1248.66871
8900.0000 -43.53588 -39.36937 4.16651 2.54049 -40.28149 1303.15140
8905.0000 -43.16340 -39.57671 3.58669 2.60249 -39.82470 1387.16779
8910.0000 -43.85985 -40.49388 3.36597 2.55123 -40.20236 1302.07056
8915.0000 -43.98831 -41.16483 2.82348 2.49328 -40.62936 1197.72042
8920.0000 -43.51382 -40.07868 3.43514 2.47074 -40.79541 1221.76245
8925.0000 -45.16997 -41.69133 3.47865 2.45670 -40.89886 1209.61837
8930.0000 -45.59972 -41.64693 3.95280 2.33786 -41.77450 1111.82141
8935.0000 -42.77834 -40.57594 2.20240 2.43804 -41.03638 1154.56081
8940.0000 -43.62094 -41.05466 2.56628 2.45669 -40.89893 1223.79842
8945.0000 -44.15284 -41.22554 2.92730 2.38959 -41.39333 1072.02273
8950.0000 -45.52539 -41.97705 3.54835 2.36455 -41.57787 1061.59519
8955.0000 -44.32688 -41.79643 2.53045 2.29470 -42.09253 1067.37337
8960.0000 -44.50383 -41.54318 2.96065 2.30782 -41.99582 1006.03560
8965.0000 -43.21644 -39.94436 3.27207 2.50570 -40.53787 1381.10348
8970.0000 -44.35720 -41.68800 2.66920 2.44818 -40.96165 1172.81228
8975.0000 -44.91479 -41.38554 3.52925 2.39813 -41.33044 1147.04165
8980.0000 -44.22990 -40.95540 3.27449 2.47702 -40.74918 1243.93877
8985.0000 -44.22834 -40.61305 3.61529 2.45741 -40.89362 1142.73618
8990.0000 -44.01921 -40.38920 3.63001 2.55498 -40.17471 1291.62259
8995.0000 -44.81805 -41.86211 2.95594 2.47703 -40.74907 1278.22915
9000.0000 -43.86552 -40.96688 2.89864 2.37315 -41.51450 1103.49361
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 2 [min], 52.6676425 [s].
main_MD> Deallocating global variables
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