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nanoparticlesims/growth_Melting_Silver_ICO_2451/freezeSims/run_56/freeze.log

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main_MD> Reading input file
read_input> Process type: freezing
Read_input> Process caloric with a T-change of 25.000000000000000 [K] and a rate of 9.9999999999999992E+022 [K/ns]
read_input> Input for metadynamics has been read
read_input> Metadynamics has not been chosen.
read_input> Reading initial positions fromtoFreeze_56.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 = 56 ntipo2 = 0
read_input> Finish reading input
main_MD> Allocating global variables
main_MD> Number of outputs that will be created: 1950
main_MD> Size of nv and nvoiz: 56 5600
main_MD> Size of nv and nvoiz: 56 5600
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 = 56
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> 1.7639261410192626E-002 -0.12006703635588829 -9.2545533420951037E-002 initial drift of cluster / NP1 for coalescence
init> 0.36644094255185244 0.35424004240461776 0.34562146560576557 scaling for velocity /for coalescence NP1
init.f90 > facguy = 3.8576758693137968E-003
preparo> IN BIGVOI : LIMIT 1.2247448652052084 1.2247448652052084 1.2247448652052084
preparo> END t=0 TIME STEP
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.94851 2.06478 -5.15213
force_rgl> df(natom) -3.21663 -7.23359 -6.12983
preparo> THERMALIZATION PROCESS AT 1290.1795696585243
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -122.13364621017530 6.7410902634117917 -128.87473647358709 6.3357346851975165E-004
preparo> END THERMALISATION ON NPAST DEFINE IN PARACLUSTER MODULE
main_MD> Time-loop is starting for freezing
main_MD> Now the computation of EXECUTION TIME starts
main_MD> Running from loop 1 to 39
FREEZING PROCESS: loop number 1 T-loop= 1266.0000000000000
main_MD> interactions number 1 at Temperature= 1266.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.47475 1.85559 -1.53500
force_rgl> df(natom) -0.61515 0.79612 -0.38690
5.0000 -129.23354 -118.52202 10.71152 3.05696 -120.45467 1268.84847
10.0000 -130.08908 -121.28883 8.80025 3.14933 -119.10252 1327.74632
15.0000 -130.23899 -121.09048 9.14851 2.98583 -121.49577 1225.98118
20.0000 -131.47244 -121.82605 9.64639 2.95600 -121.93242 1211.93917
25.0000 -128.50760 -120.58867 7.91893 3.03678 -120.74998 1251.86068
30.0000 -130.24742 -120.00219 10.24522 3.11567 -119.59522 1285.10248
35.0000 -129.75598 -121.83595 7.92003 2.96277 -121.83329 1180.17261
40.0000 -129.66760 -120.39013 9.27747 3.01170 -121.11708 1220.84759
45.0000 -132.11842 -124.57857 7.53984 2.94191 -122.13858 1183.04843
50.0000 -129.57539 -121.04622 8.52918 3.01360 -121.08920 1228.63339
55.0000 -128.76567 -119.90305 8.86262 3.05778 -120.44261 1254.16365
60.0000 -130.05383 -121.39794 8.65590 3.02799 -120.87860 1259.81852
65.0000 -131.35557 -123.44863 7.90694 2.93074 -122.30211 1183.28018
70.0000 -130.68636 -121.35614 9.33022 2.98261 -121.54285 1223.82777
75.0000 -130.08958 -121.25691 8.83267 3.05417 -120.49541 1254.43431
80.0000 -129.68437 -122.56052 7.12385 3.04747 -120.59356 1250.80773
85.0000 -131.43672 -121.91661 9.52012 2.95345 -121.96971 1206.95810
90.0000 -130.49844 -119.96007 10.53837 3.02907 -120.86284 1270.93172
95.0000 -127.13165 -119.09924 8.03241 3.16478 -118.87641 1381.09830
100.0000 -128.34514 -120.00065 8.34449 3.13562 -119.30324 1366.09491
105.0000 -128.08314 -120.38737 7.69577 3.05585 -120.47077 1250.98232
110.0000 -127.78335 -119.00902 8.77433 3.15793 -118.97673 1299.89644
115.0000 -128.09099 -118.09010 10.00089 3.19581 -118.42226 1311.25245
120.0000 -130.16772 -120.82534 9.34238 3.09345 -119.92052 1288.91549
125.0000 -129.67250 -118.95970 10.71279 3.07134 -120.24416 1286.19689
130.0000 -129.42555 -119.09955 10.32600 3.17106 -118.78454 1361.19626
135.0000 -128.37990 -118.36047 10.01943 3.16872 -118.81878 1342.94083
140.0000 -128.60121 -117.97118 10.63003 3.20349 -118.30986 1318.73027
145.0000 -126.46243 -115.63258 10.82986 3.34290 -116.26921 1450.23442
150.0000 -130.75616 -120.87544 9.88072 3.15025 -119.08907 1338.03003
155.0000 -130.35275 -120.46294 9.88981 3.03850 -120.72484 1249.32082
160.0000 -130.29936 -121.25704 9.04232 2.98090 -121.56788 1220.20177
165.0000 -129.72599 -121.06187 8.66413 3.05191 -120.52848 1269.38966
170.0000 -130.24017 -121.14183 9.09834 3.02352 -120.94407 1232.70156
175.0000 -127.13028 -117.28710 9.84318 3.17556 -118.71863 1347.81663
180.0000 -126.87825 -117.60463 9.27362 3.31783 -116.63621 1437.84236
185.0000 -129.09807 -120.49269 8.60539 3.15294 -119.04968 1291.29712
190.0000 -130.00144 -120.53791 9.46353 2.98411 -121.52092 1186.31103
195.0000 -128.48485 -117.23034 11.25451 3.15998 -118.94663 1342.08364
200.0000 -127.92243 -116.50516 11.41727 3.32848 -116.48029 1465.41081
205.0000 -127.12788 -118.09857 9.02931 3.26583 -117.39735 1398.93499
210.0000 -129.10776 -119.13559 9.97217 3.14753 -119.12896 1342.82401
215.0000 -128.68560 -120.37328 8.31232 3.05831 -120.43477 1236.89511
220.0000 -128.33903 -118.19317 10.14586 3.17775 -118.68663 1308.72510
225.0000 -127.92672 -118.75073 9.17599 3.13770 -119.27282 1272.60814
230.0000 -127.52240 -119.05740 8.46501 3.13782 -119.27103 1284.65811
235.0000 -129.41455 -120.60138 8.81316 3.16800 -118.82922 1382.46652
240.0000 -131.33185 -122.73235 8.59950 3.00634 -121.19549 1204.27413
245.0000 -129.48293 -119.66448 9.81845 3.00447 -121.22293 1223.61763
250.0000 -129.85732 -119.65508 10.20224 3.14641 -119.14536 1346.92014
FREEZING PROCESS: loop number 2 T-loop= 1241.0000000000000
main_MD> interactions number 2 at Temperature= 1241.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.87268 1.07917 1.71970
force_rgl> df(natom) 0.16562 2.50105 -1.23062
255.0000 -126.77527 -117.78887 8.98640 3.17793 -118.68399 1341.09291
260.0000 -127.38439 -120.38791 6.99648 3.12909 -119.39886 1294.67907
265.0000 -127.48363 -118.35453 9.12910 3.12904 -119.39947 1261.57976
270.0000 -131.18294 -123.51375 7.66919 3.06684 -120.31005 1246.06010
275.0000 -129.11808 -120.91599 8.20208 2.99016 -121.43231 1154.18492
280.0000 -130.47616 -122.01621 8.45994 2.98134 -121.56151 1172.41420
285.0000 -128.07288 -119.31879 8.75409 2.96883 -121.74457 1181.71371
290.0000 -127.68847 -118.88566 8.80281 3.14950 -119.10009 1305.60523
295.0000 -131.46781 -123.22414 8.24367 3.00996 -121.14255 1223.93129
300.0000 -130.71901 -123.76479 6.95422 2.90830 -122.63060 1154.79754
305.0000 -131.68584 -122.68135 9.00449 2.91218 -122.57378 1135.46940
310.0000 -128.04664 -118.90496 9.14167 3.00333 -121.23952 1191.86763
315.0000 -127.33726 -117.19335 10.14391 3.24753 -117.66520 1411.78585
320.0000 -126.50613 -118.80135 7.70478 3.24526 -117.69844 1364.43273
325.0000 -129.24037 -118.06661 11.17376 3.22958 -117.92790 1392.97963
330.0000 -128.72453 -119.27739 9.44714 3.16904 -118.81405 1349.82092
335.0000 -132.35872 -123.35871 9.00001 3.05181 -120.52995 1269.02708
340.0000 -130.60682 -122.60346 8.00336 2.81761 -123.95808 1077.27169
345.0000 -129.89350 -119.67861 10.21489 3.04085 -120.69043 1245.30643
350.0000 -131.32436 -121.39391 9.93044 3.01526 -121.06498 1212.39355
355.0000 -128.93975 -120.08755 8.85220 3.06863 -120.28383 1270.71849
360.0000 -129.75401 -122.32588 7.42813 2.97507 -121.65330 1151.79220
365.0000 -130.38421 -120.82069 9.56353 3.08840 -119.99440 1289.68218
370.0000 -128.33594 -119.25044 9.08550 3.07808 -120.14540 1286.65651
375.0000 -130.01135 -121.56636 8.44499 3.03576 -120.76484 1195.70555
380.0000 -129.39626 -119.16869 10.22757 3.05987 -120.41197 1242.91358
385.0000 -127.84052 -117.82226 10.01826 3.07742 -120.15516 1281.63958
390.0000 -128.56101 -118.14611 10.41490 3.15672 -118.99443 1346.56880
395.0000 -128.73651 -118.78199 9.95452 3.18532 -118.57574 1374.49197
400.0000 -127.96199 -119.56128 8.40071 3.13622 -119.29449 1286.73770
405.0000 -128.52418 -120.77311 7.75107 3.04068 -120.69287 1225.86630
410.0000 -130.50009 -120.80600 9.69410 3.03897 -120.71788 1260.81465
415.0000 -130.06332 -120.90836 9.15497 3.04810 -120.58431 1238.94533
420.0000 -129.16174 -120.30344 8.85831 3.03839 -120.72647 1212.77938
425.0000 -130.03549 -118.64355 11.39194 3.09094 -119.95716 1220.62061
430.0000 -126.11473 -118.49483 7.61990 3.19312 -118.46165 1341.59854
435.0000 -129.96964 -122.35362 7.61602 3.02988 -120.85104 1209.14940
440.0000 -128.98064 -120.23950 8.74113 3.00626 -121.19670 1217.53073
445.0000 -128.34721 -119.89172 8.45548 3.13809 -119.26710 1318.28409
450.0000 -130.70814 -121.71972 8.98842 3.02039 -120.98985 1234.03212
455.0000 -129.43197 -118.98908 10.44289 3.16465 -118.87829 1319.76101
460.0000 -128.69493 -117.39598 11.29895 3.14508 -119.16481 1352.01407
465.0000 -127.97268 -118.75256 9.22012 3.24138 -117.75517 1360.96728
470.0000 -130.88142 -122.38332 8.49811 3.00368 -121.23452 1216.45000
475.0000 -131.79004 -120.88190 10.90814 2.94118 -122.14933 1189.76714
480.0000 -130.21228 -122.19201 8.02026 3.00290 -121.24585 1190.15529
485.0000 -130.23551 -120.05067 10.18484 2.96798 -121.75696 1158.31469
490.0000 -129.41821 -120.15470 9.26351 3.06876 -120.28189 1273.53866
495.0000 -129.64181 -121.89794 7.74387 3.07912 -120.13025 1250.44494
500.0000 -132.60978 -124.93039 7.67939 2.88638 -122.95140 1132.74465
FREEZING PROCESS: loop number 3 T-loop= 1216.0000000000000
main_MD> interactions number 3 at Temperature= 1216.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.40265 -0.06888 0.13899
force_rgl> df(natom) -0.97494 -0.67554 2.63305
505.0000 -131.61614 -122.39441 9.22173 2.85756 -123.37329 1150.14192
510.0000 -129.85765 -121.14680 8.71085 3.00360 -121.23559 1222.04237
515.0000 -131.47447 -123.02624 8.44823 2.97957 -121.58733 1222.49808
520.0000 -132.84229 -125.68411 7.15818 2.72936 -125.24976 995.38758
525.0000 -131.77903 -122.86139 8.91764 2.74886 -124.96438 1050.67640
530.0000 -132.13149 -124.56353 7.56796 2.84377 -123.57515 1099.24989
535.0000 -131.32286 -123.28230 8.04056 2.82618 -123.83262 1091.30401
540.0000 -129.73977 -122.24054 7.49923 2.89055 -122.89031 1122.72996
545.0000 -131.12046 -122.44677 8.67370 2.86779 -123.22351 1129.02562
550.0000 -131.05314 -122.52696 8.52618 2.94769 -122.05407 1162.78512
555.0000 -130.44823 -119.58689 10.86135 2.96625 -121.78233 1205.01114
560.0000 -128.43442 -119.59809 8.83633 3.05895 -120.42550 1267.05685
565.0000 -128.88960 -120.56590 8.32370 3.15124 -119.07463 1293.44814
570.0000 -128.65215 -120.58924 8.06290 3.14357 -119.18682 1270.42501
575.0000 -129.07401 -119.16956 9.90445 3.02500 -120.92246 1198.49606
580.0000 -130.24610 -120.24459 10.00151 3.08676 -120.01846 1279.76914
585.0000 -128.11147 -119.62821 8.48325 3.07130 -120.24475 1293.41817
590.0000 -129.52888 -119.41914 10.10974 3.12722 -119.42622 1357.71252
595.0000 -129.10069 -119.44532 9.65537 3.15983 -118.94892 1313.71074
600.0000 -131.03687 -122.87862 8.15825 2.99905 -121.30217 1239.96723
605.0000 -130.39743 -121.28944 9.10799 2.90433 -122.68875 1119.48970
610.0000 -129.53592 -120.85127 8.68465 2.98915 -121.44721 1173.38658
615.0000 -129.89619 -120.27901 9.61718 3.00198 -121.25939 1168.17566
620.0000 -129.31853 -121.15639 8.16214 2.99158 -121.41164 1199.29811
625.0000 -129.89052 -119.32300 10.56752 3.04336 -120.65365 1243.11008
630.0000 -129.01456 -118.81189 10.20267 3.09497 -119.89817 1308.98221
635.0000 -128.78095 -120.50153 8.27942 3.08508 -120.04293 1283.33243
640.0000 -128.87248 -120.09105 8.78143 3.05065 -120.54700 1248.10741
645.0000 -130.49225 -123.53971 6.95254 3.00350 -121.23705 1184.13752
650.0000 -131.62434 -124.01959 7.60475 2.82852 -123.79826 1078.21112
655.0000 -129.94267 -120.65261 9.29006 2.93096 -122.29891 1143.46848
660.0000 -128.74716 -120.63393 8.11323 3.05052 -120.54890 1210.65201
665.0000 -130.40135 -122.15952 8.24183 3.00127 -121.26981 1215.92807
670.0000 -130.95926 -122.03031 8.92894 2.90856 -122.62678 1150.02790
675.0000 -129.65674 -121.62823 8.02850 2.88135 -123.02498 1123.50264
680.0000 -129.78167 -120.58650 9.19517 2.98833 -121.45914 1145.97922
685.0000 -129.86228 -119.09551 10.76678 3.10379 -119.76919 1302.06849
690.0000 -129.52116 -123.05802 6.46314 3.00882 -121.15918 1221.56557
695.0000 -129.27568 -120.67551 8.60017 2.95195 -121.99172 1192.93785
700.0000 -128.53241 -119.66728 8.86512 3.00571 -121.20480 1264.58369
705.0000 -129.33374 -120.27610 9.05764 3.04494 -120.63059 1263.83339
710.0000 -127.89483 -120.80884 7.08599 3.02039 -120.98983 1246.34792
715.0000 -131.10885 -121.96910 9.13975 2.97008 -121.72623 1195.29681
720.0000 -130.09748 -121.82499 8.27249 2.96206 -121.84367 1207.77235
725.0000 -129.83696 -120.24057 9.59640 2.96893 -121.74318 1216.90353
730.0000 -130.96323 -123.85712 7.10611 2.93951 -122.17380 1170.70918
735.0000 -129.66520 -122.05294 7.61226 2.90564 -122.66953 1159.66808
740.0000 -131.28089 -122.19546 9.08543 2.91620 -122.51497 1154.20739
745.0000 -130.84540 -123.56125 7.28415 2.95316 -121.97397 1186.10171
750.0000 -133.21796 -125.11104 8.10692 2.80901 -124.08396 1030.81760
FREEZING PROCESS: loop number 4 T-loop= 1191.0000000000000
main_MD> interactions number 4 at Temperature= 1191.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.43322 0.09477 0.25285
force_rgl> df(natom) 0.36645 1.52379 -0.96058
755.0000 -130.38168 -120.99514 9.38654 2.91245 -122.56987 1138.18997
760.0000 -131.93909 -122.81836 9.12073 2.96781 -121.75951 1177.43668
765.0000 -130.44692 -122.01113 8.43580 2.94333 -122.11780 1182.58733
770.0000 -130.43629 -121.76643 8.66986 2.93779 -122.19895 1198.26543
775.0000 -132.16424 -124.35964 7.80461 2.87059 -123.18247 1132.86285
780.0000 -130.69537 -121.04545 9.64992 2.88875 -122.91671 1095.97935
785.0000 -129.49153 -119.02924 10.46230 3.10360 -119.77186 1302.93038
790.0000 -130.44130 -120.56752 9.87378 3.04734 -120.59542 1267.90427
795.0000 -130.25772 -121.07548 9.18224 3.07426 -120.20144 1254.64924
800.0000 -127.95483 -120.06672 7.88811 3.00049 -121.28112 1179.77359
805.0000 -130.62579 -121.53389 9.09190 3.02028 -120.99148 1243.35164
810.0000 -128.96129 -121.20569 7.75560 2.98933 -121.44444 1217.15760
815.0000 -129.48994 -119.50548 9.98446 3.08330 -120.06902 1228.61860
820.0000 -131.50651 -122.57352 8.93299 2.98268 -121.54183 1176.39718
825.0000 -130.17491 -123.05102 7.12389 2.83779 -123.66264 1094.37517
830.0000 -130.74280 -123.46737 7.27543 2.90495 -122.67957 1088.30554
835.0000 -131.04256 -122.66398 8.37858 2.89848 -122.77425 1146.61491
840.0000 -131.27859 -124.35097 6.92762 2.84880 -123.50141 1094.25326
845.0000 -131.81584 -124.33287 7.48298 2.85273 -123.44389 1098.12406
850.0000 -132.49540 -124.17967 8.31572 2.84529 -123.55281 1124.86916
855.0000 -130.90788 -122.56310 8.34478 2.93048 -122.30594 1158.30730
860.0000 -130.28767 -122.16792 8.11975 2.97044 -121.72105 1182.06716
865.0000 -130.27111 -120.92498 9.34614 2.98829 -121.45977 1224.44406
870.0000 -128.37403 -120.47098 7.90305 3.03751 -120.73922 1241.33787
875.0000 -130.78860 -121.14836 9.64024 3.01459 -121.07478 1222.44017
880.0000 -127.39813 -118.78356 8.61457 3.14683 -119.13915 1329.18270
885.0000 -129.58226 -120.05682 9.52544 3.11303 -119.63384 1237.77713
890.0000 -131.10088 -121.38936 9.71152 3.06693 -120.30867 1272.52351
895.0000 -130.33206 -122.32323 8.00883 2.95764 -121.90834 1187.44243
900.0000 -130.34863 -121.20001 9.14862 2.95745 -121.91108 1177.26331
905.0000 -133.00234 -124.03381 8.96854 2.92688 -122.35856 1171.21650
910.0000 -130.65217 -122.67391 7.97826 2.84576 -123.54601 1129.57651
915.0000 -130.75459 -121.30836 9.44623 2.91538 -122.52690 1153.56705
920.0000 -129.81147 -122.28451 7.52696 2.92037 -122.45394 1133.31156
925.0000 -132.00268 -122.64327 9.35941 2.92726 -122.35300 1169.45342
930.0000 -131.18763 -122.93050 8.25713 2.88775 -122.93141 1127.36039
935.0000 -130.75993 -122.55140 8.20853 2.90511 -122.67725 1165.67583
940.0000 -127.15136 -118.21354 8.93781 3.10855 -119.69939 1303.26588
945.0000 -131.24892 -122.23708 9.01184 3.04013 -120.70095 1237.93707
950.0000 -128.94708 -120.79333 8.15376 3.01607 -121.05306 1192.84875
955.0000 -130.82968 -122.10224 8.72744 2.95842 -121.89700 1186.55052
960.0000 -129.48848 -118.96249 10.52599 2.96029 -121.86965 1168.23951
965.0000 -131.51263 -122.11394 9.39869 3.01502 -121.06844 1243.19092
970.0000 -131.50525 -122.15771 9.34754 2.95628 -121.92832 1152.95115
975.0000 -131.62263 -123.62891 7.99373 2.86092 -123.32408 1107.35684
980.0000 -129.56637 -122.44291 7.12346 2.88166 -123.02051 1127.52304
985.0000 -129.40235 -122.68686 6.71549 2.95477 -121.95037 1137.61444
990.0000 -130.07184 -121.61666 8.45519 2.94796 -122.05013 1117.52904
995.0000 -131.37590 -122.72502 8.65089 2.94233 -122.13240 1152.94733
1000.0000 -129.11372 -118.40815 10.70557 3.03115 -120.83238 1183.45368
FREEZING PROCESS: loop number 5 T-loop= 1166.0000000000000
main_MD> interactions number 5 at Temperature= 1166.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.73516 0.51067 -1.11765
force_rgl> df(natom) 1.53676 4.06346 1.48036
1005.0000 -130.35291 -122.10369 8.24921 3.06885 -120.28057 1263.86216
1010.0000 -127.11889 -119.54188 7.57701 2.97238 -121.69260 1171.77106
1015.0000 -129.92503 -120.24912 9.67591 3.12802 -119.41442 1268.25794
1020.0000 -128.09323 -121.36747 6.72576 3.00949 -121.14941 1221.61587
1025.0000 -130.15945 -122.47021 7.68924 2.93586 -122.22710 1153.54033
1030.0000 -131.40066 -124.55046 6.85019 2.90549 -122.67167 1075.02368
1035.0000 -131.61221 -123.01058 8.60163 2.83470 -123.70787 1072.73427
1040.0000 -132.17411 -124.39695 7.77716 2.80092 -124.20226 1063.86042
1045.0000 -131.18438 -121.68491 9.49947 2.90236 -122.71753 1076.49113
1050.0000 -129.85951 -121.55869 8.30082 2.95928 -121.88441 1195.70452
1055.0000 -130.22102 -121.09542 9.12559 3.04494 -120.63053 1226.22558
1060.0000 -128.80989 -119.76375 9.04614 3.05450 -120.49057 1262.59876
1065.0000 -130.01596 -120.43452 9.58144 3.02226 -120.96252 1196.08407
1070.0000 -129.53821 -121.41120 8.12701 2.99092 -121.42130 1204.05933
1075.0000 -129.86707 -122.05367 7.81340 2.98386 -121.52461 1176.64316
1080.0000 -130.85915 -123.12294 7.73621 2.91973 -122.46324 1137.82390
1085.0000 -130.09986 -121.77588 8.32398 2.91360 -122.55294 1147.36589
1090.0000 -129.44760 -121.30688 8.14071 2.93396 -122.25496 1116.08091
1095.0000 -131.98504 -121.46770 10.51733 3.02349 -120.94447 1183.44008
1100.0000 -129.09668 -121.27051 7.82617 2.95272 -121.98037 1125.07577
1105.0000 -131.86251 -123.38571 8.47681 2.87686 -123.09076 1120.77590
1110.0000 -130.55681 -123.42145 7.13536 2.91318 -122.55908 1144.33712
1115.0000 -130.46431 -121.95062 8.51369 2.93570 -122.22956 1147.74174
1120.0000 -130.83911 -122.98675 7.85237 2.90192 -122.72399 1105.83812
1125.0000 -130.23451 -122.31712 7.91739 2.90358 -122.69960 1144.37678
1130.0000 -130.88922 -123.70216 7.18707 2.88504 -122.97098 1128.95786
1135.0000 -131.05042 -123.86032 7.19010 2.84445 -123.56521 1062.71341
1140.0000 -130.20504 -122.32618 7.87886 2.89261 -122.86017 1110.58619
1145.0000 -130.40733 -122.60366 7.80367 2.93296 -122.26968 1180.52175
1150.0000 -130.09245 -121.08317 9.00928 2.99900 -121.30291 1196.20128
1155.0000 -130.35043 -121.24509 9.10535 3.00839 -121.16553 1250.90423
1160.0000 -130.10885 -122.08977 8.01908 3.00608 -121.19929 1213.13573
1165.0000 -130.37153 -121.36136 9.01016 2.95051 -122.01274 1177.63504
1170.0000 -130.78097 -122.71348 8.06750 2.92474 -122.38989 1164.02032
1175.0000 -131.21833 -123.63784 7.58049 2.83033 -123.77179 1112.41571
1180.0000 -131.60572 -123.88696 7.71876 2.83701 -123.67406 1086.47222
1185.0000 -129.99705 -122.03112 7.96593 2.95319 -121.97348 1204.40207
1190.0000 -131.31708 -122.72365 8.59343 2.98856 -121.45583 1195.45915
1195.0000 -128.08557 -120.50129 7.58428 3.00440 -121.22396 1209.56841
1200.0000 -131.81477 -123.59415 8.22062 2.93889 -122.18278 1145.90254
1205.0000 -130.67362 -120.59916 10.07446 2.88199 -123.01573 1135.92025
1210.0000 -129.43690 -118.92575 10.51115 3.10098 -119.81028 1299.27676
1215.0000 -130.29936 -122.11288 8.18648 3.04692 -120.60157 1234.95929
1220.0000 -130.17778 -121.20710 8.97067 3.00422 -121.22653 1203.73290
1225.0000 -131.51337 -122.39022 9.12315 2.93791 -122.19719 1132.10549
1230.0000 -131.46906 -121.53585 9.93321 2.92766 -122.34725 1093.61749
1235.0000 -132.32364 -121.65799 10.66564 2.93293 -122.27005 1156.92841
1240.0000 -130.43107 -122.94490 7.48617 2.89127 -122.87987 1105.61220
1245.0000 -131.24315 -121.55945 9.68371 2.94674 -122.06797 1173.61421
1250.0000 -130.89422 -122.39976 8.49446 2.94083 -122.15436 1182.80723
FREEZING PROCESS: loop number 6 T-loop= 1141.0000000000000
main_MD> interactions number 6 at Temperature= 1141.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.71399 0.71435 2.29010
force_rgl> df(natom) 0.72108 0.81584 -0.88677
1255.0000 -127.46139 -120.08066 7.38073 3.03589 -120.76294 1275.68816
1260.0000 -129.17080 -120.42509 8.74571 3.07070 -120.25341 1243.87490
1265.0000 -131.41409 -121.92202 9.49207 3.01208 -121.11156 1191.70891
1270.0000 -131.90254 -122.35293 9.54961 2.94013 -122.16461 1182.23794
1275.0000 -128.84981 -120.74502 8.10479 2.98001 -121.58097 1169.39411
1280.0000 -131.22700 -124.06559 7.16141 2.94099 -122.15214 1158.89750
1285.0000 -132.49707 -122.68667 9.81040 2.85536 -123.40544 1085.67409
1290.0000 -131.20797 -122.48893 8.71904 2.93640 -122.21928 1191.86888
1295.0000 -131.07892 -123.11169 7.96723 2.86874 -123.20964 1138.86910
1300.0000 -131.46742 -122.77680 8.69062 2.88101 -123.02995 1143.70210
1305.0000 -132.33111 -124.03339 8.29772 2.82590 -123.83668 1108.54115
1310.0000 -133.23216 -125.61524 7.61692 2.74200 -125.06473 1064.47670
1315.0000 -131.94473 -124.47980 7.46493 2.83819 -123.65684 1110.60268
1320.0000 -131.57343 -123.93043 7.64300 2.79340 -124.31231 1047.11847
1325.0000 -133.51509 -126.52205 6.99304 2.70855 -125.55439 988.34181
1330.0000 -132.84564 -124.59670 8.24894 2.73900 -125.10868 1002.76487
1335.0000 -132.52130 -123.96373 8.55757 2.84021 -123.62722 1060.05918
1340.0000 -131.60640 -123.86284 7.74357 2.86838 -123.21492 1115.47992
1345.0000 -130.08917 -123.58018 6.50899 2.78550 -124.42798 1047.39216
1350.0000 -132.06332 -125.25000 6.81332 2.80836 -124.09337 1102.75318
1355.0000 -131.28991 -124.53655 6.75336 2.76529 -124.72390 1046.12671
1360.0000 -133.84053 -124.67221 9.16832 2.75538 -124.86885 1048.48989
1365.0000 -132.76240 -123.38118 9.38122 2.84522 -123.55389 1113.72275
1370.0000 -132.40352 -123.38238 9.02114 2.79284 -124.32061 1022.26854
1375.0000 -130.59378 -120.98672 9.60706 2.91335 -122.55660 1185.97816
1380.0000 -129.80793 -122.22245 7.58548 2.97925 -121.59198 1179.36079
1385.0000 -131.23711 -123.23331 8.00380 2.91668 -122.50796 1152.50111
1390.0000 -130.08040 -120.81533 9.26507 2.99909 -121.30163 1200.30306
1395.0000 -129.83039 -121.81594 8.01445 3.04230 -120.66924 1195.92566
1400.0000 -130.78206 -123.08994 7.69212 2.94007 -122.16558 1183.10275
1405.0000 -132.05284 -124.71402 7.33882 2.82622 -123.83204 1065.53452
1410.0000 -130.72592 -121.94180 8.78411 2.81579 -123.98469 1094.67663
1415.0000 -131.16852 -123.54409 7.62443 2.92419 -122.39799 1089.37953
1420.0000 -131.56616 -124.02478 7.54139 2.88414 -122.98413 1157.80594
1425.0000 -133.08139 -124.03827 9.04312 2.83436 -123.71291 1104.26273
1430.0000 -131.85658 -124.45256 7.40402 2.79460 -124.29486 1063.95192
1435.0000 -131.38775 -123.69116 7.69660 2.80172 -124.19063 1060.44800
1440.0000 -128.93420 -120.61333 8.32087 2.99502 -121.36125 1199.90380
1445.0000 -129.07801 -119.95765 9.12036 2.98335 -121.53203 1183.03088
1450.0000 -130.11729 -122.06647 8.05081 3.09755 -119.86052 1302.32172
1455.0000 -131.25395 -124.39062 6.86333 2.90842 -122.62878 1132.11433
1460.0000 -130.64800 -122.84328 7.80472 2.80690 -124.11485 1066.05219
1465.0000 -132.25069 -121.50802 10.74267 2.92697 -122.35726 1162.11403
1470.0000 -129.44208 -120.40497 9.03711 3.01633 -121.04934 1262.48549
1475.0000 -132.16851 -124.67998 7.48852 2.90889 -122.62187 1157.41234
1480.0000 -132.08036 -124.98409 7.09627 2.72420 -125.32532 1003.31421
1485.0000 -132.25659 -124.63852 7.61807 2.76093 -124.78760 1040.54977
1490.0000 -130.64100 -123.03530 7.60571 2.82873 -123.79532 1117.59111
1495.0000 -130.49525 -122.59551 7.89974 2.82047 -123.91612 1076.10536
1500.0000 -131.95482 -123.98730 7.96751 2.89189 -122.87072 1157.94353
FREEZING PROCESS: loop number 7 T-loop= 1116.0000000000000
main_MD> interactions number 7 at Temperature= 1116.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.17412 0.08837 1.50129
force_rgl> df(natom) 0.92399 -7.58227 1.16845
1505.0000 -131.99361 -124.41164 7.58197 2.86036 -123.33225 1068.77223
1510.0000 -132.98325 -125.46758 7.51567 2.78660 -124.41187 1069.46413
1515.0000 -132.26056 -124.41335 7.84722 2.75123 -124.92958 1030.35376
1520.0000 -130.59680 -122.88568 7.71112 2.85125 -123.46556 1079.71834
1525.0000 -129.25200 -121.75591 7.49609 2.91440 -122.54128 1138.90471
1530.0000 -131.40321 -122.19579 9.20742 2.93783 -122.19832 1170.35566
1535.0000 -131.05767 -123.40752 7.65015 2.97944 -121.58920 1205.17927
1540.0000 -131.33907 -122.97399 8.36508 2.89932 -122.76199 1127.28930
1545.0000 -130.79759 -121.77778 9.01980 2.94182 -122.13989 1175.77505
1550.0000 -130.52041 -124.13475 6.38566 2.90150 -122.73014 1110.93073
1555.0000 -131.97627 -123.09957 8.87670 2.88855 -122.91972 1092.95384
1560.0000 -130.69746 -123.05890 7.63857 2.80090 -124.20254 1073.87965
1565.0000 -130.30585 -122.71869 7.58716 2.87714 -123.08661 1109.82313
1570.0000 -131.65101 -124.42553 7.22549 2.81584 -123.98397 1079.11305
1575.0000 -132.29115 -125.75091 6.54024 2.78637 -124.41526 1063.22859
1580.0000 -133.11405 -124.97897 8.13508 2.73703 -125.13747 1005.98733
1585.0000 -129.80833 -121.35200 8.45634 2.80158 -124.19269 1059.04495
1590.0000 -126.88715 -118.89112 7.99603 3.10934 -119.68793 1252.37900
1595.0000 -129.07856 -120.96792 8.11064 3.10136 -119.80473 1266.92258
1600.0000 -129.38007 -120.70498 8.67509 2.96287 -121.83175 1178.21121
1605.0000 -131.65452 -122.91039 8.74413 2.91757 -122.49486 1149.17938
1610.0000 -129.73565 -122.15424 7.58141 2.87467 -123.12277 1122.09283
1615.0000 -131.47004 -122.87212 8.59792 2.84515 -123.55487 1102.40241
1620.0000 -132.28656 -123.03867 9.24789 2.89609 -122.80921 1130.48868
1625.0000 -130.76183 -121.73931 9.02252 2.89814 -122.77923 1167.39266
1630.0000 -131.12661 -124.37614 6.75047 2.90780 -122.63783 1127.88670
1635.0000 -129.80781 -121.91957 7.88825 2.84334 -123.58143 1077.32069
1640.0000 -130.31068 -121.21275 9.09793 2.95119 -122.00279 1179.54300
1645.0000 -131.47537 -124.68433 6.79104 2.87803 -123.07362 1118.79461
1650.0000 -130.87562 -122.60758 8.26803 2.84808 -123.51197 1101.65521
1655.0000 -131.76167 -123.09927 8.66240 2.89878 -122.76993 1134.60764
1660.0000 -131.37697 -123.96891 7.40806 2.89174 -122.87290 1132.59105
1665.0000 -132.87893 -124.68979 8.18914 2.78201 -124.47905 1015.63507
1670.0000 -130.67090 -122.31204 8.35886 2.84211 -123.59938 1113.92796
1675.0000 -130.71801 -123.15653 7.56148 2.87259 -123.15332 1132.17398
1680.0000 -131.55764 -123.58800 7.96965 2.86501 -123.26426 1100.28362
1685.0000 -131.67282 -124.64774 7.02507 2.81390 -124.01239 1079.62613
1690.0000 -131.25947 -124.05754 7.20193 2.77972 -124.51259 1045.27284
1695.0000 -131.35636 -124.18934 7.16702 2.80798 -124.09896 1082.38418
1700.0000 -132.10982 -126.05340 6.05642 2.73994 -125.09484 1041.37857
1705.0000 -132.96595 -125.30528 7.66067 2.65714 -126.30680 985.19599
1710.0000 -132.92255 -123.85282 9.06972 2.71958 -125.39286 1023.02231
1715.0000 -133.39290 -126.38301 7.00990 2.70888 -125.54946 1040.09898
1720.0000 -132.75471 -124.40905 8.34566 2.80338 -124.16629 1111.11033
1725.0000 -130.91783 -123.70108 7.21675 2.77580 -124.56996 1065.11771
1730.0000 -132.21347 -123.62819 8.58528 2.83654 -123.68091 1134.22904
1735.0000 -131.24559 -123.98783 7.25776 2.81890 -123.93908 1071.50949
1740.0000 -131.41406 -123.99659 7.41747 2.86242 -123.30209 1031.04041
1745.0000 -131.38241 -123.59290 7.78950 2.90367 -122.69831 1144.66342
1750.0000 -129.36960 -121.52980 7.83980 2.97098 -121.71314 1127.89119
FREEZING PROCESS: loop number 8 T-loop= 1091.0000000000000
main_MD> interactions number 8 at Temperature= 1091.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.32336 0.13114 -2.85162
force_rgl> df(natom) -2.65215 2.06482 0.65938
1755.0000 -130.10929 -122.78114 7.32815 2.92964 -122.31818 1165.15917
1760.0000 -129.58188 -122.54838 7.03351 2.87152 -123.16892 1132.81429
1765.0000 -133.02668 -124.84579 8.18089 2.82749 -123.81346 1070.24659
1770.0000 -131.03393 -122.25152 8.78242 2.88742 -122.93624 1123.45546
1775.0000 -131.79311 -123.37496 8.41815 2.85297 -123.44044 1099.44240
1780.0000 -131.02870 -123.14769 7.88101 2.90568 -122.66889 1110.49770
1785.0000 -130.46333 -121.72507 8.73826 2.85766 -123.37177 1087.12627
1790.0000 -132.10734 -122.75849 9.34885 2.96024 -121.87023 1178.99618
1795.0000 -129.48295 -121.32006 8.16289 2.93810 -122.19442 1177.33525
1800.0000 -128.56869 -121.09086 7.47783 2.99758 -121.32370 1206.21717
1805.0000 -131.30355 -121.22970 10.07386 2.99093 -121.42102 1179.80004
1810.0000 -131.58225 -122.10066 9.48159 2.92961 -122.31869 1154.99553
1815.0000 -132.62041 -123.89357 8.72684 2.84535 -123.55202 1137.23471
1820.0000 -132.88086 -126.77323 6.10764 2.74910 -124.96079 1007.12672
1825.0000 -133.20339 -123.71081 9.49258 2.67666 -126.02110 974.01716
1830.0000 -131.34434 -123.29675 8.04759 2.90473 -122.68276 1111.02056
1835.0000 -131.02325 -124.10162 6.92164 2.86494 -123.26524 1086.86899
1840.0000 -133.23309 -125.00744 8.22565 2.76929 -124.66531 1052.22425
1845.0000 -132.69728 -125.43940 7.25788 2.68730 -125.86540 1009.29353
1850.0000 -131.57719 -123.78167 7.79551 2.78927 -124.37290 1053.00462
1855.0000 -131.01737 -122.80128 8.21610 2.86637 -123.24430 1109.42403
1860.0000 -130.60333 -123.10135 7.50198 2.88899 -122.91324 1110.32267
1865.0000 -131.09979 -123.83383 7.26596 2.85477 -123.41412 1080.55717
1870.0000 -129.46219 -122.81754 6.64465 2.89150 -122.87643 1151.51581
1875.0000 -133.17684 -125.37777 7.79907 2.77768 -124.54249 1034.08762
1880.0000 -132.32398 -124.82098 7.50301 2.82362 -123.87007 1084.94540
1885.0000 -131.90217 -125.77489 6.12728 2.73210 -125.20963 1018.10381
1890.0000 -132.34707 -123.95874 8.38834 2.75978 -124.80444 1052.66708
1895.0000 -131.87820 -122.54674 9.33147 2.86963 -123.19659 1171.27365
1900.0000 -131.98396 -124.17133 7.81262 2.82011 -123.92146 1102.65645
1905.0000 -130.73199 -123.51293 7.21906 2.83136 -123.75682 1114.31868
1910.0000 -130.11202 -122.88981 7.22222 2.88245 -123.00889 1143.97729
1915.0000 -131.82013 -124.69452 7.12561 2.86308 -123.29241 1096.67685
1920.0000 -130.01103 -121.65387 8.35716 2.88212 -123.01372 1143.66538
1925.0000 -130.41565 -121.61612 8.79954 2.97949 -121.58854 1188.70028
1930.0000 -131.05982 -121.87569 9.18413 2.94943 -122.02861 1146.70857
1935.0000 -131.55712 -122.47666 9.08046 2.93989 -122.16823 1155.69675
1940.0000 -133.42111 -125.57789 7.84322 2.86755 -123.22708 1133.96257
1945.0000 -132.51374 -126.26701 6.24673 2.72453 -125.32050 1004.03555
1950.0000 -133.91699 -126.05486 7.86213 2.71582 -125.44796 1008.26427
1955.0000 -126.98369 -121.17535 5.80834 2.86081 -123.32574 1091.36228
1960.0000 -132.15272 -124.13606 8.01666 2.89726 -122.79221 1157.80109
1965.0000 -132.22595 -123.87459 8.35136 2.81979 -123.92618 1134.93834
1970.0000 -131.28934 -123.69560 7.59373 2.89284 -122.85681 1115.04556
1975.0000 -130.66223 -122.10056 8.56167 2.87430 -123.12818 1136.28857
1980.0000 -131.25149 -123.42359 7.82790 2.92946 -122.32087 1195.36726
1985.0000 -131.59534 -121.94590 9.64944 2.92748 -122.34980 1146.72792
1990.0000 -131.76768 -123.73768 8.02999 2.89888 -122.76846 1123.31048
1995.0000 -129.29177 -123.02961 6.26216 2.82855 -123.79786 1084.65059
2000.0000 -130.01659 -121.97017 8.04642 2.92404 -122.40022 1171.81056
FREEZING PROCESS: loop number 9 T-loop= 1066.0000000000000
main_MD> interactions number 9 at Temperature= 1066.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.73543 -0.47878 -0.69218
force_rgl> df(natom) 1.90475 -2.41546 -1.22044
2005.0000 -130.67112 -123.84621 6.82491 2.90116 -122.73510 1115.85352
2010.0000 -132.96904 -124.27559 8.69345 2.75438 -124.88352 1032.61614
2015.0000 -132.28854 -124.42617 7.86237 2.80682 -124.11589 1049.30463
2020.0000 -132.01238 -124.37824 7.63414 2.73739 -125.13227 1051.29981
2025.0000 -131.69375 -123.80865 7.88510 2.81546 -123.98956 1072.42880
2030.0000 -130.95610 -122.31166 8.64444 2.94916 -122.03243 1180.61131
2035.0000 -131.83290 -123.33200 8.50090 2.88986 -122.90052 1122.50302
2040.0000 -132.05118 -123.82168 8.22950 2.86472 -123.26853 1113.07917
2045.0000 -132.19145 -123.24565 8.94580 2.81213 -124.03829 1116.28075
2050.0000 -130.49843 -122.37977 8.11867 2.93768 -122.20053 1170.66586
2055.0000 -130.04125 -122.14199 7.89927 2.95605 -121.93162 1219.53157
2060.0000 -131.03735 -124.18094 6.85641 2.84355 -123.57826 1061.72374
2065.0000 -131.61687 -122.10033 9.51654 2.87776 -123.07764 1133.73741
2070.0000 -129.97267 -123.04459 6.92807 2.87181 -123.16463 1100.47263
2075.0000 -132.03412 -124.23425 7.79987 2.84219 -123.59829 1080.38765
2080.0000 -131.18970 -124.06721 7.12250 2.81692 -123.96809 1081.44758
2085.0000 -132.77935 -124.35144 8.42790 2.73035 -125.23525 1028.97234
2090.0000 -130.89736 -122.72944 8.16792 2.84588 -123.54423 1091.61584
2095.0000 -131.87208 -124.51316 7.35892 2.86131 -123.31834 1089.96988
2100.0000 -134.21486 -125.75180 8.46306 2.71229 -125.49961 1035.17543
2105.0000 -132.58844 -126.73193 5.85651 2.71315 -125.48696 1000.69862
2110.0000 -132.95564 -125.22385 7.73179 2.70785 -125.56453 969.35444
2115.0000 -131.84957 -124.55050 7.29907 2.74180 -125.06770 1011.58580
2120.0000 -130.22299 -123.28667 6.93632 2.84955 -123.49050 1098.65980
2125.0000 -131.20769 -122.32040 8.88729 2.92759 -122.34814 1145.94188
2130.0000 -131.27379 -123.26389 8.00990 2.90934 -122.61537 1149.24986
2135.0000 -131.06051 -120.93608 10.12443 2.85573 -123.40002 1096.43733
2140.0000 -129.20589 -121.01486 8.19103 2.99086 -121.42209 1155.64168
2145.0000 -131.14606 -121.28228 9.86379 2.99701 -121.33207 1227.13523
2150.0000 -131.50103 -123.23964 8.26139 2.87768 -123.07877 1105.53519
2155.0000 -132.61175 -124.47239 8.13935 2.82247 -123.88689 1089.49812
2160.0000 -132.67500 -124.37524 8.29976 2.82316 -123.87679 1102.77454
2165.0000 -132.63576 -125.00414 7.63162 2.83150 -123.75475 1073.88145
2170.0000 -133.70146 -124.63163 9.06983 2.73691 -125.13921 1032.51646
2175.0000 -132.69116 -125.48131 7.20985 2.80706 -124.11247 1097.89175
2180.0000 -132.62656 -125.63798 6.98858 2.70447 -125.61412 949.67751
2185.0000 -130.72396 -122.70665 8.01731 2.80931 -124.07951 1114.28510
2190.0000 -130.70388 -122.97167 7.73222 2.90563 -122.66970 1130.13425
2195.0000 -131.25544 -123.93863 7.31681 2.83136 -123.75673 1076.21798
2200.0000 -131.83391 -123.25570 8.57821 2.85529 -123.40649 1120.24275
2205.0000 -131.64526 -123.18826 8.45700 2.87307 -123.14625 1098.53995
2210.0000 -131.47237 -123.63797 7.83440 2.78437 -124.44454 1047.36891
2215.0000 -132.14303 -124.87042 7.27261 2.83091 -123.76338 1084.88397
2220.0000 -132.01541 -124.34610 7.66931 2.74640 -125.00040 1064.13711
2225.0000 -132.54530 -123.50805 9.03725 2.90051 -122.74457 1150.61630
2230.0000 -129.54540 -122.30075 7.24464 2.92396 -122.40129 1149.28601
2235.0000 -131.32064 -123.60662 7.71402 2.83141 -123.75597 1079.57964
2240.0000 -131.77238 -124.04078 7.73161 2.80389 -124.15879 1049.08938
2245.0000 -131.67876 -123.08802 8.59074 2.84171 -123.60527 1120.17136
2250.0000 -131.81700 -125.12343 6.69357 2.74994 -124.94859 1035.80103
FREEZING PROCESS: loop number 10 T-loop= 1041.0000000000000
main_MD> interactions number 10 at Temperature= 1041.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.73057 4.61068 -4.95735
force_rgl> df(natom) 1.01303 2.27888 -1.88440
2255.0000 -132.20181 -126.95139 5.25042 2.65026 -126.40756 958.42348
2260.0000 -131.94436 -125.35820 6.58616 2.66555 -126.18376 983.56250
2265.0000 -130.45575 -123.69555 6.76020 2.77424 -124.59284 1014.91961
2270.0000 -133.35797 -126.83321 6.52476 2.69522 -125.74947 995.82613
2275.0000 -132.86505 -126.40541 6.45963 2.59366 -127.23608 905.74977
2280.0000 -132.42395 -125.18673 7.23722 2.68235 -125.93784 996.74191
2285.0000 -131.94894 -123.80864 8.14030 2.73267 -125.20134 1031.39887
2290.0000 -130.29429 -123.33764 6.95665 2.83533 -123.69865 1058.51404
2295.0000 -132.83154 -124.84517 7.98637 2.79544 -124.28246 1063.58277
2300.0000 -133.11646 -125.46252 7.65393 2.76048 -124.79425 1043.53295
2305.0000 -132.28595 -124.32639 7.95956 2.73623 -125.14923 1010.49740
2310.0000 -133.44278 -126.70907 6.73371 2.78854 -124.38359 1040.57533
2315.0000 -133.38592 -124.79064 8.59528 2.68537 -125.89365 997.49092
2320.0000 -132.17327 -124.87814 7.29513 2.73931 -125.10408 1034.52545
2325.0000 -133.03355 -123.44531 9.58824 2.80559 -124.13389 1092.99308
2330.0000 -131.54018 -125.69015 5.85004 2.76181 -124.77482 1017.24028
2335.0000 -133.93392 -126.55706 7.37686 2.71523 -125.45656 983.44935
2340.0000 -132.52293 -124.93208 7.59085 2.71434 -125.46965 998.35256
2345.0000 -131.53597 -124.26927 7.26671 2.72357 -125.33451 1020.50337
2350.0000 -134.48515 -126.72370 7.76144 2.69186 -125.79867 987.15545
2355.0000 -132.20857 -124.75236 7.45621 2.75995 -124.80198 1061.57675
2360.0000 -131.14216 -123.96088 7.18127 2.79463 -124.29435 1069.76864
2365.0000 -132.22515 -124.08696 8.13819 2.74459 -125.02687 997.67908
2370.0000 -130.78666 -122.27294 8.51372 2.83501 -123.70335 1112.02017
2375.0000 -133.70680 -127.08187 6.62494 2.85687 -123.38342 1117.28730
2380.0000 -133.47951 -126.75565 6.72386 2.66928 -126.12919 986.92450
2385.0000 -132.41395 -124.46944 7.94452 2.67965 -125.97741 982.53859
2390.0000 -130.82251 -122.78111 8.04139 2.85714 -123.37937 1127.00794
2395.0000 -132.07111 -124.77195 7.29916 2.79568 -124.27905 1095.50032
2400.0000 -130.62287 -122.09461 8.52826 2.83039 -123.77099 1111.54873
2405.0000 -130.23423 -122.72043 7.51380 2.88751 -122.93488 1093.04732
2410.0000 -132.90568 -125.21902 7.68667 2.78654 -124.41272 1019.48090
2415.0000 -131.92338 -122.82204 9.10134 2.80854 -124.09080 1065.14708
2420.0000 -132.66594 -126.79846 5.86748 2.76356 -124.74921 990.25315
2425.0000 -131.81239 -124.51604 7.29635 2.71855 -125.40792 994.76467
2430.0000 -132.19342 -124.35376 7.83967 2.84674 -123.53156 1097.93595
2435.0000 -132.87020 -126.06954 6.80066 2.75061 -124.93865 1028.96270
2440.0000 -132.18096 -124.89830 7.28265 2.68936 -125.83531 974.36030
2445.0000 -131.48985 -123.40525 8.08460 2.77526 -124.57789 1036.33906
2450.0000 -132.75191 -123.77858 8.97333 2.88056 -123.03654 1123.51541
2455.0000 -131.96444 -123.90098 8.06346 2.74312 -125.04834 1025.66345
2460.0000 -130.92140 -122.58495 8.33645 2.86182 -123.31085 1078.73775
2465.0000 -130.03580 -121.81404 8.22177 2.94076 -122.15545 1159.71475
2470.0000 -133.06920 -125.14277 7.92644 2.82595 -123.83588 1044.77173
2475.0000 -130.58721 -122.42701 8.16020 2.85997 -123.33791 1095.18139
2480.0000 -131.19004 -122.64381 8.54623 2.92378 -122.40397 1176.24917
2485.0000 -130.37397 -122.18067 8.19330 2.91265 -122.56682 1120.86240
2490.0000 -132.89728 -124.50679 8.39049 2.88761 -122.93337 1158.21709
2495.0000 -130.97655 -124.52220 6.45435 2.74609 -125.00487 1043.73929
2500.0000 -132.70645 -124.91458 7.79187 2.73731 -125.13344 1034.69001
FREEZING PROCESS: loop number 11 T-loop= 1016.0000000000000
main_MD> interactions number 11 at Temperature= 1016.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.15313 -0.34489 -3.41983
force_rgl> df(natom) -4.40216 2.38011 4.01613
2505.0000 -133.58371 -126.02462 7.55910 2.72151 -125.36459 1057.58722
2510.0000 -132.93480 -125.66656 7.26824 2.66641 -126.17123 949.75980
2515.0000 -133.75175 -128.66524 5.08651 2.62485 -126.77949 926.26065
2520.0000 -134.23726 -127.19266 7.04460 2.54769 -127.90896 901.70137
2525.0000 -136.01236 -129.61338 6.39898 2.52733 -128.20697 911.36287
2530.0000 -134.77437 -127.66223 7.11213 2.56142 -127.70798 906.56722
2535.0000 -135.16450 -128.14215 7.02235 2.58366 -127.38239 909.12176
2540.0000 -132.52678 -126.02196 6.50481 2.60838 -127.02051 923.20732
2545.0000 -133.37674 -125.70051 7.67623 2.70259 -125.64165 1024.73828
2550.0000 -133.94757 -126.91106 7.03651 2.68823 -125.85175 1005.75340
2555.0000 -132.82696 -124.72965 8.09731 2.68535 -125.89390 978.06597
2560.0000 -131.09379 -124.48733 6.60646 2.75601 -124.85962 1039.85902
2565.0000 -132.12413 -124.74945 7.37468 2.73071 -125.22993 1012.92754
2570.0000 -132.32534 -125.63854 6.68680 2.77653 -124.55935 1017.45574
2575.0000 -132.34781 -124.19564 8.15217 2.76488 -124.72989 1043.78816
2580.0000 -131.61834 -123.70302 7.91532 2.73719 -125.13510 1017.44014
2585.0000 -131.79478 -124.32729 7.46749 2.85994 -123.33836 1118.81165
2590.0000 -132.28151 -124.51009 7.77142 2.71012 -125.53139 1027.12026
2595.0000 -132.92816 -123.47091 9.45725 2.75355 -124.89568 1012.32951
2600.0000 -132.04905 -123.74674 8.30232 2.83346 -123.72595 1090.02780
2605.0000 -131.69006 -123.31085 8.37921 2.82389 -123.86613 1075.65112
2610.0000 -133.27850 -125.59933 7.67917 2.76067 -124.79153 1040.54505
2615.0000 -133.22620 -124.07787 9.14833 2.76982 -124.65757 1052.49827
2620.0000 -133.70467 -126.72571 6.97896 2.70322 -125.63242 1023.49391
2625.0000 -133.57090 -126.49131 7.07959 2.64557 -126.47624 943.22078
2630.0000 -134.66979 -126.92556 7.74423 2.62201 -126.82103 954.87558
2635.0000 -132.34693 -125.77358 6.57335 2.66563 -126.18254 951.81803
2640.0000 -132.49299 -124.47762 8.01537 2.74232 -125.06006 1045.56884
2645.0000 -133.14165 -125.28686 7.85479 2.77426 -124.59256 1071.24862
2650.0000 -131.54996 -124.63409 6.91586 2.71133 -125.51367 997.04045
2655.0000 -131.59234 -123.65035 7.94199 2.82099 -123.90861 1085.97734
2660.0000 -132.62128 -125.15150 7.46978 2.76910 -124.66806 1046.00627
2665.0000 -132.64579 -126.50439 6.14141 2.69910 -125.69261 960.15350
2670.0000 -133.82537 -126.59294 7.23243 2.66632 -126.17250 949.10499
2675.0000 -131.96005 -125.65308 6.30697 2.68745 -125.86327 941.91578
2680.0000 -133.51310 -126.97917 6.53393 2.65198 -126.38241 925.80810
2685.0000 -132.93670 -125.66374 7.27296 2.66621 -126.17403 999.40632
2690.0000 -131.84339 -124.12059 7.72280 2.72287 -125.34479 1018.29769
2695.0000 -130.89291 -123.71060 7.18230 2.81355 -124.01737 1030.97306
2700.0000 -132.93043 -124.40518 8.52525 2.79926 -124.22664 1083.04316
2705.0000 -133.10921 -126.47376 6.63545 2.71363 -125.48001 1000.05027
2710.0000 -132.46753 -124.61731 7.85022 2.72210 -125.35601 1024.38719
2715.0000 -132.77598 -123.76582 9.01016 2.79880 -124.23331 1092.00419
2720.0000 -130.93450 -122.84578 8.08872 2.83857 -123.65120 1098.43690
2725.0000 -130.98816 -123.08234 7.90582 2.89664 -122.80129 1134.14541
2730.0000 -133.44009 -125.66247 7.77762 2.77359 -124.60232 1022.51793
2735.0000 -132.36762 -124.50660 7.86102 2.66526 -126.18803 954.81741
2740.0000 -132.71626 -124.47369 8.24257 2.79755 -124.25157 1067.11268
2745.0000 -132.39778 -125.20737 7.19041 2.79324 -124.31478 1042.64372
2750.0000 -131.03434 -123.53925 7.49509 2.72564 -125.30415 1030.98224
FREEZING PROCESS: loop number 12 T-loop= 991.00000000000000
main_MD> interactions number 12 at Temperature= 991.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.70924 4.23313 -0.79413
force_rgl> df(natom) -1.12917 -1.69991 -3.38788
2755.0000 -130.97297 -123.02162 7.95136 2.81030 -124.06500 1135.68156
2760.0000 -132.04156 -124.52872 7.51284 2.85674 -123.38523 1083.00486
2765.0000 -131.71518 -124.89768 6.81749 2.74726 -124.98773 1025.82427
2770.0000 -132.99335 -126.36710 6.62625 2.66167 -126.24060 979.65728
2775.0000 -133.74358 -125.52076 8.22282 2.68380 -125.91661 1006.98471
2780.0000 -132.31735 -123.66475 8.65260 2.74148 -125.07238 1025.25719
2785.0000 -133.72595 -126.96439 6.76156 2.72717 -125.28178 1021.01378
2790.0000 -133.97464 -126.36354 7.61110 2.64113 -126.54113 953.18430
2795.0000 -134.60886 -128.15083 6.45803 2.57330 -127.53409 906.71590
2800.0000 -132.83103 -125.13995 7.69108 2.57793 -127.46626 942.99257
2805.0000 -134.37952 -127.07220 7.30732 2.67682 -126.01883 961.73646
2810.0000 -134.42020 -128.46097 5.95923 2.56648 -127.63393 912.85807
2815.0000 -134.38480 -128.14016 6.24463 2.53654 -128.07206 883.25465
2820.0000 -133.68670 -126.95862 6.72808 2.55403 -127.81610 877.61775
2825.0000 -132.99924 -125.48029 7.51895 2.65457 -126.34451 959.13912
2830.0000 -134.09752 -126.89304 7.20448 2.67886 -125.98886 975.77617
2835.0000 -133.71427 -124.70576 9.00851 2.69581 -125.74079 1002.79598
2840.0000 -133.59210 -125.93159 7.66051 2.70568 -125.59629 1017.53064
2845.0000 -133.31499 -127.09865 6.21634 2.62961 -126.70977 963.43261
2850.0000 -133.44016 -124.39929 9.04087 2.67588 -126.03257 989.89584
2855.0000 -134.43032 -127.23160 7.19872 2.72370 -125.33266 1045.81336
2860.0000 -134.05639 -127.70743 6.34895 2.53353 -128.11622 865.58746
2865.0000 -134.74620 -126.29167 8.45453 2.66197 -126.23613 986.11051
2870.0000 -131.58457 -125.25981 6.32476 2.74142 -125.07316 1040.73331
2875.0000 -132.75129 -125.00274 7.74855 2.70846 -125.55570 999.23858
2880.0000 -133.45551 -125.53618 7.91933 2.69567 -125.74292 962.89853
2885.0000 -133.25998 -126.99763 6.26235 2.67604 -126.03021 984.64166
2890.0000 -133.12513 -126.58969 6.53544 2.59998 -127.14344 922.46502
2895.0000 -131.83887 -126.35577 5.48310 2.66837 -126.14243 981.63189
2900.0000 -131.71772 -124.72368 6.99404 2.65535 -126.33299 959.03068
2905.0000 -132.84782 -125.34571 7.50210 2.77568 -124.57181 1029.16389
2910.0000 -134.67039 -128.50174 6.16864 2.65847 -126.28731 955.71433
2915.0000 -133.39715 -127.28244 6.11471 2.52589 -128.22792 855.44361
2920.0000 -134.41311 -128.10770 6.30541 2.60130 -127.12425 916.80371
2925.0000 -134.38795 -127.43390 6.95405 2.58153 -127.41356 863.11819
2930.0000 -134.82498 -128.91112 5.91386 2.56726 -127.62250 853.89364
2935.0000 -135.21716 -127.36159 7.85556 2.60820 -127.02321 940.06204
2940.0000 -133.50456 -126.72783 6.77673 2.59493 -127.21740 912.44760
2945.0000 -134.12893 -127.90756 6.22137 2.58416 -127.37514 888.59355
2950.0000 -132.04137 -125.70086 6.34051 2.65562 -126.32917 983.88959
2955.0000 -132.07870 -124.05070 8.02801 2.73209 -125.20979 1035.01432
2960.0000 -131.14464 -123.96559 7.17905 2.80911 -124.08245 1066.66485
2965.0000 -131.95122 -123.17040 8.78082 2.88179 -123.01860 1126.87609
2970.0000 -130.17282 -124.33202 5.84079 2.76830 -124.67975 1038.59446
2975.0000 -132.69496 -125.65034 7.04462 2.77872 -124.52719 1042.79458
2980.0000 -131.47372 -123.96039 7.51333 2.76897 -124.67002 1021.82053
2985.0000 -131.76145 -123.88745 7.87400 2.83615 -123.68666 1090.68509
2990.0000 -133.04237 -125.32329 7.71908 2.79563 -124.27978 1074.99756
2995.0000 -132.88071 -125.87907 7.00164 2.66058 -126.25647 931.03366
3000.0000 -132.80593 -126.79157 6.01437 2.65262 -126.37301 974.08172
FREEZING PROCESS: loop number 13 T-loop= 966.00000000000000
main_MD> interactions number 13 at Temperature= 966.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -7.91998 -3.65085 3.97875
force_rgl> df(natom) -1.17953 1.14912 -2.16051
3005.0000 -133.01276 -126.58344 6.42933 2.66438 -126.20088 974.62427
3010.0000 -132.01267 -124.49868 7.51398 2.63976 -126.56122 964.68287
3015.0000 -132.03515 -124.90473 7.13042 2.79230 -124.32847 1044.28258
3020.0000 -131.37466 -124.77056 6.60410 2.73665 -125.14297 1029.71287
3025.0000 -132.11038 -124.37556 7.73482 2.76469 -124.73267 1067.32611
3030.0000 -133.60231 -126.17417 7.42814 2.67940 -125.98103 994.89413
3035.0000 -131.50462 -125.46988 6.03474 2.72337 -125.33749 1011.59640
3040.0000 -131.81048 -124.69111 7.11938 2.76382 -124.74538 1021.82390
3045.0000 -131.05429 -123.91982 7.13447 2.78202 -124.47900 1025.33940
3050.0000 -133.22553 -124.48202 8.74351 2.80234 -124.18147 1130.21538
3055.0000 -133.35665 -125.97474 7.38191 2.70766 -125.56736 1032.86990
3060.0000 -130.91641 -124.40482 6.51159 2.74750 -124.98423 1032.73610
3065.0000 -133.74319 -126.93647 6.80672 2.68689 -125.87143 988.72086
3070.0000 -133.96627 -127.16467 6.80160 2.62323 -126.80324 955.77050
3075.0000 -132.82834 -126.36526 6.46309 2.65398 -126.35305 918.34807
3080.0000 -132.32165 -126.24244 6.07921 2.66918 -126.13065 970.53553
3085.0000 -133.83805 -127.15693 6.68112 2.61837 -126.87435 934.01554
3090.0000 -133.15284 -125.54630 7.60654 2.71225 -125.50021 992.76041
3095.0000 -133.15538 -125.98193 7.17345 2.75981 -124.80407 1053.68071
3100.0000 -133.69665 -125.80728 7.88937 2.65111 -126.39509 977.57687
3105.0000 -132.46640 -126.02570 6.44070 2.64169 -126.53306 945.01001
3110.0000 -133.54707 -127.03092 6.51615 2.64809 -126.43926 920.16247
3115.0000 -134.66593 -128.59274 6.07319 2.53085 -128.15541 856.05114
3120.0000 -133.93425 -127.45016 6.48409 2.47654 -128.95032 819.81814
3125.0000 -134.55217 -127.29783 7.25434 2.57403 -127.52333 954.49547
3130.0000 -134.95709 -127.97166 6.98544 2.54378 -127.96614 915.09445
3135.0000 -133.48864 -125.16632 8.32232 2.60146 -127.12188 940.36209
3140.0000 -133.91064 -126.24213 7.66851 2.71566 -125.45026 1009.21729
3145.0000 -132.65326 -128.08788 4.56538 2.61063 -126.98756 942.80189
3150.0000 -134.36526 -127.48137 6.88389 2.59916 -127.15552 925.63297
3155.0000 -133.11974 -126.72682 6.39292 2.61846 -126.87302 960.69571
3160.0000 -134.72376 -128.09280 6.63095 2.63453 -126.63779 939.21026
3165.0000 -133.60753 -126.04218 7.56535 2.61104 -126.98160 948.66613
3170.0000 -133.05206 -125.75404 7.29802 2.63043 -126.69784 953.02018
3175.0000 -132.21161 -124.87267 7.33894 2.74840 -124.97104 1016.92325
3180.0000 -133.57951 -127.05521 6.52430 2.65920 -126.27666 971.29450
3185.0000 -132.21586 -126.13043 6.08543 2.61481 -126.92643 932.53333
3190.0000 -132.12916 -124.62362 7.50554 2.72832 -125.26494 1010.29348
3195.0000 -132.99459 -125.79977 7.19482 2.72093 -125.37321 984.76227
3200.0000 -131.61205 -125.35216 6.25989 2.69989 -125.68104 988.90776
3205.0000 -133.36365 -126.99890 6.36475 2.69472 -125.75676 974.34237
3210.0000 -134.20240 -126.81567 7.38673 2.62989 -126.70566 943.31761
3215.0000 -133.22608 -125.21108 8.01500 2.71308 -125.48800 969.73577
3220.0000 -131.15505 -124.53115 6.62390 2.74015 -125.09188 985.28027
3225.0000 -133.07124 -126.75561 6.31563 2.71951 -125.39394 1006.14292
3230.0000 -134.28003 -126.98914 7.29089 2.63880 -126.57536 934.85679
3235.0000 -133.43848 -126.76907 6.66941 2.59083 -127.27743 884.29109
3240.0000 -131.50118 -123.74634 7.75483 2.70995 -125.53389 1003.94455
3245.0000 -131.38253 -124.44089 6.94164 2.80935 -124.07888 1094.95318
3250.0000 -132.77635 -125.68000 7.09635 2.75139 -124.92733 1034.01343
FREEZING PROCESS: loop number 14 T-loop= 941.00000000000000
main_MD> interactions number 14 at Temperature= 941.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.48406 5.32864 0.63863
force_rgl> df(natom) 1.83185 1.25339 3.38774
3255.0000 -132.90458 -126.48778 6.41680 2.71486 -125.46192 1018.92204
3260.0000 -133.16775 -126.91300 6.25475 2.58342 -127.38588 892.69409
3265.0000 -132.83118 -127.14907 5.68211 2.60477 -127.07345 938.66495
3270.0000 -133.36529 -127.84254 5.52275 2.62169 -126.82576 930.16802
3275.0000 -133.93179 -126.07716 7.85463 2.64340 -126.50791 957.97750
3280.0000 -134.00755 -127.01600 6.99155 2.67738 -126.01054 976.38761
3285.0000 -134.11028 -126.92589 7.18438 2.59239 -127.25456 944.31377
3290.0000 -134.53656 -127.60432 6.93225 2.56117 -127.71161 933.49076
3295.0000 -135.69204 -128.81733 6.87471 2.51752 -128.35045 866.03712
3300.0000 -134.15539 -128.93200 5.22339 2.47636 -128.95301 856.41777
3305.0000 -135.04835 -127.26620 7.78215 2.50838 -128.48422 850.23105
3310.0000 -134.16184 -128.06617 6.09567 2.55799 -127.75815 882.76451
3315.0000 -134.60708 -129.09544 5.51163 2.46319 -129.14575 815.40303
3320.0000 -133.20036 -128.07095 5.12941 2.51856 -128.33524 857.76916
3325.0000 -133.00831 -125.41618 7.59213 2.62599 -126.76285 948.27847
3330.0000 -134.79455 -128.08287 6.71168 2.70613 -125.58976 1032.33441
3335.0000 -135.36225 -128.80072 6.56154 2.55197 -127.84625 915.29319
3340.0000 -134.95296 -128.19850 6.75446 2.52841 -128.19116 877.50279
3345.0000 -133.74146 -127.12984 6.61162 2.59692 -127.18832 959.12342
3350.0000 -133.12564 -127.46464 5.66100 2.59944 -127.15143 919.28646
3355.0000 -133.52873 -125.82608 7.70265 2.64572 -126.47395 943.91826
3360.0000 -132.96595 -125.81788 7.14807 2.65357 -126.35909 940.38238
3365.0000 -132.51949 -125.32753 7.19196 2.71006 -125.53227 973.13803
3370.0000 -135.47230 -127.85852 7.61378 2.70595 -125.59242 985.63202
3375.0000 -132.72624 -126.01663 6.70961 2.57406 -127.52295 891.37985
3380.0000 -133.87932 -127.29778 6.58153 2.60711 -127.03911 927.58102
3385.0000 -133.54051 -126.51596 7.02455 2.63245 -126.66828 935.85503
3390.0000 -133.30775 -125.27462 8.03313 2.67998 -125.97248 975.22643
3395.0000 -135.35333 -128.99385 6.35947 2.55786 -127.75998 909.04836
3400.0000 -133.81625 -126.38750 7.42875 2.59165 -127.26545 915.64344
3405.0000 -133.53330 -127.11640 6.41690 2.60517 -127.06752 919.54847
3410.0000 -131.83864 -124.44061 7.39803 2.67217 -126.08678 983.68523
3415.0000 -134.43111 -127.75885 6.67225 2.66129 -126.24613 982.38211
3420.0000 -133.18790 -126.19969 6.98822 2.67964 -125.97746 977.01113
3425.0000 -135.48825 -127.59038 7.89787 2.61920 -126.86212 944.56596
3430.0000 -133.38036 -126.62913 6.75123 2.57271 -127.54272 916.03557
3435.0000 -132.83773 -125.44419 7.39354 2.64393 -126.50027 948.13271
3440.0000 -133.10699 -126.72365 6.38334 2.67263 -126.08016 967.83062
3445.0000 -133.71676 -127.91976 5.79699 2.63517 -126.62836 945.57320
3450.0000 -135.75190 -129.24487 6.50702 2.53408 -128.10817 873.15417
3455.0000 -133.23394 -125.22548 8.00846 2.61977 -126.85388 955.04801
3460.0000 -132.01648 -125.39696 6.61952 2.71069 -125.52296 986.30732
3465.0000 -131.13867 -124.64662 6.49205 2.74057 -125.08567 1045.08606
3470.0000 -134.32202 -125.80739 8.51463 2.70065 -125.66999 1027.74749
3475.0000 -133.27586 -125.26913 8.00673 2.75123 -124.92956 1041.89156
3480.0000 -132.98770 -125.56690 7.42080 2.71658 -125.43674 1007.65748
3485.0000 -134.13326 -126.94608 7.18717 2.63983 -126.56018 965.30962
3490.0000 -134.51662 -128.49405 6.02257 2.58497 -127.36327 908.37509
3495.0000 -134.99084 -128.17161 6.81923 2.47341 -128.99621 837.90219
3500.0000 -134.12326 -128.95634 5.16692 2.53747 -128.05847 857.48825
FREEZING PROCESS: loop number 15 T-loop= 916.00000000000000
main_MD> interactions number 15 at Temperature= 916.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.63082 -1.78128 -1.47038
force_rgl> df(natom) -0.54292 1.86970 -2.70765
3505.0000 -134.40649 -127.43591 6.97058 2.54521 -127.94514 866.02079
3510.0000 -133.83505 -127.75171 6.08334 2.56753 -127.61843 904.97858
3515.0000 -134.62022 -127.81539 6.80483 2.57516 -127.50681 921.77010
3520.0000 -134.61003 -129.06243 5.54759 2.50411 -128.54685 864.48558
3525.0000 -134.51739 -127.25968 7.25772 2.54947 -127.88278 918.57899
3530.0000 -134.51703 -128.53455 5.98248 2.53489 -128.09626 878.50913
3535.0000 -133.89187 -128.81395 5.07791 2.49041 -128.74736 840.43166
3540.0000 -133.84681 -127.91788 5.92893 2.48345 -128.84916 833.09282
3545.0000 -132.16401 -125.18398 6.98003 2.63908 -126.57127 941.00643
3550.0000 -133.28025 -125.32721 7.95304 2.68896 -125.84105 997.48624
3555.0000 -132.72407 -125.60665 7.11743 2.71909 -125.40010 1022.60050
3560.0000 -131.79684 -125.03658 6.76026 2.73975 -125.09773 1008.50652
3565.0000 -133.68782 -125.30448 8.38334 2.76944 -124.66316 1016.86446
3570.0000 -132.94665 -125.19139 7.75526 2.64541 -126.47858 968.91593
3575.0000 -134.15916 -127.19263 6.96653 2.64311 -126.51226 945.08031
3580.0000 -133.99178 -127.19149 6.80028 2.65000 -126.41137 964.92714
3585.0000 -134.91175 -127.69059 7.22115 2.60000 -127.14319 933.68243
3590.0000 -134.98015 -129.65292 5.32723 2.50563 -128.52453 862.27023
3595.0000 -134.32260 -127.25670 7.06589 2.43446 -129.56624 788.82452
3600.0000 -132.14212 -125.90589 6.23622 2.66610 -126.17573 1001.84313
3605.0000 -131.18921 -124.54259 6.64662 2.71896 -125.40199 972.26541
3610.0000 -133.37965 -126.97701 6.40265 2.68863 -125.84594 969.43293
3615.0000 -133.65621 -126.28361 7.37260 2.65708 -126.30778 981.92656
3620.0000 -134.70365 -127.40955 7.29410 2.65227 -126.37812 984.33808
3625.0000 -134.47542 -127.03491 7.44052 2.56331 -127.68029 909.30564
3630.0000 -134.58414 -127.48408 7.10006 2.59753 -127.17937 909.43841
3635.0000 -133.64046 -126.80626 6.83420 2.57504 -127.50859 908.29382
3640.0000 -134.02779 -127.50004 6.52775 2.61087 -126.98412 869.23102
3645.0000 -133.36730 -126.93298 6.43432 2.58218 -127.40401 901.99396
3650.0000 -134.02747 -127.46692 6.56055 2.60079 -127.13163 903.41827
3655.0000 -132.99089 -127.08292 5.90797 2.65408 -126.35157 951.80027
3660.0000 -133.71290 -127.98257 5.73034 2.55857 -127.74971 888.55303
3665.0000 -132.54658 -126.46929 6.07729 2.58798 -127.31921 906.62044
3670.0000 -132.46022 -125.83857 6.62165 2.60839 -127.02043 892.76618
3675.0000 -134.05423 -126.93242 7.12181 2.64609 -126.46865 958.02939
3680.0000 -135.14138 -129.55813 5.58325 2.53921 -128.03297 883.22463
3685.0000 -134.46544 -128.17404 6.29140 2.46687 -129.09190 796.13351
3690.0000 -135.05096 -128.27463 6.77633 2.51383 -128.40458 809.29704
3695.0000 -134.39795 -128.56248 5.83547 2.51094 -128.44676 862.01027
3700.0000 -133.91416 -128.02572 5.88845 2.54349 -127.97041 879.35909
3705.0000 -134.50433 -127.94404 6.56029 2.55228 -127.84169 900.33594
3710.0000 -133.88886 -127.41356 6.47529 2.56353 -127.67701 853.33645
3715.0000 -132.68233 -126.60886 6.07347 2.58768 -127.32358 922.24018
3720.0000 -134.32494 -128.54312 5.78182 2.53721 -128.06231 881.71226
3725.0000 -134.93472 -129.45255 5.48217 2.44372 -129.43078 837.15991
3730.0000 -135.51102 -127.82637 7.68465 2.48019 -128.89694 841.70350
3735.0000 -134.59925 -128.78282 5.81643 2.50920 -128.47230 880.35737
3740.0000 -133.43577 -126.17634 7.25943 2.59151 -127.26750 917.28545
3745.0000 -131.40195 -124.67245 6.72950 2.75318 -124.90115 1035.57669
3750.0000 -133.01230 -126.02518 6.98712 2.75949 -124.80879 1065.45129
FREEZING PROCESS: loop number 16 T-loop= 891.00000000000000
main_MD> interactions number 16 at Temperature= 891.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.69371 2.85871 3.28985
force_rgl> df(natom) 0.42115 1.77479 0.26611
3755.0000 -134.41948 -127.80407 6.61541 2.59182 -127.26291 907.65417
3760.0000 -134.33968 -126.55161 7.78808 2.54914 -127.88765 895.35789
3765.0000 -132.40123 -125.56448 6.83675 2.66189 -126.23731 978.60492
3770.0000 -134.15641 -126.99743 7.15897 2.62291 -126.80790 928.17640
3775.0000 -134.43987 -127.91710 6.52277 2.54871 -127.89390 894.24014
3780.0000 -132.93172 -126.88268 6.04905 2.56869 -127.60150 918.02295
3785.0000 -133.44262 -126.78454 6.65809 2.62793 -126.73445 964.51988
3790.0000 -135.11662 -128.16421 6.95241 2.59763 -127.17793 910.34805
3795.0000 -134.96161 -127.54572 7.41589 2.51159 -128.43734 862.05463
3800.0000 -133.66083 -127.06278 6.59805 2.62440 -126.78611 941.77839
3805.0000 -133.60375 -127.23090 6.37285 2.59312 -127.24389 905.07009
3810.0000 -134.48591 -127.89009 6.59582 2.53711 -128.06372 849.31935
3815.0000 -133.94098 -127.74182 6.19916 2.57720 -127.47694 917.99077
3820.0000 -132.83501 -126.96821 5.86681 2.56627 -127.63699 884.29095
3825.0000 -133.68579 -127.07560 6.61019 2.58139 -127.41556 903.25490
3830.0000 -135.45803 -129.31219 6.14584 2.53463 -128.10006 880.09705
3835.0000 -134.56341 -127.58398 6.97943 2.52355 -128.26217 877.15610
3840.0000 -132.66256 -126.55836 6.10420 2.67449 -126.05296 987.26242
3845.0000 -133.91246 -127.39070 6.52176 2.58321 -127.38902 918.99610
3850.0000 -134.53237 -128.67586 5.85651 2.52830 -128.19269 900.65759
3855.0000 -134.21984 -126.90260 7.31723 2.52772 -128.20120 873.39995
3860.0000 -133.18906 -127.25749 5.93157 2.54468 -127.95298 890.88695
3865.0000 -134.83937 -126.46205 8.37732 2.62681 -126.75080 955.43888
3870.0000 -133.28115 -126.75190 6.52925 2.65094 -126.39755 969.92215
3875.0000 -133.11754 -126.55693 6.56060 2.62063 -126.84124 912.02296
3880.0000 -131.61029 -125.79398 5.81631 2.69715 -125.72121 958.46730
3885.0000 -132.49536 -125.18412 7.31124 2.67193 -126.09035 966.30239
3890.0000 -133.05298 -126.21594 6.83703 2.67652 -126.02317 997.80635
3895.0000 -133.76806 -126.68222 7.08584 2.66790 -126.14929 959.64751
3900.0000 -135.65471 -129.07209 6.58262 2.55206 -127.84488 894.93479
3905.0000 -134.40056 -128.58276 5.81780 2.50833 -128.48496 868.89804
3910.0000 -134.92214 -128.90509 6.01705 2.47825 -128.92537 815.67578
3915.0000 -134.65751 -128.56581 6.09170 2.52686 -128.21378 880.29575
3920.0000 -135.13708 -128.39019 6.74689 2.51963 -128.31957 880.43894
3925.0000 -134.87730 -128.75070 6.12660 2.50799 -128.49006 875.31728
3930.0000 -135.24866 -129.50563 5.74303 2.46357 -129.14020 820.46427
3935.0000 -136.04782 -130.43100 5.61682 2.40273 -130.03067 766.13467
3940.0000 -134.76011 -128.78836 5.97175 2.42732 -129.67084 795.42814
3945.0000 -133.28656 -126.66921 6.61735 2.58710 -127.33204 919.83588
3950.0000 -132.92679 -127.37699 5.54981 2.59064 -127.28021 917.00799
3955.0000 -134.73270 -127.98683 6.74587 2.51186 -128.43329 826.30357
3960.0000 -134.08248 -126.34781 7.73467 2.56458 -127.66163 899.24045
3965.0000 -133.36330 -126.83334 6.52996 2.62980 -126.70699 934.29580
3970.0000 -133.45322 -126.43486 7.01836 2.61404 -126.93771 944.90153
3975.0000 -134.69664 -128.43256 6.26408 2.62291 -126.80791 894.95255
3980.0000 -134.02274 -127.85693 6.16581 2.50363 -128.55380 820.85769
3985.0000 -133.17755 -127.69855 5.47899 2.58402 -127.37718 907.04972
3990.0000 -132.85543 -126.83920 6.01622 2.57425 -127.52010 906.74178
3995.0000 -133.70024 -126.95072 6.74952 2.58614 -127.34608 917.62789
4000.0000 -132.43269 -126.53861 5.89409 2.62959 -126.71005 900.55258
FREEZING PROCESS: loop number 17 T-loop= 866.00000000000000
main_MD> interactions number 17 at Temperature= 866.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.34840 -5.74864 -1.05118
force_rgl> df(natom) -0.60364 2.37192 -1.54441
4005.0000 -134.12617 -126.81356 7.31261 2.65951 -126.27218 945.79400
4010.0000 -134.85732 -128.02860 6.82871 2.61950 -126.85786 925.78135
4015.0000 -134.46682 -127.89776 6.56906 2.47523 -128.96944 843.99405
4020.0000 -134.92925 -128.56939 6.35987 2.52961 -128.17354 841.95103
4025.0000 -134.01600 -128.73578 5.28022 2.50532 -128.52906 829.74802
4030.0000 -136.16594 -130.00722 6.15872 2.48596 -128.81251 834.13676
4035.0000 -134.81342 -127.93971 6.87371 2.47813 -128.92706 833.60153
4040.0000 -133.94376 -127.30587 6.63788 2.55217 -127.84328 870.47000
4045.0000 -134.96732 -129.22688 5.74044 2.53950 -128.02879 875.26600
4050.0000 -134.73498 -128.89495 5.84003 2.44813 -129.36611 808.07365
4055.0000 -133.70707 -127.61917 6.08790 2.54546 -127.94156 890.26844
4060.0000 -133.75769 -127.50716 6.25053 2.57235 -127.54801 935.87162
4065.0000 -134.70410 -128.90109 5.80301 2.53168 -128.14321 868.05348
4070.0000 -135.18013 -127.95448 7.22565 2.47711 -128.94201 829.57684
4075.0000 -133.99066 -127.67056 6.32010 2.60162 -127.11957 952.47732
4080.0000 -134.54452 -127.37807 7.16645 2.58098 -127.42160 922.49590
4085.0000 -133.77909 -126.44115 7.33794 2.63030 -126.69975 941.45781
4090.0000 -134.13609 -126.00047 8.13562 2.57126 -127.56393 891.30019
4095.0000 -132.43333 -126.45811 5.97522 2.70114 -125.66279 1019.24091
4100.0000 -134.27173 -127.69336 6.57837 2.63779 -126.59004 948.51012
4105.0000 -132.70352 -125.39068 7.31284 2.65429 -126.34859 932.49328
4110.0000 -133.54447 -128.24379 5.30068 2.62476 -126.78086 947.42963
4115.0000 -134.94363 -128.68204 6.26160 2.55381 -127.81930 875.43056
4120.0000 -134.21604 -128.73462 5.48142 2.46245 -129.15661 853.63161
4125.0000 -134.31222 -128.09522 6.21700 2.46910 -129.05918 807.54587
4130.0000 -135.66757 -130.32312 5.34446 2.44793 -129.36904 824.71333
4135.0000 -135.52560 -130.24231 5.28330 2.38831 -130.24172 772.22880
4140.0000 -135.71485 -130.09442 5.62043 2.42496 -129.70535 772.77060
4145.0000 -134.94001 -129.77893 5.16108 2.41726 -129.81801 765.27952
4150.0000 -135.15660 -129.98467 5.17193 2.40732 -129.96358 770.86712
4155.0000 -133.49216 -126.95565 6.53652 2.54885 -127.89184 893.48757
4160.0000 -134.47795 -127.39172 7.08623 2.64322 -126.51062 950.13646
4165.0000 -134.37529 -128.01648 6.35882 2.57414 -127.52173 905.81259
4170.0000 -135.37812 -129.03430 6.34382 2.49019 -128.75050 855.27477
4175.0000 -134.73393 -129.41553 5.31840 2.46969 -129.05066 830.92427
4180.0000 -134.93915 -127.85783 7.08132 2.46259 -129.15449 822.93168
4185.0000 -132.15412 -126.16064 5.99348 2.59465 -127.22158 905.59179
4190.0000 -132.65267 -127.18148 5.47119 2.62975 -126.70771 909.53812
4195.0000 -133.55020 -127.43677 6.11343 2.54722 -127.91573 864.04115
4200.0000 -133.04052 -127.09362 5.94690 2.59927 -127.15385 901.62730
4205.0000 -133.48326 -126.64814 6.83512 2.61241 -126.96152 962.01321
4210.0000 -132.57277 -126.20686 6.36591 2.66161 -126.24144 947.59094
4215.0000 -133.07629 -125.73146 7.34483 2.71938 -125.39586 1003.62960
4220.0000 -133.08384 -126.72267 6.36117 2.67573 -126.03475 968.74506
4225.0000 -133.40314 -127.58221 5.82093 2.61318 -126.95026 876.71468
4230.0000 -132.69049 -127.56871 5.12178 2.55869 -127.74796 882.03182
4235.0000 -134.31747 -127.29577 7.02170 2.54399 -127.96298 896.44333
4240.0000 -133.74800 -126.24293 7.50507 2.63274 -126.66402 910.81813
4245.0000 -133.02940 -127.08793 5.94147 2.63725 -126.59798 934.32808
4250.0000 -134.68421 -128.65350 6.03071 2.50137 -128.58688 813.46302
FREEZING PROCESS: loop number 18 T-loop= 841.00000000000000
main_MD> interactions number 18 at Temperature= 841.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.59928 -5.29839 2.23099
force_rgl> df(natom) -1.50907 -1.46229 -0.09693
4255.0000 -135.74660 -129.62196 6.12464 2.45167 -129.31439 809.07681
4260.0000 -135.99948 -129.51489 6.48459 2.44077 -129.47395 807.36122
4265.0000 -134.83130 -129.45205 5.37925 2.49938 -128.61602 845.23006
4270.0000 -135.90113 -129.86144 6.03969 2.47200 -129.01683 806.33952
4275.0000 -135.82055 -129.92244 5.89811 2.39074 -130.20625 761.98064
4280.0000 -135.76271 -128.72442 7.03829 2.44247 -129.44899 808.40525
4285.0000 -135.21919 -128.10412 7.11506 2.53202 -128.13832 887.49962
4290.0000 -133.35732 -128.69328 4.66403 2.51391 -128.40328 848.90597
4295.0000 -133.34674 -127.62151 5.72523 2.57581 -127.49736 888.78745
4300.0000 -133.37281 -127.89077 5.48204 2.58338 -127.38645 884.31896
4305.0000 -134.70349 -128.86343 5.84006 2.52212 -128.28324 837.20792
4310.0000 -134.01046 -128.15822 5.85223 2.53155 -128.14508 871.83294
4315.0000 -134.84762 -128.52088 6.32674 2.55111 -127.85881 879.00900
4320.0000 -134.85565 -127.52601 7.32963 2.52282 -128.27288 859.26983
4325.0000 -135.76602 -129.15951 6.60652 2.51090 -128.44743 844.91504
4330.0000 -135.15117 -130.19907 4.95211 2.43426 -129.56920 785.73387
4335.0000 -134.49843 -128.29772 6.20071 2.45932 -129.20240 802.64237
4340.0000 -134.76336 -128.90080 5.86256 2.52013 -128.31231 880.28922
4345.0000 -134.31922 -126.75235 7.56687 2.52818 -128.19449 871.41926
4350.0000 -134.17230 -128.24938 5.92292 2.58332 -127.38740 864.57631
4355.0000 -134.68083 -128.36333 6.31750 2.49126 -128.73481 838.03665
4360.0000 -134.14943 -129.57906 4.57038 2.50022 -128.60367 864.45786
4365.0000 -135.24496 -129.05710 6.18786 2.48275 -128.85944 826.14085
4370.0000 -134.41503 -127.02992 7.38510 2.62997 -126.70455 924.79002
4375.0000 -134.41071 -128.19828 6.21244 2.59988 -127.14502 894.45552
4380.0000 -135.25891 -129.43219 5.82672 2.46248 -129.15617 823.89622
4385.0000 -135.12241 -128.92992 6.19248 2.42043 -129.77163 772.34044
4390.0000 -134.90711 -127.97047 6.93663 2.53678 -128.06852 847.23471
4395.0000 -133.97594 -128.28599 5.68996 2.47007 -129.04498 823.51695
4400.0000 -135.92446 -130.77724 5.14722 2.46213 -129.16132 830.49890
4405.0000 -136.36893 -130.29277 6.07616 2.37233 -130.47564 775.04760
4410.0000 -135.05207 -129.24600 5.80606 2.41872 -129.79667 760.65220
4415.0000 -136.01845 -129.60761 6.41085 2.42241 -129.74269 783.30286
4420.0000 -135.40092 -128.88930 6.51162 2.46682 -129.09259 864.73993
4425.0000 -133.46986 -128.05123 5.41863 2.52234 -128.27994 842.31814
4430.0000 -134.44604 -128.06042 6.38562 2.58478 -127.36606 897.48898
4435.0000 -134.60571 -128.20963 6.39608 2.51080 -128.44885 881.39101
4440.0000 -134.15149 -126.17871 7.97279 2.58342 -127.38593 925.93266
4445.0000 -133.84534 -126.67892 7.16642 2.72869 -125.25962 1009.41021
4450.0000 -133.68164 -126.83538 6.84626 2.64920 -126.42304 956.05171
4455.0000 -135.09287 -129.09467 5.99820 2.57547 -127.50222 909.08383
4460.0000 -135.45540 -128.47579 6.97961 2.46713 -129.08808 835.48338
4465.0000 -134.78038 -129.10599 5.67438 2.47112 -129.02962 832.53091
4470.0000 -135.72775 -129.07345 6.65429 2.51230 -128.42683 833.81229
4475.0000 -134.90517 -129.52110 5.38407 2.44173 -129.45986 784.26726
4480.0000 -134.36370 -129.64920 4.71450 2.43550 -129.55108 800.99434
4485.0000 -134.95309 -130.39078 4.56232 2.38979 -130.22016 777.64395
4490.0000 -134.21470 -127.00676 7.20795 2.47253 -129.00897 830.20808
4495.0000 -134.49125 -128.65582 5.83543 2.55030 -127.87064 911.27736
4500.0000 -135.95208 -128.77422 7.17785 2.52336 -128.26495 860.02817
FREEZING PROCESS: loop number 19 T-loop= 816.00000000000000
main_MD> interactions number 19 at Temperature= 816.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.27674 -0.92851 0.32916
force_rgl> df(natom) 3.16546 -0.95461 0.13434
4505.0000 -136.59690 -129.08991 7.50699 2.43317 -129.58513 810.78954
4510.0000 -136.06546 -131.09361 4.97185 2.37668 -130.41198 743.48951
4515.0000 -136.18630 -131.66751 4.51879 2.33266 -131.05635 706.66983
4520.0000 -136.11426 -130.41860 5.69566 2.35022 -130.79931 749.31823
4525.0000 -134.86876 -130.14751 4.72125 2.38367 -130.30968 749.20720
4530.0000 -134.95829 -128.75482 6.20348 2.41366 -129.87075 780.51587
4535.0000 -133.95096 -127.81697 6.13398 2.50040 -128.60105 833.21577
4540.0000 -135.02307 -128.49315 6.52992 2.57920 -127.44769 906.00420
4545.0000 -135.60182 -130.54420 5.05762 2.46749 -129.08275 829.47199
4550.0000 -136.50290 -130.60430 5.89860 2.35305 -130.75784 763.72474
4555.0000 -134.44700 -129.40285 5.04415 2.42096 -129.76381 798.36681
4560.0000 -134.68498 -128.58670 6.09828 2.49102 -128.73839 838.66545
4565.0000 -135.01226 -129.42610 5.58616 2.41982 -129.78061 790.43319
4570.0000 -135.17187 -129.02930 6.14257 2.47350 -128.99480 820.12769
4575.0000 -133.99017 -128.60448 5.38568 2.48714 -128.79515 833.74857
4580.0000 -134.51583 -128.91351 5.60232 2.45862 -129.21268 808.46582
4585.0000 -134.12995 -128.31000 5.81995 2.49152 -128.73105 844.54884
4590.0000 -135.18421 -128.69006 6.49415 2.50373 -128.55242 855.29959
4595.0000 -135.64425 -128.07060 7.57365 2.47091 -129.03272 839.16172
4600.0000 -135.13483 -129.41313 5.72170 2.48099 -128.88520 855.51559
4605.0000 -135.93988 -130.01425 5.92563 2.41090 -129.91107 790.79544
4610.0000 -135.01601 -130.09499 4.92103 2.41401 -129.86563 815.58329
4615.0000 -135.80490 -129.68314 6.12176 2.40645 -129.97622 812.25806
4620.0000 -135.61636 -130.01961 5.59675 2.39983 -130.07316 759.97900
4625.0000 -134.75452 -128.87888 5.87564 2.44534 -129.40699 798.73286
4630.0000 -135.39671 -129.29966 6.09704 2.48334 -128.85086 834.51764
4635.0000 -134.80340 -128.56414 6.23926 2.50317 -128.56056 854.65288
4640.0000 -134.19511 -127.75853 6.43658 2.54289 -127.97910 895.68277
4645.0000 -135.39541 -128.65821 6.73720 2.49055 -128.74527 857.73616
4650.0000 -134.61518 -129.64174 4.97344 2.44621 -129.39433 810.95662
4655.0000 -136.28534 -130.77145 5.51389 2.37971 -130.36764 760.57243
4660.0000 -135.76445 -130.87592 4.88852 2.36400 -130.59762 742.91758
4665.0000 -135.82588 -130.13400 5.69188 2.36380 -130.60049 748.10706
4670.0000 -135.04605 -128.93900 6.10705 2.48486 -128.82856 839.28803
4675.0000 -135.38964 -129.36351 6.02613 2.43910 -129.49829 799.54922
4680.0000 -136.27624 -130.43017 5.84608 2.47488 -128.97458 837.26344
4685.0000 -136.44588 -130.35251 6.09337 2.34563 -130.86649 758.76605
4690.0000 -135.81585 -129.37256 6.44329 2.43167 -129.60716 794.01264
4695.0000 -135.13780 -129.11501 6.02279 2.45802 -129.22140 805.15587
4700.0000 -136.58710 -130.39480 6.19231 2.44754 -129.37478 823.95346
4705.0000 -134.39450 -127.13187 7.26264 2.48354 -128.84783 807.81184
4710.0000 -135.10367 -128.59676 6.50691 2.51955 -128.32072 870.90750
4715.0000 -135.79514 -128.96232 6.83281 2.47815 -128.92677 835.04513
4720.0000 -136.14917 -129.31256 6.83661 2.45267 -129.29977 840.40676
4725.0000 -134.18002 -128.84798 5.33204 2.48798 -128.78289 835.92705
4730.0000 -132.24692 -126.21391 6.03301 2.51854 -128.33555 893.99354
4735.0000 -134.62511 -128.18270 6.44241 2.56546 -127.64873 886.75990
4740.0000 -134.94063 -129.18087 5.75976 2.46868 -129.06541 825.21240
4745.0000 -135.10020 -129.51611 5.58410 2.47910 -128.91279 846.34446
4750.0000 -134.93157 -129.73115 5.20042 2.44307 -129.44020 787.38469
FREEZING PROCESS: loop number 20 T-loop= 791.00000000000000
main_MD> interactions number 20 at Temperature= 791.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -4.82014 -1.40589 -2.06805
force_rgl> df(natom) 2.47738 -0.72179 -0.30333
4755.0000 -135.43667 -130.07542 5.36124 2.43147 -129.61009 806.16859
4760.0000 -134.41353 -129.40752 5.00600 2.44573 -129.40136 800.29607
4765.0000 -134.48292 -128.73059 5.75232 2.49684 -128.65326 829.75879
4770.0000 -135.06660 -129.31585 5.75075 2.49437 -128.68940 834.95247
4775.0000 -136.59604 -130.21643 6.37960 2.44828 -129.36391 797.24624
4780.0000 -136.64350 -130.10407 6.53943 2.39889 -130.08695 794.06013
4785.0000 -135.85797 -129.62561 6.23236 2.37307 -130.46480 795.59140
4790.0000 -135.11163 -128.82164 6.28999 2.48358 -128.84725 839.15998
4795.0000 -134.89544 -128.84277 6.05267 2.44303 -129.44081 807.20658
4800.0000 -135.60682 -129.66533 5.94149 2.46121 -129.17474 796.08661
4805.0000 -134.92255 -129.31049 5.61206 2.42774 -129.66465 796.47949
4810.0000 -135.57736 -129.61485 5.96251 2.45982 -129.19505 813.32042
4815.0000 -135.78314 -130.46431 5.31883 2.39842 -130.09375 786.84230
4820.0000 -134.02730 -129.37942 4.64788 2.42918 -129.64348 781.08656
4825.0000 -135.19046 -129.86758 5.32288 2.40444 -130.00565 729.80403
4830.0000 -135.59725 -129.39516 6.20209 2.39470 -130.14831 723.91297
4835.0000 -134.34779 -128.53753 5.81026 2.47475 -128.97649 822.57619
4840.0000 -133.67603 -127.91526 5.76077 2.52308 -128.26917 847.52337
4845.0000 -134.05452 -127.45861 6.59591 2.52794 -128.19801 869.53747
4850.0000 -134.93243 -129.39083 5.54160 2.54263 -127.98295 867.07398
4855.0000 -136.25567 -129.68222 6.57344 2.44973 -129.34283 810.91142
4860.0000 -135.25224 -129.04121 6.21104 2.42293 -129.73497 797.17745
4865.0000 -134.30707 -127.81541 6.49166 2.45511 -129.26407 834.01849
4870.0000 -134.91154 -128.92462 5.98691 2.51780 -128.34642 844.88615
4875.0000 -135.35206 -130.05325 5.29881 2.42599 -129.69024 801.40810
4880.0000 -135.79817 -129.68682 6.11135 2.43068 -129.62164 807.83786
4885.0000 -135.37702 -129.58268 5.79434 2.41820 -129.80426 801.32228
4890.0000 -135.59170 -129.18802 6.40368 2.40763 -129.95899 805.78721
4895.0000 -136.83231 -132.16977 4.66254 2.35792 -130.68664 769.15352
4900.0000 -135.67166 -130.22623 5.44543 2.32741 -131.13318 732.79481
4905.0000 -136.75800 -131.60860 5.14940 2.35721 -130.69698 752.61811
4910.0000 -135.63661 -130.01670 5.61991 2.31479 -131.31795 705.22116
4915.0000 -136.31411 -130.56516 5.74895 2.37906 -130.37714 740.08125
4920.0000 -136.07806 -129.78129 6.29677 2.39747 -130.10773 799.79567
4925.0000 -136.41060 -130.92096 5.48963 2.38030 -130.35902 781.33212
4930.0000 -135.97025 -130.16923 5.80103 2.38884 -130.23395 765.47968
4935.0000 -135.73628 -128.99207 6.74420 2.44396 -129.42722 815.26484
4940.0000 -134.24076 -128.77643 5.46434 2.46611 -129.10295 788.00755
4945.0000 -135.38044 -129.30310 6.07734 2.46082 -129.18040 806.37049
4950.0000 -136.25002 -128.66574 7.58427 2.46291 -129.14983 833.38753
4955.0000 -134.84111 -128.65653 6.18458 2.49772 -128.64034 868.56790
4960.0000 -136.75235 -131.17001 5.58234 2.43465 -129.56347 825.44833
4965.0000 -135.53815 -129.58812 5.95003 2.40837 -129.94812 789.49539
4970.0000 -134.79731 -129.79907 4.99823 2.43354 -129.57976 790.88551
4975.0000 -135.45582 -130.50078 4.95504 2.40405 -130.01138 796.72344
4980.0000 -136.81037 -131.75216 5.05821 2.32531 -131.16391 696.88620
4985.0000 -137.06127 -131.16165 5.89961 2.31637 -131.29485 719.91530
4990.0000 -136.54968 -130.66077 5.88891 2.36772 -130.54318 759.27764
4995.0000 -136.42359 -130.77628 5.64731 2.34449 -130.88314 760.63272
5000.0000 -136.82341 -131.40876 5.41465 2.34252 -130.91204 749.70544
FREEZING PROCESS: loop number 21 T-loop= 766.00000000000000
main_MD> interactions number 21 at Temperature= 766.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.39748 0.66048 -0.31302
force_rgl> df(natom) 1.62078 1.59903 -0.54230
5005.0000 -136.39426 -130.79382 5.60045 2.29485 -131.60971 715.74402
5010.0000 -136.80608 -130.82726 5.97882 2.38074 -130.35263 744.91822
5015.0000 -136.98909 -131.28074 5.70835 2.35157 -130.77956 728.07511
5020.0000 -136.14911 -130.09108 6.05803 2.30282 -131.49304 731.86339
5025.0000 -136.04601 -130.14849 5.89752 2.33624 -131.00394 731.13612
5030.0000 -134.62564 -128.95624 5.66940 2.39070 -130.20676 806.48876
5035.0000 -136.25493 -129.99080 6.26413 2.42849 -129.65361 809.42944
5040.0000 -137.79549 -132.03502 5.76047 2.34453 -130.88260 717.18089
5045.0000 -136.28294 -131.23092 5.05202 2.26405 -132.06055 673.27602
5050.0000 -135.81918 -130.91814 4.90103 2.32258 -131.20395 726.77513
5055.0000 -136.43426 -130.37456 6.05970 2.38238 -130.32850 757.35189
5060.0000 -133.45905 -127.99467 5.46437 2.51573 -128.37671 860.71611
5065.0000 -135.20249 -129.06434 6.13815 2.52856 -128.18889 868.22744
5070.0000 -135.45443 -129.08825 6.36617 2.43293 -129.58869 815.40780
5075.0000 -136.41946 -131.22354 5.19593 2.42045 -129.77136 792.23771
5080.0000 -135.80828 -130.15029 5.65799 2.33180 -131.06892 663.46600
5085.0000 -134.83077 -129.24906 5.58171 2.42632 -129.68541 796.13224
5090.0000 -135.51658 -131.11776 4.39883 2.35924 -130.66724 733.71742
5095.0000 -135.51204 -130.22646 5.28558 2.35914 -130.66876 743.78742
5100.0000 -135.78161 -128.99269 6.78892 2.43115 -129.61477 780.57693
5105.0000 -134.68388 -129.57076 5.11312 2.42737 -129.67009 779.50986
5110.0000 -136.24665 -131.41493 4.83172 2.38762 -130.25194 739.75602
5115.0000 -137.12875 -132.37657 4.75218 2.30663 -131.43740 677.01084
5120.0000 -137.11093 -131.81083 5.30010 2.24588 -132.32659 684.70881
5125.0000 -135.66536 -129.74136 5.92400 2.34546 -130.86899 772.71411
5130.0000 -133.94933 -128.29680 5.65253 2.44406 -129.42582 774.09345
5135.0000 -135.94856 -130.22882 5.71975 2.42584 -129.69241 769.42171
5140.0000 -136.28067 -131.98497 4.29570 2.30587 -131.44848 677.90561
5145.0000 -136.52568 -131.90822 4.61747 2.30975 -131.39166 699.02299
5150.0000 -136.54057 -130.81360 5.72697 2.35174 -130.77706 740.07083
5155.0000 -136.10537 -130.92239 5.18298 2.33856 -130.96992 742.21228
5160.0000 -134.99851 -129.09705 5.90146 2.43479 -129.56138 796.08439
5165.0000 -135.99978 -131.21073 4.78905 2.41074 -129.91345 791.56638
5170.0000 -133.57223 -128.91724 4.65499 2.41788 -129.80892 803.86250
5175.0000 -136.52304 -131.33960 5.18345 2.37677 -130.41063 740.07617
5180.0000 -135.26869 -129.83668 5.43200 2.37953 -130.37032 751.92130
5185.0000 -136.17277 -130.02632 6.14645 2.46285 -129.15076 808.01466
5190.0000 -136.12474 -130.62540 5.49934 2.39311 -130.17157 747.14595
5195.0000 -134.39962 -128.93011 5.46951 2.39128 -130.19828 741.81728
5200.0000 -135.64038 -130.13901 5.50137 2.44083 -129.47298 799.75435
5205.0000 -136.34714 -130.14474 6.20241 2.38050 -130.35607 794.24368
5210.0000 -135.21866 -130.12376 5.09490 2.43099 -129.61705 809.14664
5215.0000 -135.99951 -130.94638 5.05313 2.38985 -130.21921 762.95857
5220.0000 -135.99805 -131.61842 4.37963 2.35891 -130.67206 721.19523
5225.0000 -136.44761 -130.40730 6.04031 2.33810 -130.97674 726.16098
5230.0000 -135.39443 -130.05667 5.33776 2.35854 -130.67748 736.53653
5235.0000 -135.33626 -129.84463 5.49163 2.42429 -129.71514 793.47950
5240.0000 -136.22333 -130.33750 5.88583 2.40330 -130.02231 775.30133
5245.0000 -136.29813 -130.16544 6.13269 2.38515 -130.28805 778.11071
5250.0000 -135.47122 -129.40242 6.06880 2.35722 -130.69685 750.10230
FREEZING PROCESS: loop number 22 T-loop= 741.00000000000000
main_MD> interactions number 22 at Temperature= 741.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.65227 -4.82542 -5.32383
force_rgl> df(natom) -1.19632 0.66481 -3.16445
5255.0000 -135.11853 -129.98758 5.13095 2.38738 -130.25531 787.02521
5260.0000 -135.88250 -130.37434 5.50817 2.38295 -130.32030 788.35197
5265.0000 -135.32772 -129.96662 5.36110 2.38754 -130.25310 790.06325
5270.0000 -135.76298 -129.18554 6.57744 2.44422 -129.42348 803.48116
5275.0000 -136.85503 -131.35985 5.49518 2.37459 -130.44256 756.24585
5280.0000 -136.24417 -130.36549 5.87868 2.29430 -131.61784 719.47266
5285.0000 -135.99405 -130.83099 5.16306 2.36836 -130.53373 740.73587
5290.0000 -135.54224 -130.20079 5.34145 2.33918 -130.96088 728.01471
5295.0000 -136.21300 -131.51539 4.69762 2.33130 -131.07621 702.37442
5300.0000 -137.34337 -131.08296 6.26041 2.33385 -131.03895 764.00819
5305.0000 -135.95621 -129.79215 6.16407 2.34943 -130.81087 768.26245
5310.0000 -136.13253 -129.58259 6.54994 2.41037 -129.91886 772.29124
5315.0000 -136.83040 -131.34193 5.48847 2.37249 -130.47337 769.05517
5320.0000 -134.56978 -129.66940 4.90038 2.37415 -130.44907 740.13592
5325.0000 -135.06741 -129.35498 5.71243 2.45707 -129.23532 803.32471
5330.0000 -135.14671 -129.83668 5.31003 2.40546 -129.99069 762.47911
5335.0000 -136.11543 -129.75649 6.35894 2.45105 -129.32348 832.90287
5340.0000 -135.91376 -131.04427 4.86950 2.37679 -130.41039 757.23844
5345.0000 -135.70658 -130.97797 4.72861 2.30678 -131.43513 701.07777
5350.0000 -137.26561 -132.17256 5.09306 2.27568 -131.89030 693.71325
5355.0000 -136.84228 -132.35107 4.49121 2.25539 -132.18731 663.19207
5360.0000 -136.95987 -131.64026 5.31961 2.30241 -131.49904 712.07725
5365.0000 -135.62313 -130.26358 5.35954 2.33865 -130.96859 749.87832
5370.0000 -135.41946 -129.90761 5.51185 2.40797 -129.95402 743.76778
5375.0000 -135.85022 -130.57094 5.27928 2.42193 -129.74974 798.10014
5380.0000 -135.69634 -129.62704 6.06930 2.40944 -129.93249 785.46031
5385.0000 -135.00200 -128.75742 6.24459 2.45540 -129.25969 791.44087
5390.0000 -135.71120 -129.78828 5.92292 2.43608 -129.54261 805.00855
5395.0000 -135.16962 -129.60174 5.56788 2.41867 -129.79741 778.33154
5400.0000 -136.03969 -130.05792 5.98177 2.38808 -130.24517 783.14321
5405.0000 -135.41193 -129.78881 5.62311 2.41850 -129.79992 777.46320
5410.0000 -135.40507 -129.87943 5.52564 2.42688 -129.67716 776.25645
5415.0000 -134.98552 -129.66076 5.32476 2.40045 -130.06409 755.87192
5420.0000 -136.41790 -130.90785 5.51005 2.41476 -129.85460 801.45235
5425.0000 -135.99163 -131.31345 4.67818 2.35020 -130.79964 751.96671
5430.0000 -136.88231 -130.79577 6.08654 2.32755 -131.13109 749.08446
5435.0000 -136.84955 -131.50358 5.34597 2.31809 -131.26963 733.59377
5440.0000 -137.29999 -131.78940 5.51059 2.26815 -132.00052 657.59572
5445.0000 -135.12307 -129.67066 5.45241 2.35635 -130.70964 751.43343
5450.0000 -135.14722 -129.76250 5.38472 2.37451 -130.44379 768.04122
5455.0000 -135.06587 -129.19159 5.87428 2.41802 -129.80695 784.36579
5460.0000 -137.02859 -131.03905 5.98954 2.42297 -129.73438 772.18753
5465.0000 -136.81700 -131.36484 5.45217 2.32579 -131.15685 727.27459
5470.0000 -135.21210 -130.61542 4.59668 2.38650 -130.26833 758.73112
5475.0000 -136.90653 -131.25005 5.65648 2.33649 -131.00027 729.14716
5480.0000 -136.05570 -130.43851 5.61719 2.35620 -130.71180 753.56692
5485.0000 -136.73596 -131.67376 5.06219 2.34420 -130.88736 706.70649
5490.0000 -136.23994 -130.52475 5.71519 2.33455 -131.02862 750.70121
5495.0000 -136.86474 -131.94963 4.91512 2.31441 -131.32342 724.18306
5500.0000 -136.37755 -131.49891 4.87865 2.27939 -131.83611 682.82181
FREEZING PROCESS: loop number 23 T-loop= 716.00000000000000
main_MD> interactions number 23 at Temperature= 716.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.51340 -2.27835 -0.69610
force_rgl> df(natom) 0.44664 0.77410 -1.67015
5505.0000 -134.27321 -129.83658 4.43663 2.32678 -131.14244 725.44280
5510.0000 -137.13719 -131.65999 5.47720 2.35741 -130.69410 757.72102
5515.0000 -137.27022 -131.88820 5.38202 2.31095 -131.37408 733.80336
5520.0000 -136.63312 -132.34715 4.28597 2.26960 -131.97942 707.19527
5525.0000 -135.38875 -129.85816 5.53060 2.33493 -131.02306 734.87112
5530.0000 -135.41814 -130.04549 5.37265 2.39900 -130.08536 767.07512
5535.0000 -137.08203 -130.70030 6.38172 2.36678 -130.55693 742.16678
5540.0000 -135.92956 -130.78675 5.14280 2.33604 -131.00681 739.82221
5545.0000 -135.40860 -130.53164 4.87696 2.35030 -130.79808 725.68443
5550.0000 -136.29540 -130.88983 5.40557 2.35694 -130.70092 742.86568
5555.0000 -136.25138 -131.79443 4.45695 2.35083 -130.79037 720.24910
5560.0000 -136.58388 -131.34975 5.23413 2.29795 -131.56443 697.55855
5565.0000 -135.01315 -130.35001 4.66314 2.37089 -130.49683 746.68927
5570.0000 -135.87824 -130.37559 5.50266 2.38473 -130.29415 746.30082
5575.0000 -135.99525 -130.43727 5.55798 2.36883 -130.52694 726.51691
5580.0000 -135.83782 -130.11683 5.72099 2.39971 -130.07492 762.39887
5585.0000 -135.53625 -130.17800 5.35826 2.39594 -130.13004 786.51161
5590.0000 -135.54770 -128.61281 6.93489 2.47133 -129.02653 819.92918
5595.0000 -135.64077 -130.13195 5.50882 2.39036 -130.21177 784.05851
5600.0000 -136.35261 -131.24811 5.10450 2.34341 -130.89892 746.85445
5605.0000 -135.50636 -130.22810 5.27827 2.35684 -130.70243 718.12533
5610.0000 -135.77768 -131.53874 4.23895 2.34324 -130.90154 725.81368
5615.0000 -137.65934 -133.38384 4.27550 2.17428 -133.37455 565.45852
5620.0000 -136.83915 -131.93638 4.90277 2.19194 -133.11604 621.25942
5625.0000 -137.15536 -132.12766 5.02770 2.25771 -132.15334 662.81431
5630.0000 -136.65633 -131.53064 5.12569 2.32716 -131.13681 704.81943
5635.0000 -136.88399 -131.11650 5.76749 2.25415 -132.20543 669.79372
5640.0000 -136.59022 -131.19000 5.40022 2.36457 -130.58924 763.78161
5645.0000 -135.71799 -130.30318 5.41481 2.33598 -131.00771 755.93680
5650.0000 -136.65680 -130.58909 6.06771 2.31252 -131.35116 699.66405
5655.0000 -136.13530 -129.78612 6.34919 2.36915 -130.52216 746.86372
5660.0000 -135.96908 -131.12772 4.84136 2.35839 -130.67972 731.89119
5665.0000 -137.34722 -131.71615 5.63107 2.32680 -131.14211 736.13183
5670.0000 -136.49022 -130.81043 5.67980 2.32175 -131.21602 726.68380
5675.0000 -136.38681 -130.65179 5.73502 2.36311 -130.61064 760.21247
5680.0000 -135.65272 -130.92411 4.72862 2.39974 -130.07441 785.67744
5685.0000 -136.48083 -131.43753 5.04329 2.29253 -131.64367 667.33991
5690.0000 -137.44898 -132.45261 4.99637 2.30979 -131.39106 690.20642
5695.0000 -137.27466 -131.90623 5.36843 2.24660 -132.31606 674.47927
5700.0000 -136.10244 -131.00224 5.10020 2.35500 -130.72937 756.98382
5705.0000 -136.43287 -131.63392 4.79895 2.32498 -131.16881 732.09056
5710.0000 -136.16567 -131.03215 5.13352 2.29470 -131.61203 705.19504
5715.0000 -136.94369 -131.25325 5.69044 2.34632 -130.85641 729.29807
5720.0000 -137.00589 -132.88986 4.11603 2.24216 -132.38099 662.50520
5725.0000 -135.96054 -129.77538 6.18515 2.30355 -131.48245 714.57706
5730.0000 -135.33265 -131.20939 4.12327 2.37392 -130.45244 741.76173
5735.0000 -136.67817 -131.89224 4.78593 2.33403 -131.03632 721.75906
5740.0000 -135.72489 -131.36298 4.36191 2.30293 -131.49148 685.95438
5745.0000 -136.91720 -131.85183 5.06537 2.35947 -130.66385 730.77694
5750.0000 -136.44679 -131.59223 4.85456 2.28725 -131.72107 709.81715
FREEZING PROCESS: loop number 24 T-loop= 691.00000000000000
main_MD> interactions number 24 at Temperature= 691.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.77203 2.67270 0.41601
force_rgl> df(natom) -0.80117 0.90896 1.92433
5755.0000 -137.87597 -131.90738 5.96859 2.30066 -131.52474 706.66303
5760.0000 -136.97572 -131.94332 5.03240 2.28414 -131.76655 706.37914
5765.0000 -136.94612 -132.27302 4.67311 2.24578 -132.32799 652.08662
5770.0000 -136.47680 -131.48263 4.99416 2.28142 -131.80641 701.23620
5775.0000 -135.68721 -130.59236 5.09485 2.27981 -131.82998 671.36092
5780.0000 -136.50601 -131.44550 5.06050 2.33017 -131.09276 712.64525
5785.0000 -137.69025 -131.58414 6.10611 2.27075 -131.96254 690.11048
5790.0000 -137.63816 -132.80262 4.83555 2.26653 -132.02436 688.78609
5795.0000 -136.56041 -131.99796 4.56245 2.25672 -132.16791 676.32187
5800.0000 -136.88929 -132.06727 4.82202 2.28405 -131.76787 689.71211
5805.0000 -137.31420 -132.39625 4.91795 2.22766 -132.59321 632.23825
5810.0000 -137.41148 -132.83176 4.57972 2.25358 -132.21391 675.87523
5815.0000 -137.55719 -132.04020 5.51699 2.24204 -132.38271 679.79878
5820.0000 -136.87063 -131.49730 5.37333 2.30523 -131.45781 740.31412
5825.0000 -137.36298 -131.24063 6.12235 2.30104 -131.51915 736.40327
5830.0000 -136.65284 -131.97291 4.67993 2.27247 -131.93742 664.66366
5835.0000 -136.62601 -131.14234 5.48367 2.27442 -131.90883 678.01118
5840.0000 -136.59760 -130.77660 5.82100 2.32364 -131.18839 736.55373
5845.0000 -136.74925 -131.82728 4.92197 2.31671 -131.28981 724.40627
5850.0000 -138.05397 -132.01227 6.04169 2.26960 -131.97935 713.33188
5855.0000 -137.74367 -133.40815 4.33552 2.23470 -132.49023 692.33942
5860.0000 -137.73137 -132.99009 4.74128 2.18716 -133.18598 629.37790
5865.0000 -136.51954 -131.83442 4.68512 2.24564 -132.33001 677.72121
5870.0000 -136.37731 -130.81873 5.55858 2.28295 -131.78398 713.13965
5875.0000 -136.98735 -131.85739 5.12996 2.28069 -131.81709 705.18983
5880.0000 -137.15618 -131.83498 5.32120 2.28301 -131.78306 672.73782
5885.0000 -137.14989 -132.38472 4.76517 2.23750 -132.44928 647.14830
5890.0000 -137.99369 -133.09625 4.89744 2.17432 -133.37401 620.84424
5895.0000 -137.46782 -132.37042 5.09740 2.26007 -132.11885 661.44865
5900.0000 -136.58687 -131.72294 4.86394 2.27348 -131.92262 670.12405
5905.0000 -135.90368 -131.51029 4.39339 2.29030 -131.67642 705.35979
5910.0000 -135.92796 -130.95804 4.96993 2.31565 -131.30528 729.06288
5915.0000 -137.14730 -132.23109 4.91621 2.28674 -131.72848 705.77600
5920.0000 -136.85396 -131.58767 5.26629 2.30527 -131.45718 707.07496
5925.0000 -137.52916 -132.03120 5.49797 2.25926 -132.13069 672.73640
5930.0000 -136.60486 -131.83215 4.77271 2.32407 -131.18210 712.19539
5935.0000 -137.04205 -131.91238 5.12967 2.29807 -131.56270 716.27348
5940.0000 -136.62102 -131.41179 5.20923 2.28067 -131.81727 687.86790
5945.0000 -135.12348 -129.99724 5.12624 2.35586 -130.71680 720.40410
5950.0000 -134.97110 -129.99210 4.97900 2.36581 -130.57115 737.49545
5955.0000 -135.20155 -130.26692 4.93462 2.37848 -130.38559 736.44158
5960.0000 -136.58130 -130.42219 6.15912 2.36596 -130.56889 747.18157
5965.0000 -135.04784 -130.19675 4.85109 2.38563 -130.28099 750.05596
5970.0000 -136.71361 -131.65945 5.05416 2.31585 -131.30233 697.32202
5975.0000 -137.42084 -132.56982 4.85103 2.26606 -132.03118 685.17878
5980.0000 -136.79829 -132.25881 4.53948 2.23346 -132.50837 636.32184
5985.0000 -136.38509 -132.12081 4.26428 2.26057 -132.11155 657.92428
5990.0000 -136.34473 -131.15120 5.19353 2.31070 -131.37784 675.00359
5995.0000 -136.37554 -130.64311 5.73243 2.33741 -130.98686 759.40361
6000.0000 -136.61445 -131.64221 4.97224 2.30663 -131.43737 718.87131
FREEZING PROCESS: loop number 25 T-loop= 666.00000000000000
main_MD> interactions number 25 at Temperature= 666.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.22620 0.10259 0.68205
force_rgl> df(natom) -0.66209 2.70286 -1.92801
6005.0000 -137.20189 -131.81115 5.39075 2.26173 -132.09455 672.02431
6010.0000 -137.04314 -133.09829 3.94485 2.25717 -132.16137 651.06270
6015.0000 -137.51671 -133.02095 4.49576 2.19246 -133.10852 601.74700
6020.0000 -137.97666 -133.53282 4.44384 2.21607 -132.76287 648.76220
6025.0000 -137.62197 -133.76078 3.86119 2.17146 -133.41588 596.42100
6030.0000 -137.71206 -133.61653 4.09553 2.16920 -133.44895 610.45388
6035.0000 -137.76241 -133.26318 4.49924 2.17335 -133.38817 610.74020
6040.0000 -137.21610 -132.41909 4.79701 2.23562 -132.47669 636.44581
6045.0000 -137.68245 -133.35231 4.33014 2.23826 -132.43811 672.14169
6050.0000 -136.69504 -131.99196 4.70308 2.21835 -132.72957 642.85385
6055.0000 -135.64785 -131.12635 4.52150 2.25839 -132.14347 654.15872
6060.0000 -137.81031 -132.86711 4.94320 2.26553 -132.03898 687.60177
6065.0000 -137.14389 -131.95140 5.19249 2.26215 -132.08845 687.72897
6070.0000 -137.07192 -132.23597 4.83595 2.24602 -132.32456 669.04932
6075.0000 -137.70150 -132.68902 5.01247 2.23394 -132.50126 662.09600
6080.0000 -136.85950 -132.30644 4.55306 2.22860 -132.57948 647.03107
6085.0000 -136.50333 -132.33811 4.16523 2.27447 -131.90809 695.09334
6090.0000 -137.13319 -131.14464 5.98855 2.26990 -131.97501 689.26700
6095.0000 -137.04674 -131.98974 5.05700 2.30674 -131.43572 688.82619
6100.0000 -138.31049 -133.36812 4.94237 2.23924 -132.42376 648.70935
6105.0000 -137.38378 -132.59505 4.78873 2.19118 -133.12720 613.68744
6110.0000 -136.54405 -132.30318 4.24087 2.26884 -131.99043 652.96828
6115.0000 -136.56153 -131.88034 4.68120 2.26904 -131.98761 673.43257
6120.0000 -136.60442 -131.76526 4.83915 2.25059 -132.25755 665.76911
6125.0000 -136.66046 -132.85608 3.80438 2.22436 -132.64148 637.28722
6130.0000 -135.96512 -131.37163 4.59350 2.29152 -131.65848 660.60318
6135.0000 -135.88941 -131.88471 4.00470 2.30898 -131.40289 711.67718
6140.0000 -137.55958 -132.01850 5.54108 2.23653 -132.46343 655.26369
6145.0000 -137.16049 -131.94651 5.21398 2.25708 -132.16254 676.79652
6150.0000 -137.05112 -131.71784 5.33328 2.28589 -131.74096 700.56877
6155.0000 -136.82072 -132.51958 4.30114 2.26433 -132.05648 720.64000
6160.0000 -137.83915 -132.75139 5.08776 2.20268 -132.95889 645.44702
6165.0000 -136.21700 -131.75655 4.46046 2.23260 -132.52098 657.28809
6170.0000 -137.06902 -132.36151 4.70751 2.26647 -132.02515 680.31664
6175.0000 -137.29612 -133.24071 4.05541 2.22674 -132.60677 664.44152
6180.0000 -136.24457 -131.17436 5.07021 2.26202 -132.09032 662.62392
6185.0000 -136.08293 -131.07191 5.01102 2.33733 -130.98792 726.49666
6190.0000 -137.48167 -132.41167 5.07000 2.27995 -131.82787 699.58576
6195.0000 -137.39554 -133.04774 4.34780 2.20001 -132.99792 621.28597
6200.0000 -137.07703 -132.00701 5.07003 2.25982 -132.12250 675.42308
6205.0000 -135.13404 -130.02179 5.11225 2.33692 -130.99397 739.25789
6210.0000 -136.60403 -131.07284 5.53119 2.37163 -130.48599 755.29028
6215.0000 -136.80611 -131.73241 5.07370 2.29635 -131.58775 708.36749
6220.0000 -135.77743 -130.16831 5.60912 2.32849 -131.11736 713.62013
6225.0000 -135.70029 -131.10392 4.59637 2.40676 -129.97170 768.46499
6230.0000 -135.88410 -130.95495 4.92915 2.36063 -130.64686 743.22356
6235.0000 -137.00922 -130.81446 6.19476 2.28760 -131.71596 699.55458
6240.0000 -137.17900 -132.18138 4.99762 2.27765 -131.86155 688.24438
6245.0000 -137.01724 -131.81411 5.20313 2.24853 -132.28771 655.74715
6250.0000 -137.16720 -133.09414 4.07306 2.23224 -132.52616 659.42392
FREEZING PROCESS: loop number 26 T-loop= 641.00000000000000
main_MD> interactions number 26 at Temperature= 641.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.21207 0.40373 -1.87608
force_rgl> df(natom) 0.62712 -0.11907 1.41168
6255.0000 -138.64512 -132.78259 5.86253 2.21314 -132.80572 642.30253
6260.0000 -136.97534 -132.19091 4.78443 2.22851 -132.58080 633.94114
6265.0000 -136.78654 -131.99264 4.79390 2.27012 -131.97171 706.94114
6270.0000 -138.09061 -132.92813 5.16249 2.25032 -132.26153 656.91184
6275.0000 -137.36755 -133.01334 4.35421 2.23757 -132.44818 660.71265
6280.0000 -137.26146 -133.07593 4.18554 2.18196 -133.26217 609.16454
6285.0000 -138.02329 -133.22138 4.80191 2.21125 -132.83345 634.54231
6290.0000 -137.10615 -131.71660 5.38955 2.25298 -132.22259 669.32368
6295.0000 -137.63797 -132.33417 5.30380 2.25418 -132.20507 659.45409
6300.0000 -136.74632 -131.73519 5.01114 2.30024 -131.53085 728.47690
6305.0000 -137.26533 -132.44709 4.81824 2.26508 -132.04556 664.98389
6310.0000 -136.87592 -132.78666 4.08926 2.23108 -132.54313 656.75263
6315.0000 -137.08643 -132.87668 4.20975 2.21776 -132.73821 644.51533
6320.0000 -137.68736 -132.12743 5.55993 2.25324 -132.21888 641.03522
6325.0000 -136.80005 -132.47823 4.32182 2.25273 -132.22633 650.62014
6330.0000 -137.13828 -132.61597 4.52231 2.24193 -132.38440 651.24313
6335.0000 -137.84055 -132.08398 5.75657 2.20597 -132.91072 657.60457
6340.0000 -136.61437 -132.47283 4.14154 2.23303 -132.51467 676.29747
6345.0000 -137.96843 -133.57472 4.39371 2.20277 -132.95758 638.52686
6350.0000 -137.95431 -133.93035 4.02396 2.15212 -133.69888 594.03702
6355.0000 -138.22778 -134.41449 3.81329 2.12418 -134.10795 588.35174
6360.0000 -138.23999 -133.83637 4.40362 2.09063 -134.59899 580.37104
6365.0000 -137.68985 -132.41320 5.27665 2.22586 -132.61965 681.72172
6370.0000 -136.93788 -132.66317 4.27470 2.21971 -132.70956 647.54515
6375.0000 -138.13736 -133.27792 4.85944 2.24506 -132.33849 659.11495
6380.0000 -138.04931 -133.63233 4.41698 2.15653 -133.63445 578.46643
6385.0000 -137.90730 -132.14884 5.75846 2.25445 -132.20104 675.12681
6390.0000 -136.92579 -132.15780 4.76800 2.23249 -132.52252 664.45208
6395.0000 -138.21880 -132.79810 5.42070 2.25812 -132.14740 698.19079
6400.0000 -138.03582 -133.69159 4.34422 2.16289 -133.54124 616.59362
6405.0000 -138.03675 -133.40590 4.63085 2.18508 -133.21654 630.41852
6410.0000 -137.96569 -132.37885 5.58684 2.24346 -132.36193 645.43502
6415.0000 -137.05697 -132.40962 4.64735 2.23510 -132.48436 650.87209
6420.0000 -136.32082 -131.98080 4.34002 2.24579 -132.32789 658.91682
6425.0000 -138.34683 -132.86601 5.48082 2.24774 -132.29929 648.15379
6430.0000 -138.05550 -133.78421 4.27129 2.16043 -133.57729 592.09371
6435.0000 -138.10628 -134.06514 4.04115 2.13761 -133.91138 581.68328
6440.0000 -138.60060 -134.22789 4.37272 2.13471 -133.95383 597.57691
6445.0000 -137.68676 -132.68334 5.00342 2.19258 -133.10670 631.07221
6450.0000 -137.48038 -133.14005 4.34033 2.22747 -132.59597 648.56667
6455.0000 -138.18781 -133.92761 4.26020 2.14227 -133.84311 598.63554
6460.0000 -136.29240 -131.36850 4.92390 2.19727 -133.03813 633.83440
6465.0000 -137.43545 -132.68500 4.75045 2.26447 -132.05439 672.56487
6470.0000 -138.23083 -133.20017 5.03066 2.22816 -132.58587 684.07373
6475.0000 -137.70073 -133.67665 4.02408 2.17704 -133.33424 608.20655
6480.0000 -136.90617 -133.02510 3.88107 2.17700 -133.33472 595.90417
6485.0000 -137.64418 -132.83067 4.81351 2.20435 -132.93440 621.82059
6490.0000 -136.95403 -132.49392 4.46011 2.20384 -132.94185 614.98966
6495.0000 -137.51204 -132.75220 4.75984 2.23467 -132.49067 675.57153
6500.0000 -136.67156 -131.65489 5.01667 2.23211 -132.52805 661.19847
FREEZING PROCESS: loop number 27 T-loop= 616.00000000000000
main_MD> interactions number 27 at Temperature= 616.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.66545 0.49271 -0.34799
force_rgl> df(natom) 2.55758 -0.12291 -1.75906
6505.0000 -137.88881 -133.31869 4.57012 2.26125 -132.10152 661.18279
6510.0000 -137.18040 -133.43918 3.74122 2.17256 -133.39974 611.47669
6515.0000 -137.83242 -132.86742 4.96501 2.18726 -133.18452 611.40054
6520.0000 -137.48172 -133.02375 4.45797 2.19562 -133.06218 646.12310
6525.0000 -137.21664 -133.03736 4.17928 2.21809 -132.73336 638.00930
6530.0000 -138.74496 -133.91068 4.83428 2.14740 -133.76798 577.21272
6535.0000 -138.06442 -133.35851 4.70591 2.10156 -134.43893 545.30509
6540.0000 -138.60226 -134.21511 4.38715 2.15440 -133.66552 579.34834
6545.0000 -138.58678 -134.76942 3.81736 2.06456 -134.98051 534.39336
6550.0000 -138.34362 -133.89833 4.44529 2.12772 -134.05606 571.80132
6555.0000 -138.80410 -134.65159 4.15251 2.11275 -134.27525 581.72259
6560.0000 -137.99617 -134.04690 3.94927 2.11006 -134.31452 604.93598
6565.0000 -138.05077 -133.48041 4.57036 2.17204 -133.40740 598.90419
6570.0000 -138.29829 -134.22292 4.07537 2.16343 -133.53346 630.73210
6575.0000 -138.83616 -134.33994 4.49622 2.08660 -134.65794 556.53491
6580.0000 -138.45500 -133.58248 4.87252 2.12979 -134.02580 579.22418
6585.0000 -138.72029 -134.74572 3.97457 2.13586 -133.93700 585.04747
6590.0000 -137.65875 -133.45144 4.20731 2.12434 -134.10555 565.47339
6595.0000 -136.73817 -132.19998 4.53819 2.21198 -132.82280 620.32175
6600.0000 -138.08924 -133.49035 4.59890 2.23322 -132.51187 663.96330
6605.0000 -137.25313 -133.18295 4.07018 2.14780 -133.76216 570.92278
6610.0000 -137.73481 -133.61990 4.11490 2.15548 -133.64974 588.32084
6615.0000 -137.22824 -132.73890 4.48934 2.18885 -133.16138 603.05712
6620.0000 -137.02994 -132.27231 4.75764 2.23646 -132.46438 643.11699
6625.0000 -138.18744 -134.39771 3.78973 2.16962 -133.44280 613.70375
6630.0000 -137.62522 -132.56019 5.06503 2.17639 -133.34370 615.22881
6635.0000 -136.88533 -132.97692 3.90841 2.21751 -132.74184 639.79770
6640.0000 -137.87895 -133.92160 3.95735 2.17675 -133.33844 664.05700
6645.0000 -136.62570 -132.23219 4.39351 2.19301 -133.10038 648.92434
6650.0000 -138.11614 -133.45866 4.65748 2.18136 -133.27093 649.03627
6655.0000 -138.33874 -133.66463 4.67410 2.16817 -133.46402 634.81409
6660.0000 -137.39718 -132.83052 4.56666 2.22476 -132.63568 674.95122
6665.0000 -136.60685 -132.01374 4.59311 2.27051 -131.96601 692.51048
6670.0000 -136.88478 -130.80889 6.07588 2.30154 -131.51180 706.42977
6675.0000 -136.46222 -132.11768 4.34454 2.28174 -131.80162 699.37485
6680.0000 -138.03810 -133.44026 4.59784 2.20952 -132.85878 631.62453
6685.0000 -136.40075 -131.80685 4.59389 2.19615 -133.05440 621.26741
6690.0000 -137.80920 -132.24884 5.56036 2.28437 -131.76323 687.40528
6695.0000 -137.37404 -132.44748 4.92656 2.25007 -132.26527 669.49147
6700.0000 -137.53647 -132.10497 5.43150 2.25389 -132.20924 685.87380
6705.0000 -138.72876 -133.57434 5.15442 2.22711 -132.60123 657.86329
6710.0000 -137.89658 -132.99856 4.89803 2.15513 -133.65493 586.57934
6715.0000 -138.14695 -132.83048 5.31647 2.21485 -132.78068 652.90342
6720.0000 -136.82344 -132.18121 4.64222 2.20099 -132.98360 634.33875
6725.0000 -136.76044 -131.92554 4.83491 2.23565 -132.47628 653.82487
6730.0000 -138.43883 -134.37908 4.05976 2.16377 -133.52844 602.80767
6735.0000 -136.54171 -133.03594 3.50577 2.18990 -133.14598 616.96563
6740.0000 -137.83799 -133.55846 4.27953 2.16591 -133.49705 612.48276
6745.0000 -138.17352 -133.64713 4.52639 2.14595 -133.78928 581.68977
6750.0000 -136.71327 -132.93933 3.77393 2.19470 -133.07563 644.96156
FREEZING PROCESS: loop number 28 T-loop= 591.00000000000000
main_MD> interactions number 28 at Temperature= 591.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.66356 2.28412 1.39367
force_rgl> df(natom) 2.86698 0.00845 1.46113
6755.0000 -137.40389 -132.85846 4.54543 2.17415 -133.37644 614.00187
6760.0000 -138.78765 -133.41976 5.36788 2.18325 -133.24325 647.09972
6765.0000 -136.73480 -131.90904 4.82576 2.22545 -132.62559 674.75784
6770.0000 -138.34562 -133.52353 4.82208 2.19542 -133.06517 636.71085
6775.0000 -137.47386 -133.17845 4.29541 2.15446 -133.66473 582.07344
6780.0000 -137.48629 -132.81525 4.67103 2.19549 -133.06417 647.20502
6785.0000 -138.55559 -133.55592 4.99967 2.19365 -133.09099 655.68038
6790.0000 -137.49413 -133.59811 3.89603 2.15891 -133.59949 595.51289
6795.0000 -137.74182 -133.10869 4.63313 2.16187 -133.55624 613.80663
6800.0000 -137.50325 -133.05190 4.45135 2.17126 -133.41874 625.72828
6805.0000 -138.72148 -134.37613 4.34535 2.14387 -133.81972 622.73926
6810.0000 -138.13160 -133.70010 4.43150 2.12983 -134.02513 596.97395
6815.0000 -137.86179 -134.00499 3.85680 2.13039 -134.01704 559.03473
6820.0000 -137.32425 -133.13902 4.18522 2.17616 -133.34699 629.86920
6825.0000 -139.15794 -135.16856 3.98938 2.08898 -134.62317 550.01251
6830.0000 -139.11685 -134.74090 4.37595 2.09119 -134.59079 556.26267
6835.0000 -138.56885 -134.36963 4.19921 2.08526 -134.67765 537.12457
6840.0000 -138.95953 -134.56198 4.39756 2.10302 -134.41764 583.79380
6845.0000 -139.23346 -135.13531 4.09814 2.06209 -135.01677 538.27822
6850.0000 -139.07231 -135.25003 3.82228 2.04054 -135.33219 511.80423
6855.0000 -138.86872 -135.25143 3.61729 2.04379 -135.28458 501.31712
6860.0000 -138.85304 -134.94250 3.91054 2.08762 -134.64311 540.12019
6865.0000 -139.52843 -136.16027 3.36816 2.03661 -135.38964 517.75953
6870.0000 -139.14521 -134.52015 4.62506 2.04939 -135.20261 547.99204
6875.0000 -139.19198 -135.49510 3.69689 2.09143 -134.58724 562.16181
6880.0000 -138.67210 -134.94138 3.73072 2.04115 -135.32322 499.92574
6885.0000 -139.10602 -134.52381 4.58221 2.10383 -134.40582 567.69547
6890.0000 -138.60050 -134.47921 4.12129 2.10922 -134.32681 566.98159
6895.0000 -138.53868 -134.33767 4.20101 2.11121 -134.29774 572.15329
6900.0000 -137.57096 -133.57660 3.99436 2.15713 -133.62564 604.94706
6905.0000 -138.69527 -134.26480 4.43048 2.14080 -133.86458 587.45629
6910.0000 -138.72458 -134.55664 4.16794 2.09634 -134.51539 523.49068
6915.0000 -138.40241 -134.60607 3.79634 2.09513 -134.53309 547.65085
6920.0000 -138.22088 -134.47163 3.74925 2.09181 -134.58172 562.08156
6925.0000 -138.29671 -133.78014 4.51657 2.11458 -134.24843 573.39632
6930.0000 -137.10239 -131.48722 5.61518 2.21302 -132.80754 638.09678
6935.0000 -136.96975 -133.11025 3.85950 2.22738 -132.59732 657.08529
6940.0000 -137.48901 -133.35254 4.13647 2.15813 -133.61097 578.68937
6945.0000 -138.60144 -133.46177 5.13967 2.12888 -134.03914 589.55798
6950.0000 -137.93615 -134.07868 3.85747 2.09366 -134.55468 563.06375
6955.0000 -137.61108 -133.85106 3.76002 2.13062 -134.01362 608.29457
6960.0000 -138.04939 -133.64539 4.40400 2.13976 -133.87990 588.18167
6965.0000 -137.67221 -133.19909 4.47312 2.16211 -133.55270 629.05445
6970.0000 -137.38486 -134.31479 3.07007 2.12356 -134.11694 556.05021
6975.0000 -138.52418 -135.34662 3.17757 2.06073 -135.03657 529.20813
6980.0000 -138.38130 -134.22311 4.15819 2.05608 -135.10465 524.76257
6985.0000 -138.15292 -135.04786 3.10506 2.07172 -134.87578 529.13068
6990.0000 -139.19152 -134.93577 4.25576 2.09150 -134.58629 551.45702
6995.0000 -137.99711 -134.29646 3.70065 2.11150 -134.29347 550.52071
7000.0000 -137.22854 -132.44857 4.77996 2.18606 -133.20218 615.85912
FREEZING PROCESS: loop number 29 T-loop= 566.00000000000000
main_MD> interactions number 29 at Temperature= 566.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.62423 1.16239 -1.45415
force_rgl> df(natom) 1.49812 -1.86903 2.75643
7005.0000 -137.70348 -133.12171 4.58177 2.17852 -133.31245 623.36800
7010.0000 -138.32390 -134.06092 4.26298 2.22203 -132.67561 678.31568
7015.0000 -138.59927 -134.70572 3.89355 2.09432 -134.54502 542.08469
7020.0000 -138.80496 -134.31769 4.48727 2.07734 -134.79349 536.92103
7025.0000 -139.27619 -134.00811 5.26808 2.08576 -134.67027 554.10902
7030.0000 -137.86763 -133.75892 4.10871 2.16092 -133.57008 626.52938
7035.0000 -137.67049 -132.79818 4.87231 2.16535 -133.50522 587.60888
7040.0000 -137.31313 -132.28738 5.02575 2.24522 -132.33625 662.19952
7045.0000 -137.98171 -134.26811 3.71360 2.16029 -133.57932 595.13656
7050.0000 -137.16597 -132.50564 4.66033 2.17413 -133.37670 608.43086
7055.0000 -138.29193 -133.48580 4.80613 2.20164 -132.97412 658.11081
7060.0000 -138.83642 -133.52610 5.31032 2.16868 -133.45659 642.00595
7065.0000 -138.72000 -134.31517 4.40483 2.13736 -133.91495 614.36876
7070.0000 -139.48935 -135.81807 3.67127 2.04416 -135.27912 508.19812
7075.0000 -139.44520 -134.89910 4.54610 2.01803 -135.66160 492.29096
7080.0000 -138.37471 -134.84041 3.53429 2.07861 -134.77497 553.04820
7085.0000 -139.25210 -135.27110 3.98100 2.05438 -135.12956 567.58780
7090.0000 -140.03391 -136.38623 3.64768 2.00841 -135.80239 529.84491
7095.0000 -139.58876 -135.97807 3.61069 1.97721 -136.25915 513.76137
7100.0000 -139.48294 -135.45468 4.02827 2.00450 -135.85969 525.74335
7105.0000 -139.20318 -135.87645 3.32673 2.02542 -135.55341 530.24658
7110.0000 -139.45636 -135.60815 3.84822 2.00845 -135.80191 543.87893
7115.0000 -140.01477 -136.13824 3.87653 1.98005 -136.21758 520.51849
7120.0000 -139.62088 -135.77947 3.84141 1.98503 -136.14473 524.86371
7125.0000 -139.18212 -135.07382 4.10830 2.05272 -135.15390 590.54965
7130.0000 -138.90292 -134.61753 4.28539 2.05684 -135.09358 564.69966
7135.0000 -139.25160 -134.89741 4.35419 2.11409 -134.25554 619.08556
7140.0000 -138.95949 -135.02946 3.93002 2.05644 -135.09941 561.79849
7145.0000 -139.79262 -136.26653 3.52609 2.01488 -135.70771 508.09051
7150.0000 -140.01804 -136.48470 3.53334 1.97849 -136.24042 510.75515
7155.0000 -139.62675 -135.54063 4.08611 1.99578 -135.98730 522.11110
7160.0000 -140.50090 -136.30941 4.19149 2.00053 -135.91774 535.05782
7165.0000 -139.04632 -135.63699 3.40933 1.97727 -136.25826 508.36446
7170.0000 -139.38721 -135.42947 3.95774 1.97022 -136.36152 478.96851
7175.0000 -139.51177 -135.65411 3.85765 2.02190 -135.60504 558.02125
7180.0000 -139.64669 -135.46473 4.18196 1.99214 -136.04067 564.52123
7185.0000 -139.26695 -134.91143 4.35552 2.06832 -134.92547 624.26262
7190.0000 -139.89512 -134.97252 4.92260 2.05446 -135.12846 585.67158
7195.0000 -137.82223 -133.71432 4.10791 2.09557 -134.52662 611.36239
7200.0000 -138.44960 -134.64181 3.80779 2.10548 -134.38159 561.79208
7205.0000 -138.07926 -134.07172 4.00755 2.10461 -134.39432 540.24394
7210.0000 -138.50261 -134.80143 3.70118 2.10212 -134.43081 537.87552
7215.0000 -139.47114 -134.95928 4.51186 2.05508 -135.11935 539.09465
7220.0000 -139.03396 -134.82441 4.20954 2.06306 -135.00247 544.95352
7225.0000 -139.21393 -135.40504 3.80889 2.03836 -135.36404 506.52003
7230.0000 -139.31839 -136.39333 2.92506 1.97405 -136.30539 441.43813
7235.0000 -139.26102 -135.22087 4.04015 2.01274 -135.73906 484.14006
7240.0000 -138.25542 -134.29306 3.96236 2.06941 -134.90965 545.60969
7245.0000 -138.48614 -134.58310 3.90304 2.13224 -133.98988 594.79688
7250.0000 -138.84675 -134.39152 4.45523 2.10232 -134.42790 570.94488
FREEZING PROCESS: loop number 30 T-loop= 541.00000000000000
main_MD> interactions number 30 at Temperature= 541.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.39892 1.26053 0.79860
force_rgl> df(natom) 0.46958 -0.91120 3.09957
7255.0000 -138.96085 -134.80357 4.15728 2.11799 -134.19853 565.40046
7260.0000 -138.88419 -134.73903 4.14515 2.09724 -134.50225 550.83961
7265.0000 -138.60840 -134.11810 4.49030 2.07147 -134.87936 502.50669
7270.0000 -138.41259 -135.32588 3.08671 2.09162 -134.58456 543.70021
7275.0000 -138.91262 -135.28576 3.62687 2.04253 -135.30300 495.75522
7280.0000 -139.51414 -135.68243 3.83171 2.05208 -135.16323 540.10663
7285.0000 -140.11902 -135.59867 4.52035 2.04542 -135.26078 569.66044
7290.0000 -139.40133 -135.39267 4.00865 2.04503 -135.26638 579.34416
7295.0000 -139.69423 -135.93013 3.76410 2.03978 -135.34336 586.24188
7300.0000 -140.27822 -136.25489 4.02333 1.99010 -136.07046 554.95856
7305.0000 -139.98143 -136.33100 3.65043 1.96031 -136.50652 538.46009
7310.0000 -139.95594 -135.92694 4.02900 1.94257 -136.76611 524.98085
7315.0000 -139.01054 -134.71542 4.29513 2.04673 -135.24159 600.89376
7320.0000 -139.73946 -135.74799 3.99146 2.05029 -135.18945 609.99170
7325.0000 -139.96521 -135.88551 4.07970 2.06066 -135.03761 611.92238
7330.0000 -139.88938 -135.63805 4.25132 2.04421 -135.27847 600.58369
7335.0000 -139.76484 -135.88314 3.88170 2.02559 -135.55100 581.96691
7340.0000 -140.06736 -136.67208 3.39528 1.98386 -136.16173 557.91932
7345.0000 -140.39013 -135.98378 4.40635 1.95890 -136.52719 530.33448
7350.0000 -140.07717 -135.84855 4.22862 1.99806 -135.95395 553.22760
7355.0000 -140.08554 -136.85865 3.22689 1.96829 -136.38965 535.35208
7360.0000 -139.72097 -135.94487 3.77610 1.95686 -136.55706 526.41703
7365.0000 -140.51634 -136.78666 3.72968 1.96418 -136.44986 528.44575
7370.0000 -140.47670 -136.32785 4.14885 1.96195 -136.48247 528.94678
7375.0000 -140.04608 -136.12283 3.92324 1.98185 -136.19129 561.60176
7380.0000 -139.78384 -135.51992 4.26392 2.01390 -135.72214 579.01929
7385.0000 -140.81742 -137.15355 3.66387 1.95669 -136.55953 538.35227
7390.0000 -140.86264 -136.56922 4.29342 1.91427 -137.18047 489.34622
7395.0000 -140.32667 -136.23966 4.08700 1.99392 -136.01452 559.63625
7400.0000 -139.84674 -136.73847 3.10826 1.94595 -136.71668 525.48121
7405.0000 -139.73765 -136.36499 3.37266 1.93279 -136.90930 509.73028
7410.0000 -140.41611 -136.40512 4.01100 1.97887 -136.23487 546.28394
7415.0000 -139.33069 -135.70900 3.62169 1.99654 -135.97620 565.95592
7420.0000 -139.65206 -135.46774 4.18433 2.02566 -135.55002 583.43058
7425.0000 -140.20118 -135.60694 4.59424 2.01348 -135.72824 538.66367
7430.0000 -140.13424 -136.13182 4.00242 2.01060 -135.77034 536.50547
7435.0000 -139.44194 -135.37978 4.06216 1.99406 -136.01256 540.04683
7440.0000 -140.27061 -136.31318 3.95743 2.00328 -135.87760 542.80205
7445.0000 -140.70265 -136.32992 4.37273 1.97193 -136.33646 521.08548
7450.0000 -139.65386 -135.35730 4.29656 2.01422 -135.71745 538.77747
7455.0000 -140.68593 -136.68716 3.99877 1.99250 -136.03526 538.41299
7460.0000 -140.14593 -136.76932 3.37660 1.94753 -136.69359 492.40414
7465.0000 -140.12693 -136.17519 3.95174 1.98514 -136.14300 527.19313
7470.0000 -139.64618 -135.83310 3.81308 2.01131 -135.76003 536.44325
7475.0000 -139.72462 -135.27861 4.44600 2.05553 -135.11275 547.51719
7480.0000 -139.36046 -135.44939 3.91106 2.02357 -135.58055 558.97185
7485.0000 -140.05575 -135.93924 4.11651 2.01364 -135.72587 554.65805
7490.0000 -139.87748 -135.78352 4.09396 2.02141 -135.61214 555.36224
7495.0000 -140.07401 -135.92395 4.15006 1.99206 -136.04182 548.18297
7500.0000 -139.38809 -136.05460 3.33349 1.98258 -136.18060 508.07795
FREEZING PROCESS: loop number 31 T-loop= 516.00000000000000
main_MD> interactions number 31 at Temperature= 516.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.60380 0.48160 -0.00650
force_rgl> df(natom) 2.21051 1.02633 2.27936
7505.0000 -139.64795 -135.91606 3.73190 2.01916 -135.64511 566.89942
7510.0000 -139.35639 -135.40408 3.95231 2.02480 -135.56261 563.07311
7515.0000 -140.59310 -136.85651 3.73658 1.99172 -136.04676 548.89713
7520.0000 -140.25649 -136.57854 3.67795 1.96163 -136.48721 534.39115
7525.0000 -140.28430 -136.54382 3.74048 1.97203 -136.33490 541.94175
7530.0000 -140.22235 -136.27547 3.94688 1.93875 -136.82205 520.25101
7535.0000 -140.38320 -136.60791 3.77529 1.92394 -137.03890 506.89136
7540.0000 -140.31093 -136.78823 3.52271 1.90105 -137.37384 476.90072
7545.0000 -141.27113 -138.13407 3.13705 1.89637 -137.44237 478.62759
7550.0000 -140.77739 -137.90132 2.87607 1.87478 -137.75846 458.23970
7555.0000 -140.85411 -137.21120 3.64291 1.88070 -137.67173 461.25731
7560.0000 -140.48222 -136.81662 3.66560 1.94401 -136.74502 509.77248
7565.0000 -140.56170 -137.27714 3.28457 1.92112 -137.08019 489.72510
7570.0000 -140.77238 -137.39050 3.38188 1.90338 -137.33979 478.47061
7575.0000 -140.70086 -137.51766 3.18320 1.91040 -137.23702 488.68531
7580.0000 -139.96544 -136.73637 3.22907 1.87332 -137.77979 456.02962
7585.0000 -141.13985 -137.48022 3.65962 1.92058 -137.08802 494.87655
7590.0000 -140.71949 -137.02263 3.69685 1.90710 -137.28532 488.24428
7595.0000 -141.12735 -136.86625 4.26110 1.93138 -136.92996 505.07943
7600.0000 -141.47629 -137.33883 4.13746 1.92193 -137.06823 496.40277
7605.0000 -140.60259 -136.43660 4.16599 1.93409 -136.89027 514.78891
7610.0000 -140.92146 -136.52326 4.39820 1.96745 -136.40196 520.55767
7615.0000 -140.67646 -137.76030 2.91616 1.92365 -137.04311 499.46038
7620.0000 -139.94660 -136.51386 3.43275 1.93424 -136.88803 502.03234
7625.0000 -141.34086 -138.20579 3.13506 1.90454 -137.32279 476.29589
7630.0000 -140.15436 -136.52614 3.62823 1.91380 -137.18732 496.12077
7635.0000 -140.49478 -136.60151 3.89328 1.94226 -136.77071 511.86074
7640.0000 -141.39689 -137.91399 3.48290 1.88797 -137.56538 463.34425
7645.0000 -140.68798 -137.59794 3.09004 1.87746 -137.71927 451.54327
7650.0000 -140.78418 -137.59541 3.18877 1.87449 -137.76268 457.69408
7655.0000 -140.66286 -137.40176 3.26110 1.88193 -137.65380 460.52201
7660.0000 -139.77932 -135.48198 4.29734 1.97723 -136.25884 539.82815
7665.0000 -138.54082 -135.06220 3.47861 2.03461 -135.41891 588.88354
7670.0000 -140.39834 -136.55160 3.84674 1.99629 -135.97988 565.64477
7675.0000 -140.96176 -136.83407 4.12769 1.94241 -136.76857 512.34164
7680.0000 -139.91277 -136.22367 3.68910 1.96258 -136.47330 529.06218
7685.0000 -140.00897 -135.87035 4.13862 1.99252 -136.03503 551.97878
7690.0000 -139.85848 -135.88093 3.97755 1.97562 -136.28243 553.48926
7695.0000 -140.48307 -136.23463 4.24844 1.99220 -136.03976 554.94635
7700.0000 -140.27491 -136.28979 3.98512 1.94880 -136.67492 524.69386
7705.0000 -140.07358 -136.32351 3.75008 1.92362 -137.04361 499.38461
7710.0000 -140.41300 -137.19342 3.21958 1.93660 -136.85348 509.64704
7715.0000 -141.66983 -138.08352 3.58631 1.88561 -137.59991 468.04282
7720.0000 -140.91699 -137.80169 3.11530 1.85668 -138.02340 442.20744
7725.0000 -140.66288 -137.73503 2.92785 1.90124 -137.37120 474.67046
7730.0000 -140.69018 -136.64074 4.04945 1.87893 -137.69765 466.53035
7735.0000 -140.57024 -136.13525 4.43499 1.94384 -136.74764 519.97793
7740.0000 -140.20838 -136.38434 3.82404 1.98134 -136.19876 549.68016
7745.0000 -140.46858 -137.34682 3.12175 1.92858 -136.97099 500.46457
7750.0000 -140.95041 -136.54347 4.40694 1.94430 -136.74091 520.10328
FREEZING PROCESS: loop number 32 T-loop= 491.00000000000000
main_MD> interactions number 32 at Temperature= 491.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.40258 0.98821 1.64191
force_rgl> df(natom) -0.52238 0.67470 -2.03070
7755.0000 -139.68449 -136.07873 3.60576 1.96981 -136.36752 545.88880
7760.0000 -140.36127 -136.67465 3.68661 1.98255 -136.18096 537.29105
7765.0000 -140.70600 -137.08124 3.62476 1.92402 -137.03770 497.03817
7770.0000 -140.65924 -137.45464 3.20461 1.93466 -136.88198 497.48641
7775.0000 -141.08802 -137.13198 3.95604 1.95484 -136.58664 520.28386
7780.0000 -141.31336 -137.43429 3.87907 1.92764 -136.98464 503.74713
7785.0000 -140.83412 -137.41683 3.41729 1.91133 -137.22348 500.60176
7790.0000 -140.63574 -137.40708 3.22866 1.90402 -137.33050 490.26421
7795.0000 -140.22850 -136.99057 3.23793 1.89793 -137.41958 476.44536
7800.0000 -141.11550 -137.87980 3.23570 1.91724 -137.13699 492.28242
7805.0000 -140.86639 -137.76503 3.10136 1.84617 -138.17720 424.71241
7810.0000 -140.74279 -137.77426 2.96853 1.87371 -137.77408 451.60198
7815.0000 -141.17325 -137.60921 3.56404 1.88601 -137.59412 463.50871
7820.0000 -139.78075 -136.35087 3.42988 1.91758 -137.13191 486.00991
7825.0000 -140.87285 -137.32304 3.54981 1.93010 -136.94864 501.67197
7830.0000 -141.46293 -137.97008 3.49285 1.86208 -137.94432 445.17482
7835.0000 -140.51338 -137.08274 3.43064 1.89294 -137.49268 481.72133
7840.0000 -141.17649 -137.55095 3.62553 1.91086 -137.23027 488.70940
7845.0000 -141.32144 -137.79171 3.52974 1.86580 -137.88982 451.02021
7850.0000 -140.94153 -137.42911 3.51242 1.87719 -137.72318 462.32983
7855.0000 -141.20158 -137.90016 3.30143 1.89025 -137.53204 474.27664
7860.0000 -141.30351 -137.21469 4.08882 1.89741 -137.42712 468.26532
7865.0000 -140.90528 -138.01197 2.89330 1.86710 -137.87080 449.84513
7870.0000 -141.34480 -138.85027 2.49453 1.82822 -138.43989 412.43476
7875.0000 -141.26975 -137.55672 3.71303 1.87353 -137.77672 455.55836
7880.0000 -140.38611 -136.95383 3.43228 1.91478 -137.17294 485.00058
7885.0000 -140.22683 -137.06745 3.15938 1.92399 -137.03817 512.85607
7890.0000 -141.72758 -137.47192 4.25565 1.91903 -137.11071 501.24893
7895.0000 -141.28207 -138.29378 2.98830 1.86467 -137.90641 449.07468
7900.0000 -141.01848 -137.77407 3.24441 1.86343 -137.92457 447.76839
7905.0000 -140.90232 -136.67434 4.22798 1.89722 -137.42991 472.20188
7910.0000 -140.35947 -136.92564 3.43383 1.93875 -136.82206 517.16533
7915.0000 -140.98905 -137.12215 3.86691 1.91252 -137.20606 483.19206
7920.0000 -140.06882 -135.83938 4.22944 1.95202 -136.62783 521.55798
7925.0000 -139.36166 -134.91308 4.44858 2.02210 -135.60201 578.36606
7930.0000 -140.13398 -136.79392 3.34006 1.97418 -136.30348 547.12481
7935.0000 -140.47505 -137.26527 3.20978 1.94158 -136.78069 520.60818
7940.0000 -140.85728 -137.24965 3.60763 1.93088 -136.93723 511.08120
7945.0000 -140.52382 -136.68540 3.83842 1.91697 -137.14088 492.64065
7950.0000 -140.99853 -137.91839 3.08014 1.87238 -137.79349 463.05759
7955.0000 -140.69054 -137.70327 2.98727 1.89065 -137.52615 475.80791
7960.0000 -141.01495 -137.69715 3.31780 1.87810 -137.70985 458.69898
7965.0000 -140.73737 -137.74120 2.99617 1.88464 -137.61416 465.98925
7970.0000 -141.14308 -137.34701 3.79607 1.87026 -137.82457 456.13216
7975.0000 -141.01139 -137.80577 3.20562 1.85638 -138.02774 445.69482
7980.0000 -141.50425 -138.58195 2.92229 1.87232 -137.79437 458.69683
7985.0000 -141.12554 -137.04501 4.08053 1.88083 -137.66982 459.42294
7990.0000 -140.34052 -136.46983 3.87069 1.94531 -136.72612 512.08053
7995.0000 -140.47075 -137.02964 3.44111 1.95030 -136.65305 525.84390
8000.0000 -141.64172 -137.21684 4.42488 1.94725 -136.69763 530.82263
FREEZING PROCESS: loop number 33 T-loop= 466.00000000000000
main_MD> interactions number 33 at Temperature= 466.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.77493 -2.24584 -0.68109
force_rgl> df(natom) 1.08466 0.02820 -2.49199
8005.0000 -141.55300 -137.99658 3.55641 1.88796 -137.56550 478.44546
8010.0000 -140.92476 -137.75387 3.17089 1.87363 -137.77520 462.76149
8015.0000 -140.74046 -137.33463 3.40583 1.90758 -137.27837 493.12950
8020.0000 -141.16583 -138.06412 3.10171 1.86728 -137.86828 443.14320
8025.0000 -140.88484 -137.17338 3.71145 1.87708 -137.72477 456.39918
8030.0000 -141.10998 -137.17406 3.93592 1.87634 -137.73563 457.46757
8035.0000 -140.75430 -137.25731 3.49699 1.89007 -137.53462 472.98435
8040.0000 -140.92687 -137.85932 3.06755 1.90191 -137.36133 482.68432
8045.0000 -140.83916 -137.37990 3.45926 1.86863 -137.84838 443.66008
8050.0000 -140.83419 -137.59059 3.24360 1.86415 -137.91400 454.86129
8055.0000 -140.34649 -137.43506 2.91143 1.89076 -137.52453 471.95428
8060.0000 -141.14556 -137.21239 3.93317 1.88790 -137.56633 472.12195
8065.0000 -141.41652 -137.93551 3.48101 1.89145 -137.51445 478.43402
8070.0000 -141.16448 -137.50640 3.65808 1.85895 -137.99007 445.96602
8075.0000 -141.74750 -138.33165 3.41585 1.88571 -137.59840 467.25825
8080.0000 -140.56765 -137.28589 3.28176 1.85656 -138.02513 438.34665
8085.0000 -140.82905 -137.35664 3.47242 1.89208 -137.50525 465.80511
8090.0000 -140.42463 -137.25065 3.17398 1.88568 -137.59883 464.65046
8095.0000 -140.66059 -136.67400 3.98658 1.95150 -136.63540 517.01043
8100.0000 -140.68874 -137.22839 3.46035 1.92613 -137.00681 497.75322
8105.0000 -140.82399 -137.79107 3.03291 1.86595 -137.88764 444.15685
8110.0000 -141.33307 -137.62287 3.71021 1.89026 -137.53189 471.32847
8115.0000 -140.25563 -137.22651 3.02912 1.89026 -137.53182 464.09838
8120.0000 -140.23042 -136.63794 3.59249 1.93351 -136.89873 509.15807
8125.0000 -140.73052 -136.83674 3.89378 1.94011 -136.80219 512.39177
8130.0000 -141.31949 -137.34299 3.97650 1.93867 -136.82326 513.09309
8135.0000 -140.91512 -138.18383 2.73129 1.88540 -137.60300 464.46976
8140.0000 -141.34932 -138.23538 3.11394 1.84176 -138.24181 423.01950
8145.0000 -141.87008 -137.92110 3.94898 1.83956 -138.27394 429.08966
8150.0000 -141.61946 -137.93123 3.68823 1.88021 -137.67900 465.17070
8155.0000 -141.11329 -137.62528 3.48800 1.86766 -137.86259 452.77777
8160.0000 -141.03430 -137.11356 3.92074 1.87829 -137.70709 462.34508
8165.0000 -140.87450 -137.93487 2.93963 1.92204 -137.06665 504.33841
8170.0000 -141.89382 -138.33193 3.56189 1.85427 -138.05871 444.51835
8175.0000 -142.05862 -139.27797 2.78065 1.81776 -138.59302 404.94830
8180.0000 -140.88987 -137.50233 3.38754 1.84035 -138.26233 426.63411
8185.0000 -141.59650 -138.48660 3.10990 1.87409 -137.76857 460.56418
8190.0000 -140.80085 -137.56459 3.23626 1.86713 -137.87045 456.17334
8195.0000 -140.81546 -137.17159 3.64387 1.88812 -137.56313 469.87073
8200.0000 -140.78978 -137.36632 3.42347 1.87788 -137.71308 465.26568
8205.0000 -140.56969 -137.04792 3.52177 1.90061 -137.38034 480.93532
8210.0000 -141.02162 -137.36709 3.65452 1.92907 -136.96384 509.77052
8215.0000 -140.65779 -137.94767 2.71012 1.84405 -138.20825 427.76995
8220.0000 -141.12120 -137.56794 3.55327 1.85834 -137.99904 435.24287
8225.0000 -140.93462 -137.72504 3.20958 1.88660 -137.58541 462.45577
8230.0000 -141.37537 -137.94756 3.42781 1.86177 -137.94881 445.45039
8235.0000 -141.87978 -138.35733 3.52244 1.85110 -138.10503 434.65872
8240.0000 -140.57608 -137.25684 3.31924 1.88893 -137.55125 460.66482
8245.0000 -140.30837 -137.30716 3.00121 1.90648 -137.29450 485.87966
8250.0000 -140.81961 -136.28742 4.53218 1.95989 -136.51267 532.41084
FREEZING PROCESS: loop number 34 T-loop= 441.00000000000000
main_MD> interactions number 34 at Temperature= 441.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.68509 3.12067 -0.31200
force_rgl> df(natom) -1.27862 1.60336 -0.27004
8255.0000 -141.01911 -137.15686 3.86225 1.94984 -136.65973 526.53298
8260.0000 -141.18099 -137.16774 4.01325 1.92249 -137.06006 502.45399
8265.0000 -140.58651 -137.19336 3.39315 1.89696 -137.43381 477.53363
8270.0000 -140.98687 -137.50361 3.48326 1.90787 -137.27408 482.73865
8275.0000 -141.14114 -137.86413 3.27701 1.88671 -137.58386 460.62483
8280.0000 -140.71614 -137.57993 3.13622 1.88959 -137.54159 471.77702
8285.0000 -140.79880 -138.24067 2.55813 1.83953 -138.27442 427.33199
8290.0000 -141.39865 -138.27021 3.12844 1.83471 -138.34497 419.81215
8295.0000 -141.27576 -138.82171 2.45404 1.81657 -138.61050 410.59374
8300.0000 -141.21651 -137.98567 3.23083 1.84058 -138.25896 420.89097
8305.0000 -141.02146 -137.19140 3.83005 1.90482 -137.31879 484.32907
8310.0000 -141.60430 -138.36018 3.24412 1.85406 -138.06164 436.90746
8315.0000 -141.15421 -138.11118 3.04303 1.86052 -137.96710 446.70736
8320.0000 -140.59121 -137.69339 2.89782 1.85632 -138.02858 441.17601
8325.0000 -141.65605 -137.94978 3.70627 1.85376 -138.06607 434.46400
8330.0000 -141.81451 -139.08968 2.72483 1.83750 -138.30412 426.95542
8335.0000 -141.38689 -138.52952 2.85737 1.80189 -138.82539 393.87840
8340.0000 -141.44665 -138.02981 3.41684 1.84112 -138.25108 424.21852
8345.0000 -141.15535 -137.93647 3.21889 1.84785 -138.15255 433.35107
8350.0000 -140.70164 -137.36572 3.33592 1.87607 -137.73956 455.95822
8355.0000 -140.91695 -137.67311 3.24384 1.90037 -137.38392 483.11117
8360.0000 -141.47409 -138.38307 3.09102 1.85178 -138.09512 436.13407
8365.0000 -140.96631 -137.55543 3.41088 1.85102 -138.10624 440.80676
8370.0000 -140.89380 -137.83280 3.06100 1.89152 -137.51342 475.32705
8375.0000 -140.66212 -137.05744 3.60468 1.89384 -137.47950 477.01850
8380.0000 -141.37790 -137.71163 3.66627 1.92747 -136.98719 511.13635
8385.0000 -140.73201 -136.68787 4.04414 1.91118 -137.22558 487.27775
8390.0000 -141.27819 -137.32328 3.95491 1.91981 -137.09930 504.26221
8395.0000 -141.70239 -138.62432 3.07808 1.86684 -137.87466 449.34417
8400.0000 -141.21076 -137.41469 3.79607 1.84356 -138.21539 427.37561
8405.0000 -140.80743 -137.30039 3.50704 1.89957 -137.39556 479.94075
8410.0000 -141.23078 -137.92534 3.30544 1.85754 -138.01074 441.08682
8415.0000 -140.96670 -137.86007 3.10663 1.84690 -138.16644 437.81463
8420.0000 -140.76185 -137.46677 3.29507 1.89154 -137.51311 468.36334
8425.0000 -141.73269 -138.53093 3.20177 1.85049 -138.11397 437.46260
8430.0000 -141.51230 -139.06630 2.44599 1.80634 -138.76020 392.86199
8435.0000 -142.03112 -138.88872 3.14240 1.79700 -138.89698 395.70538
8440.0000 -141.55847 -138.71651 2.84196 1.82099 -138.54571 413.48763
8445.0000 -141.13892 -137.61099 3.52792 1.79923 -138.86430 391.02191
8450.0000 -141.29815 -137.78652 3.51162 1.87224 -137.79568 455.15481
8455.0000 -140.85953 -137.80209 3.05744 1.87875 -137.70029 459.60397
8460.0000 -141.16877 -137.48106 3.68771 1.87174 -137.80299 453.97577
8465.0000 -141.02986 -137.62429 3.40556 1.89866 -137.40889 477.45941
8470.0000 -141.37511 -137.98530 3.38981 1.87088 -137.81552 456.93724
8475.0000 -141.52042 -138.05083 3.46959 1.87170 -137.80351 449.85437
8480.0000 -141.48927 -137.97397 3.51530 1.85391 -138.06397 439.10482
8485.0000 -141.24079 -137.77508 3.46572 1.86461 -137.90735 452.48286
8490.0000 -141.24817 -138.09732 3.15084 1.86207 -137.94452 446.55550
8495.0000 -141.54248 -138.22236 3.32011 1.83959 -138.27357 425.60219
8500.0000 -141.27044 -138.50096 2.76948 1.86158 -137.95165 442.45722
FREEZING PROCESS: loop number 35 T-loop= 416.00000000000000
main_MD> interactions number 35 at Temperature= 416.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.86362 1.80449 -0.01647
force_rgl> df(natom) -0.40955 -0.38515 -0.22487
8505.0000 -141.26029 -138.95679 2.30350 1.78196 -139.11704 368.81195
8510.0000 -142.09585 -138.85114 3.24471 1.79272 -138.95958 376.54610
8515.0000 -141.71482 -138.01682 3.69800 1.81164 -138.68259 401.19563
8520.0000 -141.65628 -139.03281 2.62347 1.82419 -138.49886 405.79184
8525.0000 -141.74786 -139.17957 2.56829 1.79582 -138.91411 379.44936
8530.0000 -141.76085 -139.20330 2.55755 1.76661 -139.34170 348.79381
8535.0000 -141.37688 -138.42580 2.95108 1.82330 -138.51192 415.33532
8540.0000 -141.93540 -139.26438 2.67102 1.80195 -138.82446 392.86540
8545.0000 -141.63846 -138.39237 3.24609 1.78226 -139.11263 375.56557
8550.0000 -141.55490 -138.03510 3.51980 1.83351 -138.36255 422.77178
8555.0000 -140.94485 -138.24473 2.70012 1.83245 -138.37798 416.70240
8560.0000 -140.79416 -138.06164 2.73252 1.84000 -138.26751 421.76526
8565.0000 -141.74652 -138.91276 2.83375 1.85278 -138.08039 435.46786
8570.0000 -141.38703 -138.20951 3.17752 1.81811 -138.58794 402.45855
8575.0000 -141.10749 -137.84882 3.25867 1.84476 -138.19786 429.23132
8580.0000 -141.28301 -138.11533 3.16768 1.84566 -138.18465 424.89808
8585.0000 -140.58786 -137.95684 2.63103 1.84855 -138.14232 429.53408
8590.0000 -141.54778 -138.73037 2.81741 1.82126 -138.54184 407.17317
8595.0000 -141.19041 -138.48222 2.70819 1.81858 -138.58110 405.13263
8600.0000 -141.41199 -138.80623 2.60576 1.84777 -138.15382 431.18356
8605.0000 -142.03683 -139.05726 2.97957 1.82612 -138.47071 407.21978
8610.0000 -140.99026 -138.13068 2.85958 1.81067 -138.69681 401.27841
8615.0000 -141.82245 -139.04257 2.77988 1.81616 -138.61647 409.53211
8620.0000 -141.64301 -137.60583 4.03718 1.81683 -138.60661 406.87647
8625.0000 -141.76550 -138.44945 3.31605 1.88449 -137.61635 469.43809
8630.0000 -141.23032 -138.33341 2.89691 1.82592 -138.47362 418.03055
8635.0000 -141.09205 -137.37708 3.71497 1.85812 -138.00227 447.70677
8640.0000 -141.37586 -138.44220 2.93367 1.87989 -137.68357 465.33983
8645.0000 -141.51746 -138.53454 2.98292 1.80896 -138.72190 398.71634
8650.0000 -141.26038 -137.82244 3.43794 1.84915 -138.13360 437.22200
8655.0000 -141.39196 -137.79997 3.59200 1.87129 -137.80948 444.23323
8660.0000 -140.74242 -136.96737 3.77505 1.89609 -137.44655 477.44862
8665.0000 -141.09579 -137.60405 3.49174 1.91423 -137.18101 493.28096
8670.0000 -141.07135 -137.34011 3.73123 1.89942 -137.39777 481.56343
8675.0000 -141.52206 -138.37549 3.14658 1.86420 -137.91335 450.24296
8680.0000 -141.01151 -137.84699 3.16452 1.83783 -138.29923 417.99097
8685.0000 -141.50872 -138.29182 3.21690 1.85762 -138.00956 444.51556
8690.0000 -141.41860 -137.88135 3.53726 1.84606 -138.17887 429.43110
8695.0000 -141.39129 -138.43062 2.96067 1.85071 -138.11077 428.00456
8700.0000 -141.68799 -138.53946 3.14853 1.82725 -138.45416 414.69758
8705.0000 -141.40757 -138.94803 2.45955 1.81251 -138.66988 397.51414
8710.0000 -141.52196 -138.42936 3.09260 1.81467 -138.63831 399.43795
8715.0000 -140.69816 -137.81562 2.88255 1.85778 -138.00726 440.64170
8720.0000 -141.92638 -138.69088 3.23550 1.81775 -138.59312 405.91000
8725.0000 -141.65587 -138.76491 2.89096 1.80797 -138.73638 398.94774
8730.0000 -140.96644 -137.99881 2.96764 1.82012 -138.55847 407.57865
8735.0000 -141.34675 -138.55314 2.79361 1.86824 -137.85411 448.09211
8740.0000 -141.47169 -138.55716 2.91454 1.83067 -138.40409 414.97342
8745.0000 -141.66580 -138.96042 2.70537 1.83682 -138.31405 423.59396
8750.0000 -141.56144 -138.78826 2.77318 1.79918 -138.86507 391.17947
FREEZING PROCESS: loop number 36 T-loop= 391.00000000000000
main_MD> interactions number 36 at Temperature= 391.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.69368 -3.34736 2.67626
force_rgl> df(natom) -1.03019 -0.67019 0.22921
8755.0000 -141.86811 -138.94726 2.92085 1.78769 -139.03314 372.99003
8760.0000 -141.19629 -138.01646 3.17983 1.84279 -138.22666 425.68976
8765.0000 -141.20247 -138.75223 2.45025 1.82133 -138.54076 407.65805
8770.0000 -141.68970 -138.60569 3.08401 1.83805 -138.29609 415.88614
8775.0000 -141.78255 -139.17544 2.60711 1.79967 -138.85781 385.66304
8780.0000 -141.47254 -138.76962 2.70292 1.79340 -138.94966 377.51040
8785.0000 -141.74698 -139.03779 2.70920 1.78516 -139.07022 373.07980
8790.0000 -141.39102 -138.87993 2.51108 1.77945 -139.15383 367.59623
8795.0000 -141.71339 -139.15585 2.55755 1.78608 -139.05676 375.76501
8800.0000 -141.44695 -138.67427 2.77268 1.80605 -138.76447 390.44421
8805.0000 -141.73723 -138.94418 2.79305 1.81893 -138.57588 403.05634
8810.0000 -142.10639 -139.23639 2.87000 1.78828 -139.02450 371.13899
8815.0000 -141.92893 -139.75780 2.17113 1.76967 -139.29698 356.51094
8820.0000 -142.12598 -139.76293 2.36305 1.75095 -139.57092 338.29283
8825.0000 -141.36822 -138.69091 2.67730 1.76928 -139.30268 356.17571
8830.0000 -141.83365 -139.34874 2.48492 1.77606 -139.20336 364.94383
8835.0000 -141.68106 -139.06000 2.62106 1.78649 -139.05077 374.83062
8840.0000 -142.07687 -139.52741 2.54946 1.76329 -139.39028 351.02976
8845.0000 -142.04885 -138.88793 3.16092 1.77075 -139.28107 361.71021
8850.0000 -140.69195 -137.70710 2.98485 1.82015 -138.55808 406.97763
8855.0000 -141.53552 -138.71608 2.81944 1.82584 -138.47477 407.15890
8860.0000 -141.81595 -139.06332 2.75262 1.80047 -138.84613 390.22793
8865.0000 -141.39634 -139.03131 2.36503 1.78428 -139.08308 369.54001
8870.0000 -141.60991 -138.80600 2.80391 1.80217 -138.82122 390.18127
8875.0000 -141.36838 -138.70506 2.66331 1.79284 -138.95783 382.34319
8880.0000 -141.16356 -138.19618 2.96738 1.83232 -138.37993 418.95779
8885.0000 -142.01778 -139.45046 2.56731 1.79261 -138.96113 375.30365
8890.0000 -141.40983 -138.76451 2.64531 1.77305 -139.24744 364.38686
8895.0000 -141.42888 -138.44307 2.98581 1.80697 -138.75104 388.80557
8900.0000 -141.80286 -138.46736 3.33550 1.82098 -138.54597 402.73720
8905.0000 -141.48856 -139.17425 2.31431 1.78831 -139.02408 376.58161
8910.0000 -141.47165 -138.97115 2.50051 1.78681 -139.04599 372.44533
8915.0000 -141.72692 -138.79102 2.93591 1.81058 -138.69819 391.41861
8920.0000 -141.88803 -139.18735 2.70068 1.79283 -138.95800 379.90116
8925.0000 -141.75491 -138.85885 2.89606 1.79178 -138.97325 380.84468
8930.0000 -141.65515 -138.79864 2.85652 1.77464 -139.22425 365.44885
8935.0000 -141.71193 -138.80428 2.90764 1.82824 -138.43965 409.80995
8940.0000 -141.65136 -139.00559 2.64578 1.79293 -138.95649 380.26342
8945.0000 -141.99821 -139.19576 2.80245 1.77113 -139.27555 364.01232
8950.0000 -141.35992 -138.97804 2.38188 1.80700 -138.75055 398.12296
8955.0000 -141.26478 -138.85841 2.40637 1.81558 -138.62491 398.33425
8960.0000 -141.96534 -139.03654 2.92880 1.82060 -138.55148 406.37353
8965.0000 -141.82719 -138.95038 2.87681 1.77051 -139.28458 364.66558
8970.0000 -141.54925 -138.66802 2.88123 1.79239 -138.96434 372.65432
8975.0000 -141.70344 -139.33768 2.36575 1.77938 -139.15481 367.60576
8980.0000 -141.72739 -138.71704 3.01035 1.77296 -139.24874 365.75287
8985.0000 -141.78664 -138.82146 2.96517 1.78664 -139.04860 375.18396
8990.0000 -142.09569 -139.09285 3.00284 1.78456 -139.07902 369.75350
8995.0000 -141.25324 -138.24653 3.00672 1.81840 -138.58368 404.30525
9000.0000 -141.63692 -138.55725 3.07967 1.83303 -138.36957 416.79846
FREEZING PROCESS: loop number 37 T-loop= 366.00000000000000
main_MD> interactions number 37 at Temperature= 366.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.23652 1.37951 -0.25369
force_rgl> df(natom) 0.82399 -1.23999 -1.92734
9005.0000 -141.90061 -139.24040 2.66020 1.80076 -138.84190 393.65247
9010.0000 -141.89750 -139.40976 2.48774 1.78273 -139.10578 373.33849
9015.0000 -142.28450 -139.76034 2.52415 1.73936 -139.74053 332.68266
9020.0000 -142.17796 -139.64001 2.53796 1.75201 -139.55542 346.36075
9025.0000 -141.76966 -139.29097 2.47869 1.76379 -139.38296 359.39567
9030.0000 -141.50232 -138.92882 2.57350 1.78673 -139.04726 379.07436
9035.0000 -140.93842 -138.15966 2.77876 1.81539 -138.62770 402.45144
9040.0000 -141.75265 -137.92144 3.83121 1.85439 -138.05685 438.08473
9045.0000 -141.47705 -139.04812 2.42893 1.80828 -138.73177 391.04299
9050.0000 -141.22942 -138.50418 2.72524 1.79858 -138.87380 387.62144
9055.0000 -141.79462 -139.40366 2.39096 1.77735 -139.18457 362.72921
9060.0000 -141.48104 -138.44999 3.03106 1.79813 -138.88041 386.18843
9065.0000 -141.22649 -138.73855 2.48795 1.81080 -138.69490 390.69370
9070.0000 -141.76173 -138.66821 3.09351 1.81529 -138.62919 400.11340
9075.0000 -141.79190 -138.94988 2.84202 1.80487 -138.78165 384.51408
9080.0000 -142.01077 -139.29585 2.71492 1.76886 -139.30875 364.98260
9085.0000 -142.12298 -139.43294 2.69004 1.76355 -139.38654 359.21700
9090.0000 -141.82540 -139.20938 2.61602 1.77223 -139.25944 370.67213
9095.0000 -142.02621 -139.58468 2.44153 1.77063 -139.28288 363.18772
9100.0000 -141.82154 -139.11566 2.70588 1.76337 -139.38921 358.47139
9105.0000 -141.82706 -139.16860 2.65845 1.77229 -139.25864 368.24894
9110.0000 -141.99728 -139.54054 2.45674 1.76339 -139.38882 360.25518
9115.0000 -142.28836 -139.74138 2.54698 1.75773 -139.47172 345.27394
9120.0000 -142.06559 -139.53557 2.53003 1.74536 -139.65278 335.61238
9125.0000 -141.75635 -139.31610 2.44025 1.77753 -139.18192 369.12956
9130.0000 -141.46875 -138.78913 2.67962 1.80348 -138.80206 388.17677
9135.0000 -141.70440 -139.05532 2.64908 1.78729 -139.03911 380.67861
9140.0000 -142.02848 -139.48264 2.54584 1.78648 -139.05086 376.39772
9145.0000 -141.76642 -138.68359 3.08284 1.76296 -139.39517 353.92051
9150.0000 -141.98105 -139.65437 2.32668 1.79408 -138.93961 379.10945
9155.0000 -141.94631 -138.83893 3.10738 1.79926 -138.86379 386.30508
9160.0000 -142.17118 -139.70244 2.46874 1.76149 -139.41674 349.39700
9165.0000 -141.39075 -138.58189 2.80885 1.77264 -139.25342 362.96204
9170.0000 -141.94014 -139.63445 2.30570 1.78775 -139.03223 374.33303
9175.0000 -141.71567 -139.14954 2.56613 1.76789 -139.32303 353.97024
9180.0000 -141.85965 -138.64918 3.21047 1.79955 -138.85957 383.44082
9185.0000 -141.78609 -138.66969 3.11640 1.79487 -138.92810 379.12378
9190.0000 -142.21739 -139.65603 2.56136 1.78623 -139.05458 371.14336
9195.0000 -142.09198 -139.62155 2.47043 1.75388 -139.52805 347.23182
9200.0000 -142.10981 -139.88525 2.22456 1.72493 -139.95178 321.51068
9205.0000 -142.13947 -139.43137 2.70810 1.75004 -139.58432 346.06148
9210.0000 -141.64403 -139.25778 2.38624 1.76695 -139.33680 356.49370
9215.0000 -141.73387 -138.44043 3.29345 1.78864 -139.01933 378.12179
9220.0000 -142.14195 -139.46659 2.67536 1.77843 -139.16872 368.29394
9225.0000 -142.26148 -139.14801 3.11347 1.80066 -138.84333 386.09346
9230.0000 -141.06704 -138.55297 2.51406 1.80108 -138.83722 389.29759
9235.0000 -141.32009 -138.69342 2.62667 1.80509 -138.77855 391.60353
9240.0000 -141.99045 -139.39651 2.59394 1.79409 -138.93947 380.26409
9245.0000 -142.16475 -139.14361 3.02114 1.78359 -139.09320 377.43169
9250.0000 -141.65238 -138.88083 2.77155 1.80167 -138.82848 397.62355
FREEZING PROCESS: loop number 38 T-loop= 341.00000000000000
main_MD> interactions number 38 at Temperature= 341.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.48148 1.56431 -1.11433
force_rgl> df(natom) 0.77542 -2.94124 -0.63878
9255.0000 -142.52586 -139.81789 2.70797 1.75649 -139.48991 351.18809
9260.0000 -142.41704 -139.78710 2.62994 1.73860 -139.75174 328.92089
9265.0000 -142.51112 -140.19594 2.31518 1.76020 -139.43559 357.46674
9270.0000 -142.48910 -140.17377 2.31533 1.72131 -140.00474 318.70630
9275.0000 -142.53316 -140.45078 2.08238 1.70664 -140.21954 307.02371
9280.0000 -142.74331 -140.22925 2.51406 1.71033 -140.16546 306.07093
9285.0000 -142.25796 -140.25850 1.99945 1.72320 -139.97721 319.64127
9290.0000 -142.53861 -140.34004 2.19857 1.69218 -140.43123 285.54828
9295.0000 -142.45934 -140.03114 2.42820 1.70458 -140.24966 300.14098
9300.0000 -142.29121 -139.87202 2.41919 1.72785 -139.90906 324.24078
9305.0000 -141.83125 -139.48151 2.34974 1.75007 -139.58389 346.46599
9310.0000 -142.14699 -139.49715 2.64984 1.74734 -139.62383 350.76104
9315.0000 -141.89643 -139.56642 2.33001 1.74957 -139.59111 341.42190
9320.0000 -142.00083 -139.80728 2.19355 1.73923 -139.74243 333.47889
9325.0000 -142.26898 -139.81098 2.45800 1.76333 -139.38971 357.65649
9330.0000 -142.51340 -140.71106 1.80233 1.70087 -140.30402 297.22059
9335.0000 -142.13638 -139.33409 2.80230 1.72756 -139.91331 324.19974
9340.0000 -141.10843 -138.62832 2.48012 1.77431 -139.22899 370.18701
9345.0000 -142.13787 -139.70258 2.43529 1.77902 -139.16002 367.44806
9350.0000 -141.68805 -139.58977 2.09828 1.74241 -139.69593 331.56849
9355.0000 -141.81567 -138.80558 3.01009 1.76525 -139.36165 352.98670
9360.0000 -142.06783 -139.96747 2.10037 1.75805 -139.46703 348.95362
9365.0000 -142.21841 -140.02451 2.19390 1.74113 -139.71471 327.09568
9370.0000 -142.27872 -140.03341 2.24530 1.73643 -139.78348 328.08438
9375.0000 -141.60810 -139.44941 2.15869 1.73102 -139.86271 319.52633
9380.0000 -142.50451 -139.65823 2.84628 1.72244 -139.98832 310.66782
9385.0000 -142.50973 -140.60442 1.90531 1.70139 -140.29632 290.75827
9390.0000 -141.53309 -139.12995 2.40314 1.75957 -139.44474 344.29613
9395.0000 -142.12720 -139.96102 2.16618 1.72317 -139.97756 311.91206
9400.0000 -142.82301 -140.40976 2.41326 1.71391 -140.11314 310.06101
9405.0000 -141.79269 -139.75294 2.03975 1.71595 -140.08331 314.62737
9410.0000 -142.27590 -139.85837 2.41753 1.74404 -139.67214 336.26524
9415.0000 -142.10989 -139.65296 2.45693 1.74510 -139.65664 336.79533
9420.0000 -142.02759 -139.74471 2.28288 1.74785 -139.61640 343.31061
9425.0000 -142.05997 -139.25334 2.80663 1.76806 -139.32054 362.63663
9430.0000 -141.55769 -139.05890 2.49880 1.76596 -139.35131 351.73757
9435.0000 -141.91865 -139.71293 2.20572 1.77414 -139.23151 364.07134
9440.0000 -142.21750 -140.07184 2.14567 1.72964 -139.88294 318.98001
9445.0000 -142.30832 -140.25038 2.05794 1.71748 -140.06083 310.19671
9450.0000 -142.45006 -139.77003 2.68003 1.72275 -139.98374 321.61186
9455.0000 -142.00484 -139.56573 2.43910 1.75112 -139.56844 345.51846
9460.0000 -141.76496 -139.09512 2.66984 1.74502 -139.65774 338.83196
9465.0000 -142.72582 -139.80519 2.92064 1.76217 -139.40669 353.23689
9470.0000 -141.90590 -139.90515 2.00075 1.73602 -139.78944 325.61966
9475.0000 -141.98377 -139.26723 2.71654 1.76253 -139.40148 353.61081
9480.0000 -142.09070 -139.48817 2.60253 1.75510 -139.51028 341.51761
9485.0000 -141.95032 -139.55576 2.39456 1.74685 -139.63095 340.41255
9490.0000 -142.28675 -139.78676 2.49999 1.74052 -139.72369 337.73543
9495.0000 -141.75918 -139.46662 2.29256 1.74311 -139.68576 339.75832
9500.0000 -142.34104 -140.16485 2.17619 1.72538 -139.94526 319.71696
FREEZING PROCESS: loop number 39 T-loop= 316.00000000000000
main_MD> interactions number 39 at Temperature= 316.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.83673 -0.41556 -0.98136
force_rgl> df(natom) 1.62500 -0.08735 0.32095
9505.0000 -142.16337 -139.85690 2.30647 1.71920 -140.03565 313.84839
9510.0000 -142.55682 -140.33617 2.22065 1.71653 -140.07481 312.63984
9515.0000 -142.19312 -140.05468 2.13844 1.71701 -140.06769 313.13764
9520.0000 -142.03122 -139.84868 2.18253 1.73439 -139.81338 327.81431
9525.0000 -142.63982 -140.52401 2.11582 1.72025 -140.02035 319.85200
9530.0000 -142.04129 -140.21110 1.83019 1.70791 -140.20091 302.54007
9535.0000 -142.20182 -139.86983 2.33199 1.72868 -139.89689 322.00202
9540.0000 -142.33797 -139.94259 2.39538 1.72830 -139.90253 325.12751
9545.0000 -142.07573 -140.00286 2.07287 1.71860 -140.04442 316.05189
9550.0000 -142.32183 -140.12533 2.19650 1.71322 -140.12315 311.70448
9555.0000 -142.79413 -140.47782 2.31630 1.68421 -140.54778 283.68749
9560.0000 -142.47702 -140.30665 2.17037 1.69295 -140.41998 292.56112
9565.0000 -142.21944 -139.68506 2.53438 1.72172 -139.99876 313.91321
9570.0000 -142.60729 -140.11889 2.48840 1.71231 -140.13652 303.44559
9575.0000 -142.10760 -139.80244 2.30515 1.72549 -139.94369 319.46112
9580.0000 -142.55859 -139.90650 2.65209 1.71873 -140.04250 313.08882
9585.0000 -142.40175 -139.78485 2.61690 1.74221 -139.69883 336.87640
9590.0000 -141.96022 -139.63575 2.32447 1.71465 -140.10222 308.79067
9595.0000 -142.35294 -139.69876 2.65418 1.77712 -139.18793 368.55148
9600.0000 -141.73550 -139.12181 2.61369 1.75187 -139.55749 342.29152
9605.0000 -141.14969 -138.73334 2.41636 1.78856 -139.02052 378.43478
9610.0000 -142.41358 -139.22658 3.18700 1.78258 -139.10803 375.78431
9615.0000 -142.49575 -139.96137 2.53439 1.74161 -139.70767 334.34563
9620.0000 -142.18816 -140.11604 2.07212 1.73758 -139.76660 330.07280
9625.0000 -142.54277 -140.02766 2.51511 1.72306 -139.97925 314.12826
9630.0000 -142.18468 -139.83232 2.35236 1.72795 -139.90760 314.84119
9635.0000 -142.57481 -139.81285 2.76196 1.73444 -139.81267 323.77847
9640.0000 -142.30487 -140.15425 2.15062 1.71974 -140.02781 310.72724
9645.0000 -142.38606 -139.98903 2.39703 1.72256 -139.98645 312.78870
9650.0000 -142.41610 -140.70954 1.70656 1.70112 -140.30036 294.30959
9655.0000 -142.68776 -141.05814 1.62962 1.65322 -141.00142 244.47793
9660.0000 -142.68913 -140.21096 2.47817 1.67549 -140.67548 265.68638
9665.0000 -142.39192 -140.42324 1.96869 1.71067 -140.16057 303.06041
9670.0000 -142.26978 -139.99194 2.27783 1.69724 -140.35708 292.85081
9675.0000 -142.39014 -140.09081 2.29933 1.71664 -140.07315 308.95369
9680.0000 -142.76628 -140.68720 2.07908 1.68111 -140.59315 278.16096
9685.0000 -142.51673 -139.95258 2.56414 1.70244 -140.28094 295.76284
9690.0000 -142.70026 -140.33271 2.36755 1.70935 -140.17992 308.10189
9695.0000 -141.86018 -139.92277 1.93741 1.71764 -140.05853 312.41011
9700.0000 -142.11058 -138.93530 3.17529 1.75370 -139.53069 350.61892
9705.0000 -142.14909 -139.43124 2.71785 1.77134 -139.27252 361.71264
9710.0000 -142.38980 -140.18991 2.19990 1.74537 -139.65268 336.62731
9715.0000 -142.44149 -139.97853 2.46296 1.70436 -140.25296 301.78626
9720.0000 -142.25715 -140.01702 2.24013 1.71916 -140.03622 316.76366
9725.0000 -142.46171 -139.67564 2.78607 1.72824 -139.90342 320.39000
9730.0000 -142.22014 -139.87961 2.34053 1.72799 -139.90699 317.22941
9735.0000 -142.00024 -140.23939 1.76085 1.72790 -139.90832 320.09127
9740.0000 -141.78424 -139.44691 2.33733 1.73052 -139.86999 329.73781
9745.0000 -142.22313 -139.97842 2.24471 1.73679 -139.77827 325.58555
9750.0000 -142.58729 -140.33606 2.25123 1.71855 -140.04516 308.66893
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 13 [min], 15.0269443 [s].
main_MD> Deallocating global variables
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