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nanoparticlesims/growth_Melting_Silver_ICO_4091/freezeSims/run_49/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_49.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 = 49 ntipo2 = 0
read_input> Finish reading input
main_MD> Allocating global variables
main_MD> Number of outputs that will be created: 1850
main_MD> Size of nv and nvoiz: 49 4900
main_MD> Size of nv and nvoiz: 49 4900
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 = 49
main_MD> Consider changing parameter nsiz in module_parameters.f90 for performance
main_MD> collvar_wanted = F
main_MD> INPUT AND POTENTIAL FILE READING IS DONE
main_MD> THERMALIZATION IS STARTING
init> 0.15574589806665196 4.3318347555956434E-002 -0.12000835538238092 initial drift of cluster / NP1 for coalescence
init> 0.33120910367146572 0.31160341644784983 0.29157738022094754 scaling for velocity /for coalescence NP1
init.f90 > facguy = 3.7837585142496124E-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) 4.60828 0.76343 1.34455
force_rgl> df(natom) 0.62330 -0.36832 -2.57879
preparo> THERMALIZATION PROCESS AT 1243.8337154367878
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -105.69812298858494 8.8944575334805016 -114.59258052206545 6.2297013670469643E-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 37
FREEZING PROCESS: loop number 1 T-loop= 1217.0000000000000
main_MD> interactions number 1 at Temperature= 1217.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -4.82909 -4.34545 0.24915
force_rgl> df(natom) 2.03604 7.28314 4.96011
5.0000 -113.47325 -104.89906 8.57418 3.00632 -104.29380 1232.70654
10.0000 -114.43839 -105.67623 8.76216 2.87904 -105.99810 1207.13440
15.0000 -112.71391 -106.11964 6.59427 2.85360 -106.33877 1155.54446
20.0000 -110.72939 -103.29325 7.43614 2.94391 -105.12956 1195.78109
25.0000 -112.74177 -103.73543 9.00634 3.13279 -102.60032 1364.02878
30.0000 -110.97842 -105.24661 5.73181 2.91828 -105.47277 1252.30390
35.0000 -111.45789 -103.12982 8.32808 2.94182 -105.15754 1186.80266
40.0000 -113.10906 -106.16799 6.94108 3.02245 -104.07789 1310.60968
45.0000 -114.11287 -107.18903 6.92385 2.78337 -107.27928 1071.17853
50.0000 -113.03623 -103.82745 9.20878 2.92484 -105.38487 1224.84629
55.0000 -110.20935 -101.99336 8.21599 3.18641 -101.88238 1397.59804
60.0000 -111.48375 -102.33041 9.15334 3.19687 -101.74228 1450.99716
65.0000 -112.30562 -105.28413 7.02149 2.99447 -104.45244 1213.88163
70.0000 -113.42671 -104.97184 8.45487 2.97733 -104.68195 1304.21774
75.0000 -113.28495 -106.34359 6.94137 2.92223 -105.41985 1278.50515
80.0000 -114.21000 -105.64775 8.56226 2.85207 -106.35930 1137.11420
85.0000 -111.40071 -104.33411 7.06659 2.94400 -105.12825 1254.24583
90.0000 -111.33023 -105.21750 6.11274 2.98409 -104.59142 1264.09856
95.0000 -113.17226 -104.75878 8.41348 2.94039 -105.17666 1236.94355
100.0000 -112.84388 -105.57390 7.26997 2.99189 -104.48700 1293.15168
105.0000 -111.86292 -103.17428 8.68864 2.98384 -104.59483 1259.42337
110.0000 -111.08649 -103.88961 7.19687 3.07157 -103.42009 1346.86657
115.0000 -113.26794 -105.70538 7.56256 2.90153 -105.69703 1175.55847
120.0000 -113.78734 -105.77624 8.01110 2.94302 -105.14143 1248.57011
125.0000 -116.11215 -107.09590 9.01625 2.82532 -106.71756 1135.85371
130.0000 -114.25247 -108.03015 6.22232 2.74284 -107.82191 1092.55392
135.0000 -113.94938 -106.17912 7.77026 2.85248 -106.35381 1140.41864
140.0000 -113.87068 -105.05715 8.81352 2.91286 -105.54525 1182.47354
145.0000 -113.82151 -107.16669 6.65482 2.95258 -105.01336 1288.63206
150.0000 -112.68768 -104.16642 8.52126 2.92448 -105.38974 1259.59605
155.0000 -113.08112 -105.68638 7.39474 2.98415 -104.59067 1232.84795
160.0000 -111.94991 -104.07909 7.87082 2.95759 -104.94637 1243.72149
165.0000 -110.89802 -102.79728 8.10073 3.16558 -102.16128 1356.47850
170.0000 -111.34731 -103.74300 7.60431 3.03100 -103.96334 1310.97009
175.0000 -110.43268 -101.80327 8.62941 3.10597 -102.95950 1308.95573
180.0000 -110.76752 -102.18056 8.58697 3.05760 -103.60719 1297.18475
185.0000 -110.96009 -103.20775 7.75234 3.18198 -101.94159 1431.70404
190.0000 -112.74597 -104.48365 8.26232 3.06737 -103.47629 1358.03685
195.0000 -111.80321 -104.87188 6.93134 2.96226 -104.88385 1275.76743
200.0000 -114.19950 -107.26023 6.93927 2.84390 -106.46872 1141.69392
205.0000 -114.87303 -107.96821 6.90482 2.78742 -107.22500 1083.45384
210.0000 -114.21682 -107.49362 6.72320 2.78771 -107.22108 1158.98553
215.0000 -115.17729 -107.23147 7.94583 2.73596 -107.91407 1083.43305
220.0000 -113.32416 -106.25112 7.07303 2.84511 -106.45252 1173.18648
225.0000 -113.54542 -106.12586 7.41956 2.92017 -105.44736 1225.17172
230.0000 -112.14652 -104.39077 7.75575 2.92944 -105.32332 1212.24314
235.0000 -113.56520 -106.63459 6.93061 2.91207 -105.55587 1202.02833
240.0000 -112.35517 -104.63001 7.72516 2.89144 -105.83216 1232.67827
245.0000 -110.86986 -103.65490 7.21496 2.99678 -104.42158 1289.67383
250.0000 -112.18456 -104.61905 7.56551 2.99444 -104.45296 1251.40582
FREEZING PROCESS: loop number 2 T-loop= 1192.0000000000000
main_MD> interactions number 2 at Temperature= 1192.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.99764 -0.94546 -3.77505
force_rgl> df(natom) -5.82145 7.23838 1.39891
255.0000 -113.33240 -103.48259 9.84981 2.95391 -104.99557 1195.28105
260.0000 -111.84282 -104.06773 7.77509 3.03857 -103.86192 1251.91453
265.0000 -114.17454 -105.41580 8.75874 2.97441 -104.72105 1258.35310
270.0000 -113.03228 -105.50459 7.52769 2.89120 -105.83540 1218.52440
275.0000 -114.35262 -104.94458 9.40804 2.92348 -105.40306 1252.00430
280.0000 -111.91849 -104.68977 7.22873 2.98100 -104.63282 1217.16614
285.0000 -113.95892 -106.53327 7.42566 2.95989 -104.91558 1186.78092
290.0000 -113.65536 -106.08316 7.57219 2.87452 -106.05869 1175.94488
295.0000 -113.73070 -104.71509 9.01561 2.90091 -105.70525 1191.92114
300.0000 -112.36992 -103.88490 8.48503 2.97888 -104.66126 1269.83627
305.0000 -113.72839 -104.27321 9.45518 2.96011 -104.91262 1222.98975
310.0000 -112.11956 -104.15744 7.96211 2.97979 -104.64909 1269.51588
315.0000 -113.35420 -106.38932 6.96488 2.93862 -105.20036 1231.61495
320.0000 -113.86176 -105.86080 8.00095 2.85532 -106.31583 1146.00462
325.0000 -111.83687 -104.46641 7.37046 2.92527 -105.37907 1209.93542
330.0000 -113.11859 -105.17258 7.94601 2.93267 -105.28002 1244.50992
335.0000 -112.09324 -104.20546 7.88779 2.94723 -105.08504 1220.81091
340.0000 -112.75724 -104.39455 8.36269 3.05305 -103.66812 1252.80237
345.0000 -111.48799 -104.57505 6.91294 2.99575 -104.43536 1260.92300
350.0000 -112.83619 -104.38128 8.45491 3.05028 -103.70523 1286.97180
355.0000 -113.33354 -106.10364 7.22989 2.95144 -105.02871 1211.96129
360.0000 -114.19021 -106.97845 7.21176 2.85246 -106.35415 1189.59634
365.0000 -113.44021 -106.91504 6.52517 2.80643 -106.97047 1110.42572
370.0000 -112.39020 -104.51011 7.88008 2.92396 -105.39663 1208.29615
375.0000 -113.74112 -105.66914 8.07198 2.92311 -105.40801 1186.29437
380.0000 -113.96411 -106.42746 7.53665 2.81033 -106.91819 1121.88976
385.0000 -113.14018 -106.13313 7.00706 2.86852 -106.13902 1167.32904
390.0000 -113.34347 -105.13711 8.20636 2.90677 -105.62678 1192.24373
395.0000 -112.44460 -105.50133 6.94327 2.92518 -105.38038 1223.07556
400.0000 -114.83059 -107.39512 7.43547 2.86370 -106.20357 1122.52540
405.0000 -114.21320 -107.70257 6.51063 2.73897 -107.87371 1084.15880
410.0000 -113.38628 -104.08983 9.29645 2.89969 -105.72162 1165.78629
415.0000 -113.72786 -105.44817 8.27969 2.94809 -105.07359 1197.59893
420.0000 -113.45074 -106.79594 6.65480 2.88728 -105.88785 1157.67438
425.0000 -112.01233 -104.96210 7.05022 2.82991 -106.65606 1133.05450
430.0000 -112.65912 -104.49101 8.16811 3.00588 -104.29977 1276.51462
435.0000 -114.43634 -108.10020 6.33614 2.92494 -105.38351 1165.63994
440.0000 -113.41034 -104.87015 8.54019 2.77708 -107.36349 1072.38006
445.0000 -112.45976 -104.68040 7.77936 2.97415 -104.72455 1284.17027
450.0000 -110.82948 -104.77707 6.05241 2.89857 -105.73658 1174.40423
455.0000 -112.34439 -104.67612 7.66827 2.93900 -105.19530 1193.94046
460.0000 -113.73881 -106.87754 6.86127 2.91966 -105.45428 1170.78134
465.0000 -114.87763 -105.71886 9.15877 2.82582 -106.71077 1207.17610
470.0000 -112.57822 -105.83090 6.74733 2.86827 -106.14242 1228.78843
475.0000 -113.03262 -105.76742 7.26519 2.84674 -106.43070 1192.92346
480.0000 -112.78337 -105.02045 7.76292 2.95375 -104.99780 1226.97181
485.0000 -113.18840 -105.12379 8.06461 2.92208 -105.42180 1215.67472
490.0000 -114.55607 -107.07649 7.47958 2.87767 -106.01651 1192.53811
495.0000 -112.66545 -104.88231 7.78314 2.93004 -105.31525 1229.64192
500.0000 -113.57370 -106.21264 7.36105 2.89555 -105.77704 1191.98300
FREEZING PROCESS: loop number 3 T-loop= 1167.0000000000000
main_MD> interactions number 3 at Temperature= 1167.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.17767 -1.82466 0.61843
force_rgl> df(natom) 3.91215 0.66635 0.34961
505.0000 -110.80834 -103.80280 7.00555 2.98091 -104.63408 1273.62906
510.0000 -113.09077 -105.80419 7.28657 3.01291 -104.20552 1272.64831
515.0000 -114.05746 -105.94700 8.11046 2.88307 -105.94415 1190.68823
520.0000 -112.47037 -103.22129 9.24908 2.96700 -104.82039 1240.69601
525.0000 -110.88220 -102.76749 8.11470 3.10353 -102.99218 1361.81067
530.0000 -112.12213 -104.85238 7.26976 3.01685 -104.15279 1257.84844
535.0000 -113.06186 -104.76884 8.29303 2.92240 -105.41759 1202.58641
540.0000 -112.36297 -104.48008 7.88290 3.01644 -104.15832 1292.38629
545.0000 -115.37001 -108.37993 6.99009 2.78915 -107.20183 1094.53258
550.0000 -113.82790 -106.53046 7.29744 2.76975 -107.46155 1106.40907
555.0000 -112.04219 -104.17503 7.86715 2.93265 -105.28029 1202.75880
560.0000 -111.30754 -102.68511 8.62243 3.07251 -103.40754 1341.49601
565.0000 -114.45854 -106.38986 8.06868 3.01767 -104.14180 1316.65899
570.0000 -112.78668 -104.08043 8.70626 2.88253 -105.95145 1151.05169
575.0000 -111.58719 -104.07024 7.51695 3.00320 -104.33563 1254.75934
580.0000 -111.96797 -102.22216 9.74581 3.04263 -103.80759 1256.76485
585.0000 -112.26191 -103.51223 8.74968 3.08067 -103.29827 1344.50549
590.0000 -112.44474 -103.84450 8.60024 3.04271 -103.80653 1305.84219
595.0000 -114.02536 -106.38016 7.64520 2.95379 -104.99719 1218.02965
600.0000 -113.69350 -106.35181 7.34169 2.77742 -107.35894 1126.78564
605.0000 -112.13027 -105.28209 6.84818 2.92906 -105.32837 1263.51757
610.0000 -111.26463 -103.37968 7.88495 3.02107 -104.09629 1284.28826
615.0000 -112.61962 -105.00218 7.61744 2.98069 -104.63700 1280.78943
620.0000 -112.93990 -106.13573 6.80417 2.89564 -105.77594 1234.71862
625.0000 -112.65783 -106.06784 6.58999 2.87623 -106.03582 1227.10159
630.0000 -111.74071 -105.28362 6.45709 2.93392 -105.26327 1235.23812
635.0000 -113.77255 -107.40365 6.36891 2.82638 -106.70328 1134.08895
640.0000 -113.36740 -106.53606 6.83134 2.88105 -105.97120 1158.19399
645.0000 -113.23248 -107.47721 5.75527 2.90501 -105.65044 1222.31127
650.0000 -112.70684 -104.14099 8.56585 2.92389 -105.39765 1220.84810
655.0000 -114.32640 -106.29818 8.02822 2.99756 -104.41114 1250.90526
660.0000 -113.58140 -105.96001 7.62138 2.90163 -105.69569 1188.40416
665.0000 -112.60594 -105.30822 7.29772 2.93760 -105.21404 1211.27897
670.0000 -114.21144 -106.86948 7.34196 2.89986 -105.71938 1179.00365
675.0000 -114.09677 -107.71129 6.38547 2.76640 -107.50644 1078.83198
680.0000 -114.18786 -105.75080 8.43706 2.80870 -106.94009 1137.29694
685.0000 -113.47165 -106.13823 7.33342 2.90422 -105.66098 1189.11981
690.0000 -112.59726 -104.69409 7.90318 2.91566 -105.50786 1222.45813
695.0000 -113.77705 -105.97200 7.80505 2.86247 -106.22002 1179.04581
700.0000 -112.71747 -105.65731 7.06016 2.84514 -106.45211 1138.51321
705.0000 -111.34272 -105.52909 5.81363 2.89837 -105.73936 1190.89666
710.0000 -114.43868 -106.25290 8.18578 2.86513 -106.18439 1198.47485
715.0000 -114.72046 -107.41261 7.30784 2.82063 -106.78031 1125.06859
720.0000 -114.19390 -106.98816 7.20574 2.86115 -106.23770 1186.45489
725.0000 -113.39658 -106.03559 7.36099 2.79998 -107.05680 1093.79918
730.0000 -113.08791 -106.05073 7.03718 2.86819 -106.14348 1174.84643
735.0000 -115.16221 -107.55767 7.60454 2.85911 -106.26497 1158.08572
740.0000 -113.98802 -108.75979 5.22824 2.83829 -106.54378 1107.11729
745.0000 -113.32710 -106.12768 7.19942 2.80701 -106.96265 1120.00596
750.0000 -114.51265 -106.20511 8.30754 2.86672 -106.16308 1204.50106
FREEZING PROCESS: loop number 4 T-loop= 1142.0000000000000
main_MD> interactions number 4 at Temperature= 1142.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.31613 -2.50110 -2.46391
force_rgl> df(natom) -4.56927 1.14490 1.56155
755.0000 -115.11442 -107.09244 8.02198 2.78411 -107.26929 1108.40617
760.0000 -114.32039 -107.41712 6.90327 2.78032 -107.32013 1091.46572
765.0000 -112.27983 -107.41055 4.86928 2.76246 -107.55920 1079.94035
770.0000 -112.15561 -105.20841 6.94721 2.91834 -105.47191 1196.03347
775.0000 -114.10793 -106.65787 7.45006 2.88127 -105.96833 1149.57676
780.0000 -113.63948 -107.18675 6.45273 2.79782 -107.08580 1114.12776
785.0000 -113.43727 -107.16971 6.26756 2.80159 -107.03528 1106.54910
790.0000 -112.79692 -105.38465 7.41227 2.84578 -106.44348 1145.50022
795.0000 -112.50283 -105.10113 7.40170 2.99497 -104.44579 1280.61052
800.0000 -113.25753 -105.04152 8.21601 2.89404 -105.79725 1189.00145
805.0000 -114.19491 -104.57629 9.61862 2.94837 -105.06979 1215.62507
810.0000 -113.23670 -106.81667 6.42003 2.83678 -106.56400 1138.19329
815.0000 -113.45840 -105.60014 7.85826 2.95820 -104.93811 1235.09319
820.0000 -112.64592 -105.17638 7.46954 2.98804 -104.53866 1237.16435
825.0000 -112.25688 -105.58925 6.66763 2.95430 -104.99040 1223.15154
830.0000 -114.62012 -107.00770 7.61242 2.84803 -106.41342 1151.01801
835.0000 -113.94250 -106.54504 7.39745 2.86398 -106.19977 1131.67789
840.0000 -113.14718 -106.01157 7.13561 2.83346 -106.60853 1137.54629
845.0000 -114.42855 -105.84355 8.58499 2.85757 -106.28565 1165.04988
850.0000 -112.29306 -104.86244 7.43061 2.90690 -105.62514 1206.08877
855.0000 -112.77331 -106.20061 6.57270 2.91698 -105.49010 1198.94786
860.0000 -114.06845 -107.33622 6.73223 2.72735 -108.02931 1079.84621
865.0000 -114.85302 -107.56120 7.29182 2.77718 -107.36212 1117.79417
870.0000 -115.53801 -108.79265 6.74536 2.71953 -108.13406 1078.10340
875.0000 -115.88292 -108.92370 6.95921 2.68607 -108.58212 1040.83642
880.0000 -115.52604 -107.12810 8.39794 2.76050 -107.58552 1117.90969
885.0000 -114.47251 -108.09483 6.37769 2.77804 -107.35062 1112.03569
890.0000 -114.84337 -106.11858 8.72479 2.81176 -106.89912 1132.22468
895.0000 -114.10171 -107.72587 6.37584 2.81904 -106.80153 1140.26346
900.0000 -114.64791 -107.37631 7.27160 2.72712 -108.03239 1044.20259
905.0000 -114.18945 -105.99200 8.19745 2.83228 -106.62432 1147.10727
910.0000 -114.42017 -107.38100 7.03917 2.89774 -105.74770 1247.75180
915.0000 -114.67992 -107.71658 6.96334 2.83272 -106.61843 1152.28884
920.0000 -114.82416 -107.42950 7.39466 2.81079 -106.91209 1112.14590
925.0000 -115.03113 -107.34371 7.68742 2.84117 -106.50528 1196.32432
930.0000 -112.91712 -107.00515 5.91197 2.85825 -106.27657 1188.84885
935.0000 -112.82647 -106.96082 5.86565 2.86364 -106.20435 1178.65970
940.0000 -113.05232 -105.68069 7.37162 2.89295 -105.81185 1153.21662
945.0000 -112.82356 -105.83700 6.98656 2.90738 -105.61868 1200.06064
950.0000 -113.09867 -105.52543 7.57323 2.89299 -105.81133 1195.67755
955.0000 -111.12545 -104.27845 6.84700 2.96155 -104.89331 1223.11472
960.0000 -113.27187 -104.27454 8.99732 2.99372 -104.46252 1245.33508
965.0000 -113.13572 -105.35657 7.77915 2.95385 -104.99645 1193.57497
970.0000 -113.65643 -106.42080 7.23563 2.92187 -105.42460 1189.34918
975.0000 -113.53783 -105.32393 8.21390 2.84883 -106.40265 1158.98095
980.0000 -112.25292 -105.72998 6.52294 2.82905 -106.66754 1153.11312
985.0000 -113.90014 -106.30560 7.59454 2.89784 -105.74642 1185.04736
990.0000 -113.34178 -106.76719 6.57459 2.90240 -105.68537 1172.09887
995.0000 -113.33758 -105.70189 7.63569 2.89853 -105.73724 1176.30774
1000.0000 -114.28334 -106.86597 7.41737 2.90179 -105.69358 1138.97438
FREEZING PROCESS: loop number 5 T-loop= 1117.0000000000000
main_MD> interactions number 5 at Temperature= 1117.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.39647 -2.51739 1.66284
force_rgl> df(natom) 3.85016 2.55058 1.04856
1005.0000 -114.44715 -107.69890 6.74825 2.78435 -107.26616 1090.89336
1010.0000 -114.07850 -107.18074 6.89776 2.76249 -107.55876 1067.04850
1015.0000 -113.90573 -107.07008 6.83565 2.75030 -107.72208 1067.74028
1020.0000 -112.60309 -105.77318 6.82990 2.84579 -106.44342 1110.70295
1025.0000 -112.38955 -105.88243 6.50712 2.82662 -106.70003 1161.10715
1030.0000 -115.35462 -108.45088 6.90374 2.76954 -107.46439 1099.12142
1035.0000 -114.23205 -106.04275 8.18931 2.76019 -107.58965 1096.51204
1040.0000 -115.17623 -108.07562 7.10061 2.84531 -106.44977 1153.99288
1045.0000 -114.80364 -107.72638 7.07726 2.71421 -108.20534 1058.59371
1050.0000 -114.02183 -106.43932 7.58252 2.84519 -106.45139 1145.97400
1055.0000 -112.85933 -103.08857 9.77076 2.94475 -105.11832 1227.88805
1060.0000 -114.64513 -108.15659 6.48854 2.87634 -106.03427 1184.18877
1065.0000 -114.33613 -108.48493 5.85120 2.72561 -108.05270 1019.19806
1070.0000 -113.47178 -106.21697 7.25480 2.77822 -107.34821 1072.36001
1075.0000 -114.41055 -104.79930 9.61125 2.88420 -105.92911 1171.41392
1080.0000 -113.97369 -105.87584 8.09785 2.90205 -105.69008 1200.10487
1085.0000 -114.69290 -107.57987 7.11303 2.88404 -105.93120 1175.35577
1090.0000 -112.92461 -106.33603 6.58858 2.83405 -106.60055 1177.52875
1095.0000 -114.91295 -107.45109 7.46185 2.82655 -106.70110 1148.03483
1100.0000 -114.28730 -108.23298 6.05432 2.75160 -107.70466 1097.78682
1105.0000 -113.83671 -107.50497 6.33174 2.81590 -106.84365 1126.62330
1110.0000 -115.22406 -108.51119 6.71287 2.72182 -108.10347 1026.19971
1115.0000 -113.37828 -108.29964 5.07865 2.72927 -108.00372 1050.55300
1120.0000 -114.68618 -107.96839 6.71780 2.75305 -107.68522 1046.58768
1125.0000 -114.75637 -107.95999 6.79638 2.72387 -108.07594 1092.18755
1130.0000 -111.82600 -105.99059 5.83541 2.85462 -106.32513 1142.37965
1135.0000 -113.40832 -107.04044 6.36789 2.80958 -106.92821 1082.59186
1140.0000 -111.88184 -104.74951 7.13233 2.85638 -106.30162 1154.36512
1145.0000 -114.48767 -106.21611 8.27156 2.89138 -105.83294 1214.88049
1150.0000 -114.78132 -109.31948 5.46185 2.66778 -108.82710 1075.34226
1155.0000 -114.05148 -106.63032 7.42116 2.72148 -108.10803 1056.61478
1160.0000 -112.39392 -104.01286 8.38107 2.92695 -105.35658 1221.17384
1165.0000 -113.84830 -106.87639 6.97190 2.90911 -105.59553 1168.81011
1170.0000 -116.05794 -109.22971 6.82823 2.75867 -107.60999 1053.01263
1175.0000 -113.92262 -106.78873 7.13388 2.73616 -107.91138 1061.92588
1180.0000 -114.13669 -107.93625 6.20044 2.76422 -107.53561 1055.20184
1185.0000 -113.60983 -105.89372 7.71612 2.82669 -106.69921 1158.10330
1190.0000 -112.42389 -105.51436 6.90952 2.83324 -106.61146 1164.35834
1195.0000 -114.77769 -106.18792 8.58977 2.87876 -106.00192 1166.18201
1200.0000 -112.55778 -105.76214 6.79563 2.89275 -105.81456 1194.51582
1205.0000 -115.18993 -108.72358 6.46635 2.76049 -107.58554 1065.91056
1210.0000 -113.36262 -105.73331 7.62931 2.81337 -106.87752 1097.21831
1215.0000 -114.17954 -105.75555 8.42400 2.83752 -106.55412 1126.28355
1220.0000 -114.96455 -108.57685 6.38770 2.80536 -106.98479 1119.12985
1225.0000 -113.58242 -105.55419 8.02823 2.80811 -106.94793 1084.86550
1230.0000 -113.59637 -106.58531 7.01106 2.86872 -106.13639 1167.91258
1235.0000 -114.56503 -106.46258 8.10244 2.85739 -106.28804 1150.15062
1240.0000 -113.40951 -107.09402 6.31549 2.84266 -106.48527 1189.12161
1245.0000 -113.22852 -104.62472 8.60380 2.90220 -105.68799 1163.92957
1250.0000 -112.90887 -106.32142 6.58745 2.92098 -105.43651 1196.21377
FREEZING PROCESS: loop number 6 T-loop= 1092.0000000000000
main_MD> interactions number 6 at Temperature= 1092.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.97978 3.68154 2.25961
force_rgl> df(natom) 0.74417 -2.41465 0.00667
1255.0000 -113.44255 -105.47006 7.97250 2.87536 -106.04743 1157.95571
1260.0000 -113.37500 -106.82244 6.55256 2.89582 -105.77341 1193.16362
1265.0000 -113.25025 -107.53703 5.71322 2.82445 -106.72920 1113.52219
1270.0000 -113.70530 -107.95851 5.74680 2.70226 -108.36528 1076.37976
1275.0000 -116.07261 -109.15933 6.91327 2.63263 -109.29778 999.26663
1280.0000 -114.26718 -107.45783 6.80935 2.68456 -108.60237 1000.13951
1285.0000 -114.50500 -106.63662 7.86838 2.86359 -106.20507 1204.10674
1290.0000 -114.90338 -106.68310 8.22028 2.77857 -107.34356 1134.11089
1295.0000 -113.85269 -105.60032 8.25237 2.89427 -105.79429 1210.74594
1300.0000 -113.27062 -105.10998 8.16064 2.88272 -105.94893 1178.46308
1305.0000 -113.46611 -105.07799 8.38812 2.97516 -104.71103 1242.43185
1310.0000 -114.79974 -107.16145 7.63829 2.86574 -106.17625 1143.30887
1315.0000 -114.28936 -108.02387 6.26548 2.80472 -106.99333 1103.86776
1320.0000 -114.28979 -107.30109 6.98869 2.74141 -107.84104 1060.13822
1325.0000 -114.50188 -108.69642 5.80546 2.77803 -107.35078 1091.14453
1330.0000 -115.46770 -108.43923 7.02847 2.71206 -108.23404 1056.04310
1335.0000 -113.94218 -109.05876 4.88341 2.65269 -109.02905 1021.58823
1340.0000 -114.11985 -107.84805 6.27180 2.69663 -108.44070 1003.45496
1345.0000 -112.93905 -105.40697 7.53208 2.84540 -106.44866 1160.23802
1350.0000 -112.78928 -105.42245 7.36683 2.93941 -105.18978 1260.03598
1355.0000 -113.40856 -106.84323 6.56533 2.85572 -106.31049 1095.27698
1360.0000 -113.50670 -106.94720 6.55950 2.80631 -106.97210 1086.65334
1365.0000 -114.46841 -104.70000 9.76841 2.86673 -106.16300 1165.38558
1370.0000 -113.32212 -106.54254 6.77958 2.88699 -105.89171 1209.92367
1375.0000 -114.96049 -108.19737 6.76312 2.78950 -107.19721 1110.49943
1380.0000 -113.33954 -106.54828 6.79126 2.76158 -107.57107 1086.40073
1385.0000 -112.91834 -104.54863 8.36971 2.87854 -106.00485 1138.61647
1390.0000 -114.61515 -106.46616 8.14898 2.92939 -105.32390 1267.20589
1395.0000 -116.64262 -109.89128 6.75135 2.72573 -108.05108 1063.13630
1400.0000 -115.35708 -110.27709 5.07999 2.60516 -109.66550 942.01710
1405.0000 -112.82513 -106.43635 6.38878 2.76135 -107.57415 1063.84573
1410.0000 -115.21728 -108.23970 6.97758 2.71640 -108.17603 1038.03473
1415.0000 -115.92084 -109.25292 6.66792 2.65500 -108.99812 1017.72356
1420.0000 -113.69410 -106.95287 6.74124 2.70016 -108.39346 1039.82772
1425.0000 -112.68419 -105.13487 7.54932 2.78860 -107.20914 1120.40906
1430.0000 -112.83986 -104.93923 7.90063 2.88739 -105.88640 1145.98969
1435.0000 -112.12657 -105.60721 6.51936 2.94695 -105.08880 1190.16482
1440.0000 -114.28767 -107.44895 6.83872 2.79960 -107.06190 1106.77214
1445.0000 -114.89952 -108.42798 6.47155 2.73120 -107.97779 1065.99194
1450.0000 -114.90790 -108.84947 6.05843 2.72920 -108.00464 1088.59578
1455.0000 -113.93541 -108.66717 5.26824 2.67495 -108.73100 1026.29815
1460.0000 -114.18158 -106.81965 7.36194 2.79149 -107.17056 1095.14832
1465.0000 -115.32343 -108.21648 7.10695 2.76245 -107.55943 1094.35570
1470.0000 -113.87152 -107.65786 6.21367 2.77464 -107.39617 1075.31370
1475.0000 -115.39650 -108.82408 6.57242 2.67793 -108.69115 1052.38877
1480.0000 -115.65051 -109.11339 6.53712 2.58380 -109.95154 983.54430
1485.0000 -115.32439 -109.17137 6.15302 2.66178 -108.90736 1030.10628
1490.0000 -114.50083 -107.11088 7.38995 2.70546 -108.32251 1065.30904
1495.0000 -114.74337 -107.60035 7.14302 2.76319 -107.54948 1062.17152
1500.0000 -115.02576 -105.56373 9.46203 2.88531 -105.91426 1178.54123
FREEZING PROCESS: loop number 7 T-loop= 1067.0000000000000
main_MD> interactions number 7 at Temperature= 1067.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.21066 2.11829 -1.12023
force_rgl> df(natom) 0.68220 -1.66442 -1.80569
1505.0000 -113.61209 -106.83465 6.77744 2.83992 -106.52195 1166.24494
1510.0000 -114.47942 -106.79607 7.68335 2.79341 -107.14475 1130.64695
1515.0000 -114.71938 -107.73695 6.98242 2.75282 -107.68827 1093.03851
1520.0000 -114.83107 -108.32836 6.50271 2.69727 -108.43217 995.97778
1525.0000 -115.94301 -108.78884 7.15417 2.63986 -109.20092 1036.74509
1530.0000 -115.65313 -108.81070 6.84243 2.70832 -108.28416 1024.11798
1535.0000 -114.55436 -107.37914 7.17522 2.76243 -107.55963 1103.26183
1540.0000 -115.14392 -109.09004 6.05388 2.69297 -108.48980 1035.08869
1545.0000 -114.01403 -106.80497 7.20906 2.69382 -108.47830 1061.03284
1550.0000 -114.66522 -106.22199 8.44323 2.83412 -106.59963 1128.68289
1555.0000 -113.58030 -105.95716 7.62314 2.87341 -106.07354 1160.16572
1560.0000 -113.73916 -107.52720 6.21196 2.79400 -107.13685 1114.44425
1565.0000 -113.07020 -105.98274 7.08746 2.77922 -107.33480 1093.11817
1570.0000 -113.63120 -107.38557 6.24562 2.87065 -106.11054 1124.77312
1575.0000 -115.58328 -109.07391 6.50937 2.71675 -108.17129 1029.58768
1580.0000 -114.88902 -109.15010 5.73892 2.65690 -108.97273 1013.04358
1585.0000 -114.68544 -107.90664 6.77880 2.74930 -107.73548 1054.89564
1590.0000 -115.78827 -108.42604 7.36223 2.72649 -108.04084 1052.07337
1595.0000 -115.07709 -109.82255 5.25453 2.61322 -109.55761 966.57048
1600.0000 -116.14239 -110.92911 5.21328 2.52685 -110.71422 930.60213
1605.0000 -115.57184 -110.18395 5.38789 2.53844 -110.55895 913.00371
1610.0000 -116.28830 -108.52951 7.75879 2.64066 -109.19025 968.53383
1615.0000 -115.58199 -108.80837 6.77362 2.65896 -108.94516 1033.01912
1620.0000 -115.20264 -107.29396 7.90868 2.71557 -108.18711 1034.44263
1625.0000 -115.84751 -109.86377 5.98374 2.70591 -108.31645 1015.04078
1630.0000 -114.84611 -108.22787 6.61824 2.67089 -108.78536 1022.62238
1635.0000 -115.58875 -108.75869 6.83006 2.69792 -108.42342 1048.27204
1640.0000 -116.14481 -108.74210 7.40272 2.70070 -108.38629 1030.18600
1645.0000 -115.22319 -108.82703 6.39616 2.66892 -108.81184 1036.63999
1650.0000 -115.19280 -109.04546 6.14733 2.67131 -108.77974 1021.46096
1655.0000 -115.39152 -107.24960 8.14192 2.65828 -108.95425 1005.55558
1660.0000 -114.26810 -105.92903 8.33907 2.82132 -106.77101 1151.42555
1665.0000 -114.51149 -106.90408 7.60741 2.91347 -105.53716 1213.39303
1670.0000 -113.20927 -106.93841 6.27086 2.75047 -107.71981 1070.95314
1675.0000 -114.79859 -109.01635 5.78224 2.72837 -108.01567 1069.90625
1680.0000 -115.44923 -108.20801 7.24122 2.67355 -108.74983 1049.50099
1685.0000 -114.46272 -107.82968 6.63305 2.71233 -108.23053 1045.08214
1690.0000 -117.06186 -108.89130 8.17056 2.68719 -108.56717 1061.67525
1695.0000 -115.62767 -107.57536 8.05231 2.77932 -107.33350 1091.40127
1700.0000 -114.36812 -106.80427 7.56386 2.84206 -106.49333 1138.32701
1705.0000 -115.10269 -109.26849 5.83420 2.75888 -107.60723 1075.87364
1710.0000 -115.26760 -108.55344 6.71417 2.66256 -108.89693 1000.70107
1715.0000 -113.90892 -106.23619 7.67273 2.74992 -107.72721 1083.22789
1720.0000 -113.88724 -106.56987 7.31737 2.78896 -107.20439 1113.57001
1725.0000 -114.01040 -108.40247 5.60793 2.78608 -107.24299 1070.66120
1730.0000 -113.22778 -107.69616 5.53162 2.73014 -107.99203 1058.27408
1735.0000 -114.46139 -107.32291 7.13847 2.81504 -106.85515 1145.56090
1740.0000 -113.79269 -107.66539 6.12730 2.79419 -107.13434 1101.28904
1745.0000 -113.38654 -107.98996 5.39658 2.68409 -108.60863 1042.19780
1750.0000 -115.35896 -107.95270 7.40625 2.74140 -107.84122 1003.60893
FREEZING PROCESS: loop number 8 T-loop= 1042.0000000000000
main_MD> interactions number 8 at Temperature= 1042.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.03196 -0.20310 -2.11502
force_rgl> df(natom) 1.90682 0.01365 -1.57167
1755.0000 -114.14456 -106.98072 7.16384 2.76176 -107.56867 1065.45443
1760.0000 -115.42149 -108.61010 6.81139 2.78514 -107.25552 1041.89689
1765.0000 -115.87305 -109.83592 6.03713 2.59363 -109.82001 954.60072
1770.0000 -115.56524 -109.65486 5.91038 2.56054 -110.26302 932.50946
1775.0000 -116.83333 -110.29806 6.53527 2.62538 -109.39485 963.61216
1780.0000 -116.23039 -110.27416 5.95624 2.61148 -109.58087 962.55270
1785.0000 -116.76659 -109.62700 7.13959 2.55363 -110.35561 953.09338
1790.0000 -115.22919 -108.72943 6.49976 2.63084 -109.32162 992.21081
1795.0000 -115.45434 -106.78309 8.67125 2.67268 -108.76148 1049.07550
1800.0000 -113.90873 -109.00041 4.90832 2.71465 -108.19947 1073.54371
1805.0000 -114.75616 -108.80333 5.95282 2.68930 -108.53883 1043.72145
1810.0000 -116.75566 -111.26711 5.48854 2.66207 -108.90344 1032.67061
1815.0000 -116.00709 -111.02001 4.98708 2.48781 -111.23694 872.79931
1820.0000 -115.74318 -109.66512 6.07806 2.59606 -109.78743 967.50075
1825.0000 -115.28084 -107.93767 7.34317 2.64599 -109.11884 1005.33210
1830.0000 -115.05067 -108.78688 6.26379 2.74792 -107.75396 1103.38530
1835.0000 -115.20512 -108.54171 6.66341 2.66899 -108.81083 1022.83855
1840.0000 -114.40736 -106.18246 8.22490 2.77787 -107.35282 1109.89553
1845.0000 -113.94619 -108.63292 5.31327 2.73050 -107.98714 1057.54695
1850.0000 -115.14158 -108.14774 6.99384 2.73412 -107.93867 1057.06647
1855.0000 -114.22745 -107.88378 6.34368 2.70316 -108.35331 1058.04245
1860.0000 -114.69272 -108.74097 5.95175 2.76303 -107.55163 1132.78690
1865.0000 -116.68155 -109.54056 7.14099 2.68286 -108.62507 1034.51169
1870.0000 -114.39587 -108.71702 5.67885 2.64520 -109.12945 980.08531
1875.0000 -114.58047 -107.29404 7.28643 2.72095 -108.11507 1080.35942
1880.0000 -115.07999 -108.14494 6.93506 2.72547 -108.05451 1077.57948
1885.0000 -115.23108 -108.86322 6.36786 2.64010 -109.19770 998.19337
1890.0000 -115.77431 -108.14864 7.62568 2.67592 -108.71804 1015.42511
1895.0000 -113.81717 -106.66253 7.15465 2.76536 -107.52046 1103.46775
1900.0000 -114.50509 -108.81329 5.69180 2.72055 -108.12048 1071.79102
1905.0000 -116.47797 -110.79075 5.68722 2.63452 -109.27248 992.67150
1910.0000 -116.89836 -110.15002 6.74834 2.54294 -110.49871 893.57202
1915.0000 -114.80550 -107.92536 6.88014 2.61276 -109.56380 985.04847
1920.0000 -116.19384 -109.45465 6.73919 2.69006 -108.52866 1020.08059
1925.0000 -117.26875 -109.86926 7.39948 2.61366 -109.55168 938.63114
1930.0000 -116.05081 -109.55333 6.49748 2.62852 -109.35277 996.79520
1935.0000 -115.22738 -108.51758 6.70981 2.67506 -108.72951 1032.25661
1940.0000 -114.80371 -109.19651 5.60721 2.68474 -108.59989 1018.54825
1945.0000 -114.15410 -106.55466 7.59944 2.74988 -107.72775 1078.99341
1950.0000 -113.09229 -105.92624 7.16605 2.83614 -106.57256 1104.59574
1955.0000 -115.01350 -108.94794 6.06557 2.73922 -107.87049 1058.78275
1960.0000 -115.06055 -107.11765 7.94290 2.71262 -108.22660 1026.08184
1965.0000 -116.90237 -108.84416 8.05821 2.73798 -107.88707 1059.22327
1970.0000 -117.45885 -109.25210 8.20676 2.64233 -109.16777 1028.83095
1975.0000 -115.95503 -108.88210 7.07293 2.69682 -108.43821 1014.53100
1980.0000 -115.51990 -110.55740 4.96250 2.55670 -110.31443 870.08039
1985.0000 -115.79414 -108.59120 7.20295 2.59553 -109.79455 950.80446
1990.0000 -114.83146 -108.76684 6.06462 2.59818 -109.75899 966.01353
1995.0000 -115.10436 -107.60292 7.50144 2.71678 -108.17087 1093.66628
2000.0000 -113.59624 -106.68536 6.91088 2.76282 -107.55438 1090.37736
FREEZING PROCESS: loop number 9 T-loop= 1017.0000000000000
main_MD> interactions number 9 at Temperature= 1017.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.14417 -6.94182 10.23422
force_rgl> df(natom) 0.32547 -0.30974 1.60579
2005.0000 -115.96123 -109.07669 6.88454 2.76487 -107.52690 1084.40742
2010.0000 -114.71058 -109.06359 5.64699 2.73343 -107.94792 1031.22966
2015.0000 -114.66647 -108.67994 5.98653 2.64248 -109.16579 980.82299
2020.0000 -113.75445 -106.76729 6.98716 2.73873 -107.87704 1082.47405
2025.0000 -115.84514 -109.63685 6.20829 2.71544 -108.18890 1067.06773
2030.0000 -114.35993 -108.46274 5.89720 2.65741 -108.96586 1038.73340
2035.0000 -114.49917 -108.08187 6.41730 2.68982 -108.53196 1012.46707
2040.0000 -113.85048 -107.60026 6.25022 2.71713 -108.16625 1053.25190
2045.0000 -116.36090 -109.45370 6.90720 2.72790 -108.02195 1072.51544
2050.0000 -115.56290 -109.27165 6.29124 2.65037 -109.06014 1039.86167
2055.0000 -115.41231 -108.21868 7.19363 2.71407 -108.20715 1078.01814
2060.0000 -113.94007 -105.97667 7.96340 2.78660 -107.23598 1111.86072
2065.0000 -113.70799 -106.22317 7.48482 2.85320 -106.34416 1186.89387
2070.0000 -116.42603 -109.79202 6.63401 2.68859 -108.54839 1030.45402
2075.0000 -116.11301 -110.23515 5.87786 2.57740 -110.03724 937.81937
2080.0000 -115.58507 -108.89637 6.68871 2.59308 -109.82737 923.87017
2085.0000 -114.25043 -107.49780 6.75263 2.69527 -108.45900 1021.57807
2090.0000 -116.34818 -109.94075 6.40743 2.70480 -108.33130 1031.30410
2095.0000 -116.42121 -109.96052 6.46068 2.59309 -109.82713 929.63964
2100.0000 -115.90957 -108.65914 7.25043 2.62052 -109.45982 968.19618
2105.0000 -114.52359 -107.49647 7.02712 2.74919 -107.73697 1084.25295
2110.0000 -114.76539 -106.20398 8.56140 2.75573 -107.64929 1082.16527
2115.0000 -113.85858 -107.29187 6.56672 2.82445 -106.72918 1156.02052
2120.0000 -113.89511 -106.82021 7.07490 2.75416 -107.67040 1065.22168
2125.0000 -114.37126 -106.53456 7.83670 2.83324 -106.61149 1143.26828
2130.0000 -113.72191 -107.96646 5.75544 2.77765 -107.35576 1094.37046
2135.0000 -113.15455 -108.12740 5.02715 2.76072 -107.58254 1075.82597
2140.0000 -113.95664 -107.52637 6.43028 2.72303 -108.08725 1087.46635
2145.0000 -114.17369 -107.49026 6.68343 2.81311 -106.88098 1109.46593
2150.0000 -115.15357 -109.12223 6.03133 2.71059 -108.25383 1045.50526
2155.0000 -116.28659 -109.91419 6.37240 2.63036 -109.32809 980.71830
2160.0000 -115.21634 -109.64561 5.57073 2.63417 -109.27713 1004.56900
2165.0000 -115.16098 -110.09734 5.06364 2.62773 -109.36335 983.91348
2170.0000 -115.26697 -108.15270 7.11427 2.54849 -110.42437 915.67863
2175.0000 -116.33099 -110.52233 5.80866 2.66137 -108.91284 1008.24575
2180.0000 -116.77340 -110.35772 6.41568 2.52566 -110.73016 903.94937
2185.0000 -114.37027 -108.29686 6.07341 2.61782 -109.49600 997.34618
2190.0000 -116.07739 -109.41357 6.66382 2.65209 -109.03715 1009.74230
2195.0000 -116.63158 -109.66730 6.96428 2.58588 -109.92378 946.71493
2200.0000 -114.25902 -108.47655 5.78247 2.66124 -108.91466 997.41154
2205.0000 -116.94619 -109.75693 7.18926 2.63041 -109.32750 982.88527
2210.0000 -114.84981 -109.71638 5.13343 2.62637 -109.38160 1000.72496
2215.0000 -115.83741 -109.96283 5.87458 2.61136 -109.58252 937.09426
2220.0000 -116.17658 -110.01778 6.15880 2.58917 -109.87961 924.43401
2225.0000 -115.81822 -109.07672 6.74150 2.64308 -109.15774 1017.50510
2230.0000 -114.10623 -108.20432 5.90191 2.70447 -108.33580 1057.86544
2235.0000 -115.92865 -109.30039 6.62826 2.68673 -108.57329 1030.30776
2240.0000 -115.75091 -109.48898 6.26193 2.58069 -109.99318 941.00962
2245.0000 -114.94243 -109.70517 5.23726 2.62126 -109.45003 968.88687
2250.0000 -114.93863 -108.42146 6.51717 2.63240 -109.30086 991.78730
FREEZING PROCESS: loop number 10 T-loop= 992.00000000000000
main_MD> interactions number 10 at Temperature= 992.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.49651 0.66276 -1.93507
force_rgl> df(natom) 1.35588 0.93519 -1.42680
2255.0000 -116.71037 -110.08296 6.62741 2.65310 -109.02368 1019.53514
2260.0000 -114.09049 -108.37729 5.71319 2.63655 -109.24528 1012.34091
2265.0000 -114.05690 -106.95699 7.09991 2.76983 -107.46060 1094.02375
2270.0000 -113.27744 -107.13435 6.14309 2.81034 -106.91809 1127.28529
2275.0000 -114.56293 -108.17535 6.38758 2.76612 -107.51023 1089.57964
2280.0000 -116.32914 -109.53791 6.79123 2.66058 -108.92343 1014.70976
2285.0000 -115.76383 -110.51774 5.24609 2.62284 -109.42878 984.82706
2290.0000 -114.32755 -107.28173 7.04582 2.67247 -108.76418 1036.99169
2295.0000 -116.14871 -111.13515 5.01356 2.63431 -109.27516 993.58411
2300.0000 -115.22180 -108.37506 6.84674 2.54698 -110.44464 927.94818
2305.0000 -114.98684 -108.60781 6.37903 2.68554 -108.58926 1058.71804
2310.0000 -114.57285 -108.38707 6.18577 2.63326 -109.28922 1007.53589
2315.0000 -115.85259 -108.98569 6.86690 2.70317 -108.35319 1092.86839
2320.0000 -116.63248 -109.44200 7.19047 2.56182 -110.24594 947.70440
2325.0000 -115.54220 -109.77696 5.76524 2.57115 -110.12098 954.70636
2330.0000 -115.92592 -109.69873 6.22720 2.57441 -110.07725 924.27494
2335.0000 -117.14290 -111.06056 6.08234 2.57074 -110.12651 949.66599
2340.0000 -117.12233 -111.13964 5.98268 2.47205 -111.44795 856.16448
2345.0000 -116.22807 -111.07218 5.15588 2.44140 -111.85844 855.46878
2350.0000 -116.51116 -110.20494 6.30622 2.53509 -110.60385 922.50265
2355.0000 -116.51826 -109.96545 6.55281 2.57225 -110.10629 966.79087
2360.0000 -115.82271 -109.11623 6.70648 2.59997 -109.73511 964.47970
2365.0000 -116.24513 -109.88254 6.36259 2.61952 -109.47328 968.01545
2370.0000 -116.76717 -110.62222 6.14495 2.55457 -110.34300 949.65743
2375.0000 -117.62722 -112.40779 5.21943 2.46866 -111.49334 914.69221
2380.0000 -117.01287 -111.51513 5.49775 2.41850 -112.16497 839.64682
2385.0000 -114.99790 -109.06460 5.93329 2.56819 -110.16061 930.70827
2390.0000 -116.67947 -110.03716 6.64231 2.61142 -109.58172 980.00316
2395.0000 -115.79323 -110.59466 5.19857 2.62313 -109.42498 994.89122
2400.0000 -117.60759 -109.99045 7.61714 2.60149 -109.71477 983.76943
2405.0000 -115.92203 -108.54554 7.37650 2.68221 -108.63382 1007.59798
2410.0000 -114.81935 -107.68833 7.13102 2.73210 -107.96573 1061.18553
2415.0000 -115.75747 -108.71463 7.04284 2.73549 -107.92041 1079.69579
2420.0000 -115.67790 -109.59307 6.08483 2.63162 -109.31122 990.21345
2425.0000 -116.46955 -110.43789 6.03166 2.60266 -109.69906 976.77519
2430.0000 -115.06329 -110.28184 4.78145 2.54846 -110.42483 932.75553
2435.0000 -115.83267 -109.79665 6.03601 2.57801 -110.02908 944.62835
2440.0000 -116.54404 -109.21002 7.33401 2.61215 -109.57197 1005.20961
2445.0000 -116.52596 -110.32654 6.19942 2.59234 -109.83716 943.63737
2450.0000 -115.76208 -110.06663 5.69545 2.54920 -110.41495 924.39256
2455.0000 -116.84845 -111.22959 5.61886 2.60412 -109.67949 982.53945
2460.0000 -115.64869 -110.11396 5.53473 2.55355 -110.35667 950.39363
2465.0000 -116.09484 -110.27161 5.82323 2.58212 -109.97414 932.99150
2470.0000 -117.39329 -110.73567 6.65762 2.56597 -110.19040 951.29421
2475.0000 -115.41317 -109.07159 6.34157 2.58880 -109.88459 938.86264
2480.0000 -115.94619 -108.83772 7.10847 2.66395 -108.87828 1019.25717
2485.0000 -114.44391 -109.10889 5.33502 2.65169 -109.04244 982.53875
2490.0000 -114.06914 -106.61119 7.45795 2.72346 -108.08151 1045.24745
2495.0000 -115.37585 -108.63406 6.74179 2.78336 -107.27933 1099.53563
2500.0000 -114.57938 -107.65543 6.92395 2.64896 -109.07904 1049.66067
FREEZING PROCESS: loop number 11 T-loop= 967.00000000000000
main_MD> interactions number 11 at Temperature= 967.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 11.24697 0.69490 -7.61836
force_rgl> df(natom) -1.02852 0.95158 1.03072
2505.0000 -115.95032 -108.61467 7.33565 2.75172 -107.70307 1088.10465
2510.0000 -115.05076 -109.23669 5.81406 2.58564 -109.92691 976.88651
2515.0000 -115.18516 -109.15868 6.02648 2.63931 -109.20825 986.13049
2520.0000 -117.27689 -111.99664 5.28025 2.58315 -109.96030 954.00278
2525.0000 -115.77914 -109.75592 6.02322 2.54803 -110.43052 899.83439
2530.0000 -115.51722 -108.74084 6.77638 2.73054 -107.98670 1063.44746
2535.0000 -115.08213 -108.53386 6.54827 2.73325 -107.95033 1052.55916
2540.0000 -114.74305 -109.02413 5.71892 2.68311 -108.62181 1022.68216
2545.0000 -115.80333 -108.91385 6.88948 2.68168 -108.64096 999.62660
2550.0000 -115.63294 -108.26721 7.36573 2.65595 -108.98540 991.87573
2555.0000 -115.96070 -110.05912 5.90158 2.54519 -110.46855 930.17134
2560.0000 -114.42310 -108.38646 6.03663 2.63814 -109.22390 955.02087
2565.0000 -115.39438 -109.24789 6.14649 2.61698 -109.50723 945.34969
2570.0000 -114.50685 -108.82826 5.67859 2.61761 -109.49889 957.58107
2575.0000 -116.69519 -110.92528 5.76991 2.59631 -109.78409 943.53481
2580.0000 -115.83648 -110.60464 5.23183 2.56755 -110.16911 942.98440
2585.0000 -114.74498 -109.69105 5.05393 2.55379 -110.35346 933.21045
2590.0000 -116.13545 -110.10289 6.03256 2.63473 -109.26965 989.13971
2595.0000 -115.48118 -109.93512 5.54606 2.56126 -110.25347 930.46685
2600.0000 -115.50310 -111.00694 4.49617 2.52505 -110.73827 922.27513
2605.0000 -115.82447 -108.42779 7.39668 2.61424 -109.54401 986.34244
2610.0000 -116.03504 -109.49402 6.54102 2.64303 -109.15846 998.69723
2615.0000 -116.20127 -110.18655 6.01473 2.53483 -110.60726 907.69529
2620.0000 -114.88596 -109.56994 5.31603 2.59789 -109.76297 978.93590
2625.0000 -115.54234 -109.56572 5.97662 2.65122 -109.04874 987.04605
2630.0000 -115.89833 -109.98153 5.91680 2.59441 -109.80949 943.30507
2635.0000 -116.33763 -109.81502 6.52261 2.58773 -109.89895 944.82844
2640.0000 -115.26485 -109.45199 5.81287 2.59657 -109.78059 935.00151
2645.0000 -115.93668 -110.64560 5.29108 2.62333 -109.42230 984.52559
2650.0000 -115.50359 -110.59530 4.90830 2.52299 -110.76584 888.15944
2655.0000 -115.20996 -109.94979 5.26017 2.55322 -110.36108 931.60922
2660.0000 -116.21700 -110.18598 6.03102 2.57087 -110.12471 918.71476
2665.0000 -115.82788 -111.25648 4.57140 2.52129 -110.78860 933.83797
2670.0000 -117.04682 -110.78693 6.25989 2.52822 -110.69576 914.86011
2675.0000 -115.56237 -109.15346 6.40891 2.59590 -109.78954 977.10293
2680.0000 -114.44057 -108.22899 6.21158 2.65623 -108.98166 1013.52221
2685.0000 -114.19583 -108.04499 6.15084 2.74236 -107.82840 1072.38388
2690.0000 -114.99514 -108.42013 6.57501 2.68135 -108.64529 1029.30353
2695.0000 -114.75640 -109.39452 5.36188 2.65956 -108.93710 992.33435
2700.0000 -115.93944 -109.05919 6.88025 2.59200 -109.84180 937.19962
2705.0000 -115.54199 -109.14735 6.39464 2.66299 -108.89114 982.14473
2710.0000 -115.12675 -108.06236 7.06439 2.66574 -108.85441 1027.80336
2715.0000 -116.54105 -111.04700 5.49406 2.55252 -110.37045 930.09702
2720.0000 -116.81806 -109.20004 7.61802 2.60737 -109.63594 983.58118
2725.0000 -115.53851 -110.19719 5.34132 2.61909 -109.47900 989.24678
2730.0000 -115.21973 -109.48629 5.73344 2.64207 -109.17138 962.63912
2735.0000 -116.57277 -110.67025 5.90252 2.55032 -110.39984 942.51104
2740.0000 -114.91799 -108.69431 6.22369 2.62438 -109.40823 998.70560
2745.0000 -114.35096 -107.91459 6.43637 2.65349 -109.01836 1009.26081
2750.0000 -115.08381 -109.33279 5.75102 2.67546 -108.72423 1043.92544
FREEZING PROCESS: loop number 12 T-loop= 942.00000000000000
main_MD> interactions number 12 at Temperature= 942.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.07486 -0.17842 0.41243
force_rgl> df(natom) 1.07964 0.88460 2.26584
2755.0000 -116.67938 -110.63430 6.04508 2.57422 -110.07988 962.27987
2760.0000 -116.88579 -109.67571 7.21008 2.58808 -109.89431 996.47233
2765.0000 -116.62665 -109.06524 7.56142 2.58609 -109.92087 945.28170
2770.0000 -116.70815 -110.46353 6.24462 2.56811 -110.16166 924.29738
2775.0000 -115.89596 -108.47505 7.42091 2.66749 -108.83086 1037.05924
2780.0000 -115.91134 -109.00650 6.90485 2.65279 -109.02776 1026.34324
2785.0000 -116.36075 -109.49747 6.86329 2.59920 -109.74538 971.54901
2790.0000 -115.26637 -108.85718 6.40919 2.64614 -109.11686 962.65629
2795.0000 -116.04579 -109.67762 6.36816 2.67805 -108.68951 934.25292
2800.0000 -116.86043 -110.93965 5.92079 2.58539 -109.93024 933.51967
2805.0000 -116.65883 -110.27923 6.37960 2.57184 -110.11173 953.73498
2810.0000 -115.27525 -109.95050 5.32475 2.52943 -110.67963 910.28575
2815.0000 -115.25162 -109.52454 5.72709 2.62073 -109.45709 987.89019
2820.0000 -114.36050 -108.17714 6.18336 2.67407 -108.74277 1026.85097
2825.0000 -115.66361 -109.05247 6.61114 2.68066 -108.65459 1018.15022
2830.0000 -113.65435 -108.48731 5.16704 2.71970 -108.13177 1018.60139
2835.0000 -113.48616 -108.11633 5.36983 2.70322 -108.35250 1047.73693
2840.0000 -115.77583 -110.13024 5.64559 2.60604 -109.65371 956.24943
2845.0000 -114.71050 -109.40422 5.30628 2.56406 -110.21592 908.16695
2850.0000 -115.16284 -109.30574 5.85710 2.63713 -109.23745 996.67407
2855.0000 -116.31254 -109.07530 7.23723 2.65815 -108.95595 1044.78019
2860.0000 -114.60040 -109.42809 5.17232 2.61500 -109.53376 978.84029
2865.0000 -114.73342 -108.01077 6.72265 2.70927 -108.27143 1079.74913
2870.0000 -115.53279 -109.36520 6.16759 2.63021 -109.33012 980.87301
2875.0000 -116.37873 -110.34717 6.03155 2.58743 -109.90294 916.49945
2880.0000 -117.01493 -110.80500 6.20993 2.51452 -110.87928 896.95682
2885.0000 -115.70435 -110.91170 4.79265 2.52741 -110.70668 858.34163
2890.0000 -115.34654 -109.58573 5.76082 2.59747 -109.76850 953.82377
2895.0000 -115.31482 -109.62335 5.69148 2.64946 -109.07235 1007.63560
2900.0000 -116.34403 -112.06634 4.27769 2.47739 -111.37643 866.84724
2905.0000 -117.09324 -110.72585 6.36738 2.50683 -110.98228 871.04698
2910.0000 -116.48211 -110.04644 6.43567 2.56732 -110.17223 958.64999
2915.0000 -116.92179 -109.88150 7.04028 2.56032 -110.26602 944.09558
2920.0000 -116.62690 -110.07519 6.55171 2.54638 -110.45262 941.53274
2925.0000 -116.20305 -110.44839 5.75466 2.52333 -110.76128 922.80332
2930.0000 -116.75682 -110.10277 6.65405 2.52479 -110.74173 884.51694
2935.0000 -116.24412 -110.61933 5.62479 2.59620 -109.78555 989.71852
2940.0000 -115.25609 -109.85791 5.39818 2.54831 -110.42686 891.47835
2945.0000 -115.76174 -109.51974 6.24200 2.59538 -109.79650 914.02317
2950.0000 -116.20243 -110.52949 5.67294 2.56278 -110.23308 924.19601
2955.0000 -116.69976 -112.07784 4.62192 2.45752 -111.64251 867.66989
2960.0000 -116.61956 -112.39837 4.22119 2.41557 -112.20423 804.33681
2965.0000 -115.62784 -110.20750 5.42034 2.44947 -111.75032 833.30666
2970.0000 -115.91896 -110.11302 5.80593 2.62455 -109.40587 946.45355
2975.0000 -115.13332 -109.46369 5.66963 2.60006 -109.73379 941.74904
2980.0000 -117.47494 -111.18785 6.28709 2.53859 -110.55700 946.26624
2985.0000 -115.73321 -109.80901 5.92420 2.49161 -111.18607 897.89987
2990.0000 -116.56953 -110.51743 6.05210 2.55360 -110.35596 931.22556
2995.0000 -115.57179 -110.61415 4.95764 2.53242 -110.63955 933.14214
3000.0000 -115.54676 -110.12433 5.42244 2.53822 -110.56194 959.60334
FREEZING PROCESS: loop number 13 T-loop= 917.00000000000000
main_MD> interactions number 13 at Temperature= 917.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.39228 7.39987 4.11724
force_rgl> df(natom) 7.01314 -2.33019 -1.79692
3005.0000 -116.47074 -111.03192 5.43881 2.50331 -111.02937 889.93672
3010.0000 -115.55464 -108.70583 6.84881 2.57392 -110.08385 959.23068
3015.0000 -114.55529 -108.44895 6.10634 2.69953 -108.40195 1051.10635
3020.0000 -115.57069 -109.03055 6.54014 2.74449 -107.79985 995.00748
3025.0000 -116.43815 -110.26716 6.17099 2.60701 -109.64082 949.72021
3030.0000 -115.21000 -109.59877 5.61122 2.55843 -110.29134 921.82412
3035.0000 -116.76355 -110.10975 6.65380 2.58329 -109.95835 947.60140
3040.0000 -118.23206 -113.23639 4.99567 2.44150 -111.85702 854.36739
3045.0000 -118.47087 -113.27018 5.20069 2.31586 -113.53943 743.90532
3050.0000 -118.17346 -113.31375 4.85971 2.34557 -113.14162 790.75803
3055.0000 -117.22001 -110.96244 6.25757 2.46816 -111.50007 902.34602
3060.0000 -117.17124 -111.30595 5.86530 2.55237 -110.37240 925.78468
3065.0000 -115.83032 -109.81824 6.01208 2.59377 -109.81804 972.46037
3070.0000 -115.56995 -107.81406 7.75588 2.65831 -108.95388 987.75951
3075.0000 -115.16046 -107.63240 7.52805 2.67848 -108.68370 1000.87162
3080.0000 -116.39014 -109.87556 6.51458 2.65217 -109.03603 1015.30280
3085.0000 -114.80700 -108.19804 6.60896 2.63165 -109.31080 976.08462
3090.0000 -115.26337 -109.05102 6.21235 2.67300 -108.75717 985.44064
3095.0000 -116.47190 -109.67868 6.79322 2.62877 -109.34939 981.94990
3100.0000 -117.18633 -110.76740 6.41893 2.51840 -110.82731 905.75510
3105.0000 -117.65008 -112.33581 5.31426 2.43664 -111.92208 846.45530
3110.0000 -117.52420 -111.68076 5.84344 2.45645 -111.65688 826.26502
3115.0000 -117.59166 -111.28702 6.30465 2.46744 -111.50976 900.01298
3120.0000 -116.57185 -110.71470 5.85715 2.53166 -110.64975 895.89286
3125.0000 -115.07832 -109.45887 5.61945 2.56065 -110.26161 927.77027
3130.0000 -115.85325 -110.46877 5.38448 2.55205 -110.37672 931.56054
3135.0000 -116.98918 -111.93201 5.05717 2.48027 -111.33795 861.94650
3140.0000 -118.09551 -111.92241 6.17310 2.36898 -112.82818 779.02308
3145.0000 -116.93879 -110.65014 6.28866 2.49636 -111.12246 894.06128
3150.0000 -116.11362 -110.13067 5.98295 2.53203 -110.64478 935.69049
3155.0000 -116.47292 -111.46248 5.01044 2.58522 -109.93259 939.29445
3160.0000 -117.33249 -111.14884 6.18364 2.45603 -111.66250 867.73327
3165.0000 -115.80978 -110.06609 5.74369 2.49760 -111.10584 886.42581
3170.0000 -116.42072 -110.30958 6.11114 2.53093 -110.65955 914.67891
3175.0000 -115.31694 -109.80233 5.51461 2.50478 -111.00965 879.62224
3180.0000 -114.96876 -108.82167 6.14708 2.65968 -108.93554 1034.29520
3185.0000 -115.91267 -109.88951 6.02316 2.57496 -110.06992 965.90352
3190.0000 -114.76014 -109.04297 5.71717 2.63482 -109.26842 1012.14958
3195.0000 -116.73800 -111.12297 5.61503 2.59083 -109.85744 946.54027
3200.0000 -116.45140 -111.72552 4.72587 2.45802 -111.63583 871.26463
3205.0000 -117.11708 -112.14386 4.97321 2.50711 -110.97856 908.72008
3210.0000 -117.06354 -111.99049 5.07306 2.44827 -111.76644 852.72140
3215.0000 -117.58171 -112.00345 5.57825 2.47486 -111.41040 876.10406
3220.0000 -117.39717 -112.43924 4.95793 2.44112 -111.86216 854.05558
3225.0000 -116.99259 -110.59418 6.39841 2.48240 -111.30941 858.35503
3230.0000 -115.82273 -109.99825 5.82448 2.54240 -110.50598 934.33764
3235.0000 -116.92675 -111.09645 5.83030 2.52501 -110.73887 905.12587
3240.0000 -116.60980 -111.24954 5.36026 2.48711 -111.24631 862.07176
3245.0000 -116.71838 -111.51385 5.20453 2.48387 -111.28968 866.80999
3250.0000 -117.29182 -111.47059 5.82123 2.50984 -110.94196 897.07140
FREEZING PROCESS: loop number 14 T-loop= 892.00000000000000
main_MD> interactions number 14 at Temperature= 892.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.71854 -0.47543 3.54849
force_rgl> df(natom) -0.11559 -2.02489 0.75351
3255.0000 -116.87551 -111.30513 5.57038 2.44724 -111.78018 818.45399
3260.0000 -116.18227 -110.65340 5.52887 2.53669 -110.58234 929.33121
3265.0000 -116.06416 -110.22895 5.83521 2.48965 -111.21228 871.68466
3270.0000 -115.91420 -110.69141 5.22279 2.51705 -110.84537 898.50484
3275.0000 -116.93105 -110.89354 6.03751 2.48531 -111.27036 906.37325
3280.0000 -115.61419 -110.45902 5.15517 2.55553 -110.33015 971.20961
3285.0000 -116.36436 -112.48578 3.87857 2.44147 -111.85745 822.30693
3290.0000 -117.12809 -111.16077 5.96732 2.43402 -111.95721 833.74979
3295.0000 -115.31771 -110.26686 5.05085 2.54341 -110.49244 937.99804
3300.0000 -116.09560 -110.64165 5.45396 2.55418 -110.34822 932.31832
3305.0000 -116.37676 -109.30191 7.07485 2.57190 -110.11087 947.07905
3310.0000 -115.76474 -109.95582 5.80891 2.59887 -109.74976 959.71691
3315.0000 -115.96425 -110.39288 5.57137 2.56079 -110.25965 945.28045
3320.0000 -114.52453 -108.79699 5.72754 2.59729 -109.77100 941.93624
3325.0000 -114.56158 -109.39740 5.16418 2.62892 -109.34746 996.61859
3330.0000 -117.13591 -110.87767 6.25824 2.53846 -110.55872 885.83641
3335.0000 -116.96375 -111.32961 5.63414 2.43888 -111.89207 860.55063
3340.0000 -116.75050 -109.95723 6.79326 2.52782 -110.70123 932.87678
3345.0000 -116.46748 -111.26385 5.20363 2.52165 -110.78374 915.65563
3350.0000 -116.69268 -111.60942 5.08326 2.50412 -111.01856 899.24892
3355.0000 -116.16055 -111.09676 5.06379 2.52610 -110.72421 889.94315
3360.0000 -117.76627 -113.03023 4.73604 2.43498 -111.94429 874.95481
3365.0000 -115.74005 -110.67651 5.06354 2.41011 -112.27734 827.22089
3370.0000 -117.92426 -112.14263 5.78162 2.48052 -111.33454 853.10162
3375.0000 -116.15903 -111.67796 4.48107 2.45519 -111.67371 851.37319
3380.0000 -116.34580 -110.14917 6.19663 2.49056 -111.20016 851.30817
3385.0000 -115.61730 -109.27819 6.33911 2.61234 -109.56938 979.64582
3390.0000 -114.96956 -109.15480 5.81476 2.69429 -108.47212 986.34634
3395.0000 -114.93072 -109.33605 5.59467 2.63353 -109.28563 1004.08451
3400.0000 -116.75951 -111.84076 4.91875 2.61386 -109.54900 969.53765
3405.0000 -117.05350 -111.79738 5.25612 2.51567 -110.86381 882.04429
3410.0000 -117.58406 -112.50920 5.07486 2.43056 -112.00350 828.47640
3415.0000 -117.81253 -112.05002 5.76252 2.39583 -112.46861 839.73270
3420.0000 -117.37555 -112.06961 5.30594 2.45482 -111.67865 830.29406
3425.0000 -116.42717 -110.93842 5.48875 2.48262 -111.30641 889.24292
3430.0000 -116.08704 -110.45246 5.63458 2.55704 -110.30991 924.78451
3435.0000 -116.37548 -110.38567 5.98980 2.56037 -110.26527 942.11935
3440.0000 -115.97115 -110.64835 5.32280 2.56517 -110.20101 907.87788
3445.0000 -118.50027 -112.43241 6.06786 2.46216 -111.58042 853.79487
3450.0000 -116.59819 -111.15295 5.44524 2.44067 -111.86810 851.66328
3455.0000 -116.79671 -111.13154 5.66517 2.47733 -111.37728 891.69004
3460.0000 -116.79043 -111.40001 5.39042 2.49017 -111.20531 878.24479
3465.0000 -117.35080 -111.74316 5.60764 2.41421 -112.22243 808.44809
3470.0000 -117.88017 -111.66246 6.21770 2.48225 -111.31133 894.60821
3475.0000 -114.78850 -110.29098 4.49752 2.47342 -111.42968 869.20391
3480.0000 -114.96010 -109.24233 5.71776 2.58579 -109.92495 926.08411
3485.0000 -118.31962 -111.47614 6.84348 2.60139 -109.71600 931.39436
3490.0000 -116.85437 -110.31405 6.54033 2.50695 -110.98065 925.95286
3495.0000 -116.22462 -109.05030 7.17432 2.59729 -109.77096 961.73620
3500.0000 -115.54431 -109.49548 6.04883 2.62327 -109.42303 966.70902
FREEZING PROCESS: loop number 15 T-loop= 867.00000000000000
main_MD> interactions number 15 at Temperature= 867.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.71987 0.92301 -3.14780
force_rgl> df(natom) 0.27083 -3.07388 -1.59993
3505.0000 -116.59437 -111.88022 4.71414 2.56635 -110.18519 898.22405
3510.0000 -116.15723 -110.54283 5.61440 2.49919 -111.08461 851.02271
3515.0000 -116.19106 -109.81982 6.37124 2.54109 -110.52352 888.89509
3520.0000 -115.91940 -109.27932 6.64008 2.63902 -109.21222 1035.50180
3525.0000 -116.26612 -111.07103 5.19509 2.53228 -110.64143 898.61473
3530.0000 -117.46383 -111.61383 5.84999 2.50193 -111.04786 873.91735
3535.0000 -115.77550 -110.24701 5.52849 2.52063 -110.79747 918.93666
3540.0000 -116.02764 -111.33620 4.69144 2.51813 -110.83095 917.35485
3545.0000 -116.31253 -111.64286 4.66967 2.47934 -111.35031 879.34111
3550.0000 -116.44820 -110.51982 5.92838 2.51581 -110.86202 913.96362
3555.0000 -115.23722 -108.88439 6.35283 2.61188 -109.57556 977.44384
3560.0000 -116.33203 -110.63961 5.69242 2.58381 -109.95139 957.35968
3565.0000 -116.79504 -111.02836 5.76668 2.50239 -111.04175 894.25317
3570.0000 -116.50957 -111.38945 5.12012 2.46955 -111.48148 849.66082
3575.0000 -117.09419 -110.99075 6.10344 2.45304 -111.70255 830.16330
3580.0000 -117.09620 -112.31455 4.78165 2.44355 -111.82955 846.14152
3585.0000 -116.89621 -111.23531 5.66091 2.46914 -111.48700 899.84472
3590.0000 -116.78684 -110.82115 5.96570 2.51977 -110.80896 878.49776
3595.0000 -117.40730 -110.19632 7.21097 2.54334 -110.49341 957.33671
3600.0000 -118.38712 -111.83621 6.55091 2.51449 -110.87973 904.45223
3605.0000 -118.10640 -112.48954 5.61686 2.43147 -111.99140 855.43037
3610.0000 -117.99473 -112.03953 5.95520 2.40933 -112.28785 821.60683
3615.0000 -116.02933 -110.67648 5.35284 2.50106 -111.05951 913.28399
3620.0000 -117.67010 -111.55601 6.11409 2.54573 -110.46141 900.37539
3625.0000 -117.28747 -111.52973 5.75774 2.43149 -111.99111 830.24088
3630.0000 -117.08839 -111.12580 5.96259 2.43666 -111.92189 858.13892
3635.0000 -116.78915 -110.19305 6.59610 2.50405 -111.01952 880.92011
3640.0000 -117.28003 -112.04108 5.23895 2.49298 -111.16776 860.24258
3645.0000 -117.65387 -112.95618 4.69768 2.38160 -112.65914 816.31394
3650.0000 -118.05571 -112.59429 5.46142 2.42123 -112.12848 842.85157
3655.0000 -116.04835 -110.88816 5.16019 2.41804 -112.17115 858.70535
3660.0000 -116.10248 -109.55919 6.54329 2.61763 -109.49852 964.51108
3665.0000 -114.93192 -108.76171 6.17021 2.61828 -109.48993 982.94401
3670.0000 -116.11491 -109.11440 7.00052 2.64962 -109.07028 989.29592
3675.0000 -115.71180 -109.78013 5.93167 2.62481 -109.40249 974.08656
3680.0000 -117.96469 -111.67298 6.29171 2.52355 -110.75842 877.88328
3685.0000 -117.53521 -112.63096 4.90424 2.34276 -113.17920 779.82645
3690.0000 -117.37180 -112.34906 5.02273 2.37107 -112.80013 765.41884
3695.0000 -116.63205 -111.08238 5.54966 2.48969 -111.21173 862.65654
3700.0000 -117.25105 -111.40496 5.84608 2.44159 -111.85578 843.11027
3705.0000 -117.85167 -111.26827 6.58340 2.48206 -111.31399 876.56652
3710.0000 -115.93436 -110.76943 5.16493 2.52371 -110.75615 884.59065
3715.0000 -117.50534 -112.80715 4.69819 2.43204 -111.98373 853.89845
3720.0000 -118.03681 -112.55492 5.48189 2.31260 -113.58311 745.85480
3725.0000 -116.86331 -111.88575 4.97755 2.45474 -111.67978 858.52282
3730.0000 -116.07573 -109.85051 6.22522 2.46739 -111.51036 856.14030
3735.0000 -116.94504 -110.58418 6.36086 2.51497 -110.87321 897.06732
3740.0000 -116.70883 -110.63056 6.07828 2.55111 -110.38935 914.28785
3745.0000 -115.33551 -109.97416 5.36136 2.56389 -110.21825 902.16934
3750.0000 -116.82054 -110.75600 6.06454 2.47297 -111.43571 837.84112
FREEZING PROCESS: loop number 16 T-loop= 842.00000000000000
main_MD> interactions number 16 at Temperature= 842.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.60586 -4.22819 -0.23301
force_rgl> df(natom) 1.44685 -1.61953 -0.44279
3755.0000 -115.92313 -110.21977 5.70335 2.50375 -111.02353 880.33318
3760.0000 -117.63485 -111.61357 6.02129 2.51117 -110.92407 896.53738
3765.0000 -117.25322 -111.81967 5.43355 2.40402 -112.35893 808.15300
3770.0000 -118.83253 -114.46170 4.37082 2.34791 -113.11033 763.53402
3775.0000 -119.26156 -114.50339 4.75816 2.18442 -115.29954 647.97236
3780.0000 -118.70745 -113.90222 4.80524 2.28470 -113.95667 728.50262
3785.0000 -116.91596 -111.72261 5.19335 2.37990 -112.68192 819.13308
3790.0000 -117.05200 -111.07811 5.97389 2.50042 -111.06809 896.65130
3795.0000 -116.93949 -111.56044 5.37905 2.42919 -112.02182 868.26766
3800.0000 -117.00853 -112.16652 4.84201 2.40246 -112.37976 832.38368
3805.0000 -117.53961 -112.27907 5.26055 2.46801 -111.50205 871.50156
3810.0000 -117.87858 -113.18212 4.69646 2.37000 -112.81449 781.32941
3815.0000 -116.31271 -112.14991 4.16281 2.40047 -112.40651 798.29248
3820.0000 -117.54466 -112.04104 5.50362 2.40688 -112.32059 791.54981
3825.0000 -117.20628 -112.82614 4.38015 2.41296 -112.23916 809.16773
3830.0000 -116.55124 -109.45097 7.10027 2.44208 -111.84925 843.82357
3835.0000 -116.46772 -110.66473 5.80300 2.56954 -110.14247 941.80026
3840.0000 -117.60050 -110.87550 6.72500 2.52896 -110.68592 871.94439
3845.0000 -116.76789 -111.75222 5.01567 2.44777 -111.77314 819.16582
3850.0000 -116.08965 -110.86936 5.22029 2.48391 -111.28916 837.14562
3855.0000 -116.82075 -110.97150 5.84925 2.52616 -110.72336 881.79916
3860.0000 -116.38196 -110.50400 5.87796 2.50400 -111.02015 864.60503
3865.0000 -117.52326 -112.67787 4.84539 2.46556 -111.53493 855.38704
3870.0000 -117.55965 -113.16371 4.39593 2.37207 -112.78670 799.65377
3875.0000 -117.31691 -111.07128 6.24563 2.39540 -112.47430 795.61888
3880.0000 -117.68477 -112.47022 5.21455 2.39190 -112.52121 798.07600
3885.0000 -118.60106 -112.61967 5.98139 2.43108 -111.99655 845.19157
3890.0000 -116.59825 -110.66348 5.93477 2.38740 -112.58147 812.22979
3895.0000 -117.80653 -112.47415 5.33238 2.40979 -112.28163 834.58521
3900.0000 -116.93422 -112.16300 4.77122 2.41548 -112.20545 813.90592
3905.0000 -116.90911 -111.35331 5.55580 2.49448 -111.14758 868.59121
3910.0000 -116.45122 -111.19564 5.25558 2.51105 -110.92570 928.50061
3915.0000 -115.92606 -110.96140 4.96466 2.51572 -110.86318 865.88330
3920.0000 -117.46596 -111.36705 6.09891 2.49692 -111.11501 850.17040
3925.0000 -116.79261 -110.28751 6.50510 2.51508 -110.87184 903.49554
3930.0000 -117.01479 -110.95624 6.05856 2.53212 -110.64365 953.35885
3935.0000 -117.35762 -111.97888 5.37873 2.48777 -111.23749 881.35612
3940.0000 -118.68311 -114.29249 4.39063 2.32584 -113.40577 732.73954
3945.0000 -117.20500 -112.37025 4.83475 2.33853 -113.23590 759.02413
3950.0000 -117.09861 -112.54939 4.54922 2.39732 -112.44861 823.24158
3955.0000 -117.44189 -112.97877 4.46312 2.37754 -112.71347 817.44327
3960.0000 -118.36126 -113.38224 4.97902 2.41839 -112.16646 849.12494
3965.0000 -115.91145 -110.76381 5.14764 2.45983 -111.61158 863.64636
3970.0000 -117.64915 -111.63692 6.01224 2.48699 -111.24788 844.12501
3975.0000 -116.58373 -111.58372 5.00000 2.48870 -111.22499 868.99342
3980.0000 -116.60461 -112.40136 4.20326 2.43745 -111.91134 843.67893
3985.0000 -117.50389 -111.96942 5.53447 2.39671 -112.45680 811.24609
3990.0000 -118.04610 -112.90793 5.13817 2.39297 -112.50687 827.35126
3995.0000 -118.33018 -113.62000 4.71018 2.34015 -113.21420 749.48745
4000.0000 -118.02339 -112.45595 5.56743 2.33989 -113.21768 737.88217
FREEZING PROCESS: loop number 17 T-loop= 817.00000000000000
main_MD> interactions number 17 at Temperature= 817.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.99822 3.51511 -0.08101
force_rgl> df(natom) -1.57310 -0.63097 -0.29705
4005.0000 -118.06614 -112.51273 5.55341 2.42141 -112.12604 822.90815
4010.0000 -117.49150 -112.44698 5.04452 2.46743 -111.50982 892.66596
4015.0000 -117.22037 -111.77834 5.44204 2.42744 -112.04534 832.43927
4020.0000 -118.00963 -112.83027 5.17936 2.43576 -111.93394 844.51623
4025.0000 -118.48571 -111.97991 6.50580 2.38455 -112.61961 830.52008
4030.0000 -118.24789 -112.88543 5.36246 2.44797 -111.77039 836.86671
4035.0000 -118.88130 -113.73032 5.15098 2.33159 -113.32886 755.10718
4040.0000 -117.33505 -112.06511 5.26994 2.38159 -112.65924 786.58789
4045.0000 -117.56999 -111.22981 6.34018 2.40979 -112.28160 815.09328
4050.0000 -118.46292 -113.68625 4.77667 2.43771 -111.90781 848.00515
4055.0000 -116.55518 -111.70878 4.84640 2.43147 -111.99135 844.45370
4060.0000 -118.46477 -112.81104 5.65372 2.38439 -112.62180 803.55298
4065.0000 -117.94342 -111.05697 6.88645 2.42672 -112.05500 804.56352
4070.0000 -117.32757 -112.24630 5.08127 2.42333 -112.10040 844.25680
4075.0000 -118.55831 -113.47066 5.08764 2.42678 -112.05415 837.39206
4080.0000 -117.46941 -113.10588 4.36353 2.33197 -113.32368 756.62111
4085.0000 -116.42345 -112.14669 4.27676 2.39235 -112.51516 778.73345
4090.0000 -118.62821 -113.96434 4.66387 2.36736 -112.84981 798.11738
4095.0000 -117.13919 -112.93301 4.20618 2.38072 -112.67097 778.66518
4100.0000 -118.27971 -114.16176 4.11795 2.29777 -113.78163 745.80912
4105.0000 -117.95220 -113.33144 4.62076 2.27731 -114.05568 735.93012
4110.0000 -117.37335 -113.18008 4.19327 2.40968 -112.28315 820.65910
4115.0000 -117.32682 -111.44570 5.88112 2.39468 -112.48403 770.50014
4120.0000 -117.69602 -112.35789 5.33814 2.42824 -112.03459 865.12067
4125.0000 -117.30650 -111.77210 5.53440 2.43109 -111.99643 841.92089
4130.0000 -116.94272 -111.49721 5.44552 2.48311 -111.29987 887.45504
4135.0000 -117.67859 -112.05160 5.62699 2.43623 -111.92768 845.01557
4140.0000 -118.44943 -113.10634 5.34309 2.44578 -111.79976 873.18847
4145.0000 -118.19637 -113.33590 4.86047 2.35690 -112.98994 791.51818
4150.0000 -118.22571 -113.55643 4.66928 2.38227 -112.65018 835.85248
4155.0000 -118.98304 -113.96123 5.02181 2.27143 -114.13433 746.96887
4160.0000 -118.83880 -113.40464 5.43416 2.26402 -114.23358 743.69322
4165.0000 -117.65628 -113.43398 4.22231 2.35384 -113.03086 773.09236
4170.0000 -118.09615 -113.85837 4.23779 2.34315 -113.17396 768.95824
4175.0000 -117.40437 -112.93950 4.46487 2.34174 -113.19289 780.31245
4180.0000 -117.44113 -113.29360 4.14753 2.36090 -112.93627 783.86478
4185.0000 -117.87279 -112.29427 5.57853 2.38573 -112.60380 798.58734
4190.0000 -117.50070 -112.53575 4.96495 2.41822 -112.16884 824.30201
4195.0000 -118.01108 -112.81668 5.19440 2.38596 -112.60074 780.02276
4200.0000 -118.92465 -114.32270 4.60195 2.33668 -113.26071 779.96030
4205.0000 -118.51825 -113.79932 4.71893 2.28622 -113.93634 715.88857
4210.0000 -116.99521 -113.07754 3.91767 2.34728 -113.11864 805.35172
4215.0000 -118.60979 -113.66167 4.94812 2.27159 -114.13219 721.10598
4220.0000 -118.28579 -113.55274 4.73305 2.36329 -112.90431 772.04485
4225.0000 -117.48151 -112.68152 4.79999 2.37053 -112.80742 785.90384
4230.0000 -118.11155 -112.22541 5.88614 2.38382 -112.62943 816.85780
4235.0000 -117.18032 -111.51149 5.66882 2.40873 -112.29583 815.05635
4240.0000 -118.65515 -113.58308 5.07207 2.34246 -113.18322 768.66120
4245.0000 -116.53674 -112.01054 4.52620 2.36765 -112.84589 778.17853
4250.0000 -118.10461 -112.73977 5.36484 2.38483 -112.61590 757.00333
FREEZING PROCESS: loop number 18 T-loop= 792.00000000000000
main_MD> interactions number 18 at Temperature= 792.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.75366 1.74816 -1.24321
force_rgl> df(natom) -3.86761 0.54271 -1.42930
4255.0000 -117.57804 -113.01012 4.56793 2.32819 -113.37432 762.70819
4260.0000 -117.84353 -112.83448 5.00905 2.35142 -113.06327 796.68955
4265.0000 -118.08929 -113.61479 4.47449 2.33601 -113.26958 770.12486
4270.0000 -118.74240 -113.60832 5.13408 2.31166 -113.59570 740.47205
4275.0000 -116.56873 -111.53087 5.03786 2.41726 -112.18169 821.53739
4280.0000 -117.48928 -111.17448 6.31480 2.45371 -111.69351 871.58279
4285.0000 -118.15960 -112.10190 6.05769 2.41424 -112.22204 828.93007
4290.0000 -117.51069 -112.64962 4.86106 2.45466 -111.68083 845.29073
4295.0000 -117.19591 -112.70176 4.49415 2.40845 -112.29967 814.04722
4300.0000 -116.63425 -111.38460 5.24965 2.41124 -112.26229 784.29502
4305.0000 -118.13445 -111.01076 7.12369 2.49393 -111.15505 902.88853
4310.0000 -117.04491 -111.28549 5.75942 2.48429 -111.28412 868.10602
4315.0000 -117.98190 -112.82971 5.15219 2.41323 -112.23556 830.53314
4320.0000 -119.54818 -113.40684 6.14134 2.35572 -113.00565 755.35579
4325.0000 -117.32326 -112.61779 4.70547 2.36145 -112.92895 777.08567
4330.0000 -117.20967 -110.55634 6.65334 2.42468 -112.08227 848.55510
4335.0000 -117.74589 -112.97161 4.77428 2.47344 -111.42932 838.52810
4340.0000 -117.00942 -111.51754 5.49188 2.38465 -112.61833 787.01487
4345.0000 -117.80711 -113.02368 4.78344 2.41794 -112.17258 831.65765
4350.0000 -117.76326 -113.57088 4.19238 2.32392 -113.43147 745.33678
4355.0000 -117.83694 -113.04147 4.79547 2.36494 -112.88225 796.42684
4360.0000 -118.50784 -113.92943 4.57842 2.29448 -113.82570 750.06252
4365.0000 -119.93649 -115.67389 4.26259 2.19608 -115.14341 676.35350
4370.0000 -118.56819 -114.44717 4.12103 2.16435 -115.56821 652.80686
4375.0000 -119.20546 -114.26321 4.94225 2.26118 -114.27162 708.66111
4380.0000 -118.68204 -112.80843 5.87361 2.32576 -113.40682 783.35241
4385.0000 -118.43199 -113.47700 4.95499 2.35349 -113.03561 790.46827
4390.0000 -117.02022 -113.21444 3.80579 2.29913 -113.76343 760.11694
4395.0000 -117.49298 -112.70337 4.78961 2.35539 -113.01012 749.92250
4400.0000 -117.02664 -112.20656 4.82008 2.37960 -112.68594 792.88180
4405.0000 -118.07200 -112.59390 5.47810 2.45768 -111.64033 889.49747
4410.0000 -117.31990 -112.69880 4.62110 2.40405 -112.35855 812.82517
4415.0000 -117.50023 -113.38414 4.11610 2.37869 -112.69813 759.39937
4420.0000 -117.84792 -113.34769 4.50023 2.33136 -113.33192 773.83985
4425.0000 -117.52768 -111.77766 5.75002 2.39478 -112.48265 777.17214
4430.0000 -117.71284 -112.19937 5.51347 2.41902 -112.15812 823.10970
4435.0000 -116.73639 -111.46778 5.26861 2.47638 -111.38994 868.44414
4440.0000 -116.96437 -111.30302 5.66135 2.43581 -111.93324 854.03424
4445.0000 -118.76303 -113.02317 5.73986 2.40509 -112.34462 807.07129
4450.0000 -117.83981 -112.57248 5.26732 2.41061 -112.27062 822.12095
4455.0000 -117.71663 -112.73126 4.98537 2.42303 -112.10443 824.55316
4460.0000 -118.44883 -113.93113 4.51770 2.32634 -113.39906 749.02470
4465.0000 -117.72025 -113.64868 4.07156 2.21964 -114.82784 684.82824
4470.0000 -118.90461 -113.66794 5.23667 2.28454 -113.95883 731.01383
4475.0000 -117.77527 -113.11195 4.66333 2.34129 -113.19895 761.23547
4480.0000 -118.87684 -113.81380 5.06304 2.34001 -113.21604 795.56678
4485.0000 -117.83191 -113.05548 4.77643 2.33738 -113.25127 792.56279
4490.0000 -117.55437 -113.52646 4.02791 2.33779 -113.24580 742.80688
4495.0000 -118.28544 -113.30590 4.97954 2.34895 -113.09634 788.60353
4500.0000 -117.09245 -112.41528 4.67717 2.40902 -112.29193 848.14258
FREEZING PROCESS: loop number 19 T-loop= 767.00000000000000
main_MD> interactions number 19 at Temperature= 767.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.75574 0.93693 0.07570
force_rgl> df(natom) 2.24807 -0.92828 1.15454
4505.0000 -117.59882 -112.49320 5.10562 2.36909 -112.82667 754.82627
4510.0000 -119.01365 -114.29138 4.72227 2.33214 -113.32148 756.46647
4515.0000 -119.64867 -114.12368 5.52499 2.31628 -113.53388 748.32610
4520.0000 -118.76461 -114.58762 4.17700 2.25431 -114.36367 724.60059
4525.0000 -118.40399 -113.69666 4.70734 2.27836 -114.04160 754.55225
4530.0000 -116.83122 -112.84254 3.98868 2.33238 -113.31823 748.66054
4535.0000 -118.57239 -113.75889 4.81350 2.33492 -113.28424 740.39017
4540.0000 -118.35503 -113.12408 5.23095 2.29034 -113.88118 737.89507
4545.0000 -118.04341 -112.60468 5.43873 2.36422 -112.89192 793.60358
4550.0000 -118.91298 -112.90457 6.00841 2.38164 -112.65862 817.52425
4555.0000 -118.16736 -112.80921 5.35815 2.36658 -112.86024 765.41729
4560.0000 -119.04332 -114.19589 4.84743 2.36187 -112.92336 755.45056
4565.0000 -118.52923 -113.46218 5.06705 2.29646 -113.79925 738.88706
4570.0000 -117.39439 -112.82744 4.56695 2.35437 -113.02373 743.92586
4575.0000 -118.12539 -112.68621 5.43918 2.36756 -112.84712 778.47408
4580.0000 -116.94187 -111.81239 5.12948 2.37816 -112.70519 823.56989
4585.0000 -116.30397 -110.83607 5.46790 2.46022 -111.60633 868.77823
4590.0000 -117.68563 -111.78504 5.90059 2.44651 -111.78995 876.58190
4595.0000 -117.75572 -112.71496 5.04076 2.44134 -111.85919 859.78690
4600.0000 -119.23976 -114.21938 5.02038 2.35984 -112.95048 788.80285
4605.0000 -118.79172 -113.96396 4.82776 2.28503 -113.95227 703.02327
4610.0000 -120.17206 -115.85931 4.31275 2.17879 -115.37485 669.90099
4615.0000 -119.47560 -114.26347 5.21214 2.17948 -115.36568 635.78317
4620.0000 -118.72056 -114.09050 4.63006 2.29629 -113.80143 729.67186
4625.0000 -118.46417 -114.06331 4.40086 2.33912 -113.22796 768.19457
4630.0000 -119.00876 -114.41577 4.59299 2.27922 -114.03010 717.94588
4635.0000 -118.53140 -113.02180 5.50960 2.28451 -113.95929 751.13215
4640.0000 -118.45195 -113.29963 5.15232 2.33560 -113.27514 773.89774
4645.0000 -119.25221 -114.28671 4.96550 2.30269 -113.71575 732.21332
4650.0000 -118.18296 -112.93646 5.24650 2.32787 -113.37856 777.06784
4655.0000 -116.90311 -112.30504 4.59807 2.34254 -113.18212 735.68699
4660.0000 -118.32680 -113.25592 5.07088 2.39555 -112.47236 794.26809
4665.0000 -119.45455 -114.79611 4.65844 2.27225 -114.12335 719.61204
4670.0000 -118.39369 -113.73674 4.65695 2.24128 -114.53808 704.04586
4675.0000 -117.31724 -112.66749 4.64975 2.36865 -112.83254 797.78974
4680.0000 -117.39520 -111.69764 5.69757 2.39681 -112.45542 815.21657
4685.0000 -118.49775 -113.13192 5.36583 2.37643 -112.72839 801.93905
4690.0000 -117.00277 -111.72811 5.27465 2.40809 -112.30448 838.79715
4695.0000 -117.84900 -113.20634 4.64265 2.43148 -111.99121 824.72317
4700.0000 -118.01656 -112.98517 5.03139 2.36313 -112.90647 779.75376
4705.0000 -117.49471 -112.45555 5.03916 2.42868 -112.02869 836.78339
4710.0000 -117.40065 -112.37153 5.02913 2.42575 -112.06797 797.68070
4715.0000 -117.94113 -113.31744 4.62369 2.37527 -112.74397 784.08275
4720.0000 -117.53545 -111.99750 5.53795 2.35248 -113.04912 771.74917
4725.0000 -118.07104 -112.20695 5.86409 2.42854 -112.03061 852.96850
4730.0000 -117.01647 -112.50730 4.50917 2.42980 -112.01371 813.31386
4735.0000 -117.94842 -114.58049 3.36794 2.33296 -113.31045 749.99624
4740.0000 -118.68712 -114.45547 4.23164 2.21096 -114.94414 683.19202
4745.0000 -119.37796 -114.24418 5.13378 2.22701 -114.72916 678.18648
4750.0000 -118.40970 -114.50347 3.90623 2.27674 -114.06321 717.58821
FREEZING PROCESS: loop number 20 T-loop= 742.00000000000000
main_MD> interactions number 20 at Temperature= 742.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.14914 3.06963 -1.39351
force_rgl> df(natom) -1.36499 0.31556 1.24679
4755.0000 -119.01168 -114.93743 4.07426 2.27315 -114.11141 719.41458
4760.0000 -119.45482 -114.63961 4.81521 2.21823 -114.84680 673.16516
4765.0000 -118.84091 -113.34086 5.50006 2.29946 -113.75903 748.10472
4770.0000 -117.91783 -112.74305 5.17478 2.35725 -112.98518 769.19614
4775.0000 -119.19174 -113.90983 5.28192 2.28852 -113.90556 733.74548
4780.0000 -118.48245 -114.29905 4.18340 2.28567 -113.94372 735.83666
4785.0000 -117.97778 -113.73201 4.24577 2.25490 -114.35574 696.12520
4790.0000 -118.78889 -115.25619 3.53270 2.23346 -114.64280 679.22371
4795.0000 -119.32302 -115.52001 3.80301 2.21136 -114.93879 664.75824
4800.0000 -117.82454 -113.38886 4.43568 2.26758 -114.18597 712.73483
4805.0000 -118.76841 -112.96500 5.80341 2.32837 -113.37194 770.78496
4810.0000 -119.19480 -114.67340 4.52140 2.24706 -114.46072 716.67920
4815.0000 -119.04196 -114.35282 4.68914 2.21585 -114.87864 696.13466
4820.0000 -119.52827 -114.80929 4.71898 2.23176 -114.66561 678.67302
4825.0000 -118.26879 -114.17937 4.08943 2.23403 -114.63517 676.89981
4830.0000 -117.37603 -112.34148 5.03455 2.32993 -113.35103 770.98463
4835.0000 -119.27276 -113.57740 5.69537 2.35442 -113.02305 805.20941
4840.0000 -119.43263 -114.07228 5.36035 2.26800 -114.18031 739.68651
4845.0000 -117.97876 -114.31328 3.66548 2.21012 -114.95530 669.92484
4850.0000 -118.88202 -114.59058 4.29144 2.28697 -113.92631 737.43992
4855.0000 -119.40750 -114.51756 4.88995 2.23876 -114.57189 702.51098
4860.0000 -119.06773 -114.76846 4.29928 2.24212 -114.52680 682.53339
4865.0000 -119.42591 -115.42992 3.99599 2.19223 -115.19484 652.59922
4870.0000 -118.53576 -114.18968 4.34608 2.25579 -114.34383 734.00226
4875.0000 -118.14695 -113.35739 4.78956 2.33580 -113.27236 781.31158
4880.0000 -118.18557 -113.68426 4.50132 2.32389 -113.43192 740.43596
4885.0000 -118.49641 -113.92815 4.56826 2.31847 -113.50447 743.20022
4890.0000 -117.61185 -112.05537 5.55648 2.34630 -113.13178 772.71840
4895.0000 -118.20990 -113.98784 4.22206 2.32967 -113.35456 745.31659
4900.0000 -117.27765 -113.10039 4.17726 2.34086 -113.20465 721.13689
4905.0000 -117.89330 -112.59164 5.30166 2.40351 -112.36581 811.27502
4910.0000 -117.76557 -112.50108 5.26449 2.38357 -112.63277 831.59764
4915.0000 -116.78060 -113.17126 3.60934 2.41196 -112.25262 817.97361
4920.0000 -117.06132 -112.74650 4.31481 2.32944 -113.35760 714.20283
4925.0000 -117.08419 -112.30666 4.77753 2.32597 -113.40407 742.86119
4930.0000 -117.94261 -113.22257 4.72004 2.36986 -112.81634 791.07193
4935.0000 -118.50641 -113.80300 4.70341 2.33296 -113.31041 757.78087
4940.0000 -117.17567 -113.29318 3.88250 2.31561 -113.54282 742.28555
4945.0000 -118.02009 -113.62794 4.39215 2.31807 -113.50983 732.70149
4950.0000 -118.39725 -114.69693 3.70032 2.29496 -113.81930 722.54158
4955.0000 -120.12049 -114.88802 5.23247 2.21370 -114.90739 681.75590
4960.0000 -118.87451 -114.51470 4.35980 2.22703 -114.72895 691.02219
4965.0000 -119.39487 -114.77779 4.61708 2.26464 -114.22525 725.19615
4970.0000 -117.37602 -113.18901 4.18701 2.25892 -114.30190 674.28833
4975.0000 -117.22611 -112.84918 4.37693 2.35781 -112.97767 771.17467
4980.0000 -117.67953 -112.55175 5.12778 2.39775 -112.44288 791.92179
4985.0000 -117.82345 -113.67771 4.14573 2.31844 -113.50486 765.66440
4990.0000 -118.09777 -113.26406 4.83371 2.32144 -113.46478 747.02363
4995.0000 -120.30316 -115.92400 4.37916 2.24511 -114.48676 682.53931
5000.0000 -120.41019 -116.28067 4.12953 2.14908 -115.77266 656.14721
FREEZING PROCESS: loop number 21 T-loop= 717.00000000000000
main_MD> interactions number 21 at Temperature= 717.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.35804 -0.93049 0.60646
force_rgl> df(natom) 1.30573 1.42366 2.00128
5005.0000 -120.38239 -116.38501 3.99738 2.11375 -116.24583 628.59416
5010.0000 -118.06775 -113.64699 4.42075 2.20399 -115.03741 695.17744
5015.0000 -119.12247 -114.39605 4.72641 2.24188 -114.53011 663.99510
5020.0000 -119.29774 -114.40891 4.88882 2.26314 -114.24532 741.09673
5025.0000 -118.77126 -114.46468 4.30658 2.20695 -114.99777 687.58144
5030.0000 -117.73591 -113.61262 4.12329 2.28587 -113.94105 715.85272
5035.0000 -117.97574 -113.44712 4.52862 2.33060 -113.34202 759.94273
5040.0000 -118.58274 -114.79069 3.79205 2.26466 -114.22509 680.14324
5045.0000 -118.70457 -114.11684 4.58772 2.25805 -114.31357 698.83278
5050.0000 -119.59264 -115.18668 4.40596 2.21182 -114.93260 676.76323
5055.0000 -120.03448 -114.87997 5.15451 2.19765 -115.12234 678.07482
5060.0000 -118.90659 -114.80149 4.10511 2.23355 -114.64160 711.19426
5065.0000 -119.00865 -115.32009 3.68856 2.21838 -114.84477 699.50330
5070.0000 -119.38728 -114.47062 4.91666 2.18723 -115.26190 686.82831
5075.0000 -118.12702 -113.22274 4.90428 2.29874 -113.76866 744.80865
5080.0000 -118.91484 -113.58200 5.33284 2.29292 -113.84664 769.26398
5085.0000 -118.23263 -113.12126 5.11137 2.27836 -114.04155 735.90645
5090.0000 -119.93528 -114.29404 5.64123 2.25028 -114.41757 703.46345
5095.0000 -117.83882 -113.73813 4.10069 2.27130 -114.13610 736.38492
5100.0000 -118.35452 -113.55735 4.79716 2.31562 -113.54261 753.48523
5105.0000 -118.57883 -112.74081 5.83802 2.35705 -112.98794 776.75295
5110.0000 -118.21800 -114.65261 3.56539 2.25823 -114.31114 716.42718
5115.0000 -118.13016 -114.62952 3.50065 2.23439 -114.63031 692.29477
5120.0000 -118.57367 -114.11386 4.45981 2.24268 -114.51931 687.02735
5125.0000 -119.02188 -115.46152 3.56035 2.23390 -114.63692 668.63031
5130.0000 -119.23328 -115.62703 3.60626 2.14665 -115.80527 610.79568
5135.0000 -119.00934 -113.81321 5.19614 2.22472 -114.75979 673.17990
5140.0000 -119.14027 -114.77350 4.36678 2.23441 -114.63003 718.49779
5145.0000 -119.26405 -114.95958 4.30447 2.23750 -114.58875 698.13390
5150.0000 -119.01094 -114.37116 4.63978 2.23945 -114.56264 686.04889
5155.0000 -117.65955 -113.47147 4.18808 2.30490 -113.68621 733.45308
5160.0000 -119.10592 -114.47169 4.63423 2.26368 -114.23813 758.72813
5165.0000 -119.37495 -114.37781 4.99714 2.29342 -113.83990 729.59286
5170.0000 -119.05081 -115.69799 3.35282 2.14781 -115.78973 614.83974
5175.0000 -119.44472 -114.86467 4.58005 2.20573 -115.01419 653.71868
5180.0000 -119.20049 -114.50051 4.69998 2.22022 -114.82009 687.02408
5185.0000 -118.99731 -114.84872 4.14859 2.26185 -114.26261 705.96486
5190.0000 -118.02770 -114.02304 4.00466 2.26047 -114.28117 701.37063
5195.0000 -118.03494 -114.62648 3.40846 2.22187 -114.79803 683.28980
5200.0000 -118.74916 -114.56730 4.18186 2.26715 -114.19166 695.50488
5205.0000 -119.32555 -115.38153 3.94402 2.21802 -114.84955 683.03031
5210.0000 -120.09579 -115.42305 4.67274 2.19899 -115.10436 650.16703
5215.0000 -120.09414 -115.45783 4.63631 2.17293 -115.45341 679.59654
5220.0000 -119.84493 -115.79736 4.04756 2.20369 -115.04139 679.48200
5225.0000 -120.07161 -115.37020 4.70141 2.18091 -115.34653 658.39667
5230.0000 -120.30175 -115.72683 4.57492 2.19209 -115.19682 662.19008
5235.0000 -120.08899 -115.67966 4.40933 2.15879 -115.64270 636.57063
5240.0000 -118.89476 -114.01569 4.87907 2.20067 -115.08193 670.39523
5245.0000 -120.09364 -115.09088 5.00276 2.22327 -114.77925 724.54510
5250.0000 -119.94218 -116.03152 3.91065 2.21727 -114.85960 681.75371
FREEZING PROCESS: loop number 22 T-loop= 692.00000000000000
main_MD> interactions number 22 at Temperature= 692.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.71693 3.31520 -0.07430
force_rgl> df(natom) -0.10870 -1.21235 2.00851
5255.0000 -118.17083 -114.61498 3.55585 2.17136 -115.47433 608.15402
5260.0000 -119.11124 -114.31106 4.80018 2.26366 -114.23848 682.94168
5265.0000 -119.77393 -115.51588 4.25805 2.22574 -114.74623 683.78232
5270.0000 -119.38787 -116.36213 3.02574 2.13803 -115.92064 631.60340
5275.0000 -119.28811 -115.19053 4.09758 2.13840 -115.91577 625.54579
5280.0000 -119.14995 -115.13972 4.01023 2.19986 -115.09277 657.82079
5285.0000 -118.81498 -113.90697 4.90801 2.23959 -114.56073 687.83972
5290.0000 -119.00634 -114.79467 4.21168 2.26081 -114.27656 738.76239
5295.0000 -118.81935 -114.09886 4.72048 2.21555 -114.88259 681.06064
5300.0000 -118.38804 -114.56236 3.82568 2.24883 -114.43701 685.16608
5305.0000 -117.66330 -113.66883 3.99447 2.27924 -114.02974 711.82035
5310.0000 -118.34949 -112.73446 5.61503 2.32862 -113.36863 774.80707
5315.0000 -118.25136 -113.08900 5.16235 2.40270 -112.37665 796.16970
5320.0000 -118.23629 -112.83601 5.40028 2.34410 -113.16122 764.67907
5325.0000 -118.08646 -113.48552 4.60095 2.34965 -113.08697 787.87410
5330.0000 -118.25160 -113.81544 4.43616 2.28208 -113.99172 705.62365
5335.0000 -118.38062 -113.07002 5.31060 2.30868 -113.63564 735.36552
5340.0000 -119.51603 -115.16533 4.35070 2.24318 -114.51263 717.50968
5345.0000 -118.40680 -114.23843 4.16837 2.19933 -115.09987 658.99404
5350.0000 -118.58599 -113.95522 4.63077 2.30771 -113.64859 765.00522
5355.0000 -119.14227 -114.24285 4.89941 2.31524 -113.54777 728.73075
5360.0000 -118.92520 -114.53867 4.38652 2.28026 -114.01620 727.97916
5365.0000 -118.60754 -114.62023 3.98730 2.22182 -114.79863 660.62525
5370.0000 -119.27949 -115.94426 3.33523 2.19941 -115.09874 651.38590
5375.0000 -118.03355 -114.25583 3.77772 2.19638 -115.13937 664.60044
5380.0000 -118.95206 -114.87094 4.08111 2.23592 -114.60984 637.11870
5385.0000 -118.60660 -113.95705 4.64955 2.27163 -114.13173 689.50629
5390.0000 -119.39626 -115.33185 4.06442 2.28315 -113.97744 716.33618
5395.0000 -118.45392 -114.40355 4.05036 2.17723 -115.39574 633.73664
5400.0000 -118.30421 -112.82461 5.47959 2.32202 -113.45697 765.96172
5405.0000 -117.99013 -112.18402 5.80611 2.41739 -112.17993 839.05585
5410.0000 -117.68168 -114.30523 3.37645 2.34420 -113.15988 778.77265
5415.0000 -119.25918 -115.44913 3.81005 2.21471 -114.89393 672.86717
5420.0000 -120.29510 -115.70541 4.58968 2.15754 -115.65943 669.60333
5425.0000 -119.15332 -115.27072 3.88259 2.17014 -115.49070 658.45996
5430.0000 -119.45843 -115.28940 4.16903 2.20055 -115.08350 683.12076
5435.0000 -118.30653 -113.57180 4.73474 2.27365 -114.10467 714.38069
5440.0000 -118.46551 -113.42421 5.04130 2.31661 -113.52943 731.44262
5445.0000 -119.88757 -114.01382 5.87375 2.28355 -113.97208 738.67199
5450.0000 -118.13453 -113.55432 4.58021 2.30456 -113.69073 738.49010
5455.0000 -119.40917 -113.58508 5.82408 2.30355 -113.70421 761.43112
5460.0000 -118.82290 -114.49889 4.32401 2.27864 -114.03779 727.57756
5465.0000 -119.35696 -114.97955 4.37742 2.19809 -115.11639 639.23223
5470.0000 -119.08785 -114.71457 4.37328 2.21915 -114.83440 693.58572
5475.0000 -118.97888 -114.94770 4.03118 2.22414 -114.76764 671.37274
5480.0000 -118.64113 -113.35979 5.28134 2.26242 -114.25503 705.45221
5485.0000 -119.37707 -114.75147 4.62560 2.30033 -113.74734 741.83347
5490.0000 -119.53896 -115.36872 4.17024 2.20658 -115.00268 692.96614
5495.0000 -119.20541 -115.37941 3.82600 2.16547 -115.55330 631.78656
5500.0000 -119.39576 -113.85388 5.54187 2.24070 -114.54587 699.63793
FREEZING PROCESS: loop number 23 T-loop= 667.00000000000000
main_MD> interactions number 23 at Temperature= 667.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.53825 -1.43730 0.61319
force_rgl> df(natom) -0.74237 1.42424 2.26163
5505.0000 -119.13302 -115.08862 4.04440 2.25252 -114.38754 682.47232
5510.0000 -118.49012 -114.95549 3.53463 2.19170 -115.20207 610.96271
5515.0000 -118.63102 -113.88160 4.74942 2.23972 -114.55905 681.01566
5520.0000 -119.97252 -114.92853 5.04398 2.21618 -114.87420 684.39962
5525.0000 -118.97684 -114.73592 4.24092 2.22985 -114.69113 678.39010
5530.0000 -120.03540 -115.45914 4.57626 2.20174 -115.06757 675.03537
5535.0000 -119.67625 -115.04918 4.62707 2.14276 -115.85727 639.46551
5540.0000 -119.84090 -116.56883 3.27207 2.14002 -115.89401 605.02296
5545.0000 -119.76216 -116.23286 3.52930 2.09494 -116.49763 589.49028
5550.0000 -119.64049 -115.53582 4.10467 2.16370 -115.57689 635.83684
5555.0000 -119.57476 -115.97758 3.59718 2.15309 -115.71907 630.39412
5560.0000 -119.78471 -116.17694 3.60777 2.15126 -115.74348 647.64639
5565.0000 -118.34748 -114.02898 4.31850 2.22267 -114.78727 694.29710
5570.0000 -119.35595 -114.54159 4.81436 2.28064 -114.01104 720.92662
5575.0000 -118.83792 -114.20969 4.62823 2.24964 -114.42609 709.48133
5580.0000 -118.68547 -113.34245 5.34302 2.27786 -114.04834 737.73016
5585.0000 -119.32885 -114.83645 4.49240 2.25900 -114.30076 693.21470
5590.0000 -118.93596 -114.06552 4.87044 2.20325 -115.04732 667.16023
5595.0000 -118.85420 -114.72256 4.13163 2.28906 -113.89826 728.01472
5600.0000 -118.79909 -114.90419 3.89490 2.19963 -115.09575 657.51719
5605.0000 -118.92596 -115.01729 3.90867 2.22787 -114.71767 663.66172
5610.0000 -118.85626 -114.58594 4.27032 2.24496 -114.48878 690.10343
5615.0000 -118.05903 -114.08966 3.96937 2.29638 -113.80029 713.10750
5620.0000 -119.99955 -115.81596 4.18359 2.21649 -114.87008 681.01238
5625.0000 -118.59128 -114.08924 4.50205 2.18935 -115.23345 655.60797
5630.0000 -118.41415 -113.62535 4.78880 2.28924 -113.89595 743.92631
5635.0000 -118.34887 -114.26027 4.08859 2.29785 -113.78063 736.49561
5640.0000 -119.79335 -115.33756 4.45579 2.24814 -114.44628 701.86331
5645.0000 -118.83483 -115.86446 2.97037 2.14467 -115.83177 614.76484
5650.0000 -119.68491 -115.18683 4.49808 2.15404 -115.70633 628.08892
5655.0000 -119.49777 -115.13016 4.36760 2.18882 -115.24055 634.58831
5660.0000 -119.35182 -115.51636 3.83545 2.18782 -115.25393 658.85086
5665.0000 -119.02519 -114.50359 4.52160 2.21357 -114.90914 678.24747
5670.0000 -119.61929 -114.83091 4.78838 2.21173 -114.93378 677.80670
5675.0000 -118.56539 -114.25367 4.31172 2.26730 -114.18963 723.47622
5680.0000 -118.31543 -113.62915 4.68628 2.28537 -113.94766 740.73687
5685.0000 -118.09030 -113.60349 4.48681 2.32015 -113.48196 766.44236
5690.0000 -118.20803 -113.75563 4.45241 2.30251 -113.71822 743.40781
5695.0000 -119.60854 -115.19092 4.41762 2.21051 -114.95011 659.42824
5700.0000 -119.31510 -114.47771 4.83739 2.24992 -114.42236 707.90525
5705.0000 -119.46008 -115.23694 4.22314 2.19938 -115.09918 668.73800
5710.0000 -119.40444 -114.80335 4.60109 2.17630 -115.40815 646.57605
5715.0000 -119.07299 -114.83170 4.24128 2.24750 -114.45487 689.72444
5720.0000 -119.13660 -114.64578 4.49082 2.21725 -114.85991 675.24883
5725.0000 -119.70237 -115.47972 4.22265 2.20289 -115.05216 675.75702
5730.0000 -119.02858 -114.90474 4.12385 2.23342 -114.64330 695.91771
5735.0000 -118.78964 -114.37478 4.41486 2.19852 -115.11063 649.91454
5740.0000 -118.83145 -114.36544 4.46601 2.25172 -114.39825 694.96516
5745.0000 -119.46904 -115.05183 4.41721 2.19776 -115.12092 662.76220
5750.0000 -119.39530 -115.40955 3.98575 2.19519 -115.15524 660.41956
FREEZING PROCESS: loop number 24 T-loop= 642.00000000000000
main_MD> interactions number 24 at Temperature= 642.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.69769 3.96454 0.43357
force_rgl> df(natom) 2.95738 -0.40276 1.55521
5755.0000 -119.20625 -115.09684 4.10941 2.18305 -115.31783 628.69247
5760.0000 -118.87363 -114.31623 4.55740 2.25821 -114.31144 714.30301
5765.0000 -119.07658 -115.21015 3.86643 2.21805 -114.84910 671.09045
5770.0000 -118.39016 -113.97342 4.41674 2.25269 -114.38531 698.98240
5775.0000 -121.51097 -116.97782 4.53314 2.19218 -115.19557 688.40112
5780.0000 -120.28200 -116.82606 3.45593 2.08512 -116.62910 622.36879
5785.0000 -120.56377 -116.02657 4.53720 2.10471 -116.36678 620.19431
5790.0000 -119.96690 -115.73948 4.22742 2.12039 -116.15694 605.70770
5795.0000 -119.33531 -115.25795 4.07736 2.16443 -115.56713 659.46191
5800.0000 -118.85333 -115.80060 3.05273 2.19035 -115.22004 648.89890
5805.0000 -118.99759 -114.85089 4.14670 2.14845 -115.78117 608.82497
5810.0000 -119.36333 -114.87860 4.48472 2.18846 -115.24538 669.42856
5815.0000 -120.47430 -115.86529 4.60901 2.14480 -115.83001 642.26240
5820.0000 -120.73568 -116.06072 4.67496 2.14556 -115.81989 616.87554
5825.0000 -119.97682 -115.88249 4.09433 2.14256 -115.85999 630.66988
5830.0000 -121.10627 -117.46676 3.63951 2.06849 -116.85184 574.24544
5835.0000 -120.81923 -117.55207 3.26716 2.04589 -117.15443 546.62348
5840.0000 -118.88259 -115.74665 3.13594 2.08264 -116.66240 558.90111
5845.0000 -120.14175 -115.26731 4.87445 2.18332 -115.31417 664.15193
5850.0000 -119.39455 -115.35786 4.03669 2.19816 -115.11553 654.45090
5855.0000 -118.36696 -113.43277 4.93419 2.27155 -114.13280 704.59472
5860.0000 -118.99280 -115.37785 3.61495 2.23754 -114.58813 680.59239
5865.0000 -119.40979 -115.80353 3.60626 2.17561 -115.41740 646.47620
5870.0000 -120.12021 -116.53200 3.58821 2.16364 -115.57769 642.82345
5875.0000 -120.87699 -116.59676 4.28023 2.06317 -116.92312 566.99000
5880.0000 -119.81780 -115.70130 4.11650 2.09624 -116.48030 592.06872
5885.0000 -120.53694 -116.79672 3.74022 2.13184 -116.00352 619.23189
5890.0000 -120.61337 -116.33960 4.27377 2.08664 -116.60875 591.56090
5895.0000 -120.14027 -116.51047 3.62980 2.06601 -116.88504 572.43697
5900.0000 -119.55505 -115.51890 4.03615 2.12896 -116.04215 609.11065
5905.0000 -120.19082 -115.43542 4.75540 2.14676 -115.80373 631.50124
5910.0000 -120.77348 -116.71732 4.05616 2.12435 -116.10380 623.24919
5915.0000 -119.85176 -115.62766 4.22410 2.12168 -116.13964 623.45863
5920.0000 -120.13573 -116.27774 3.85799 2.11618 -116.21330 615.28607
5925.0000 -118.99197 -115.35859 3.63339 2.14245 -115.86146 633.38398
5930.0000 -120.24421 -115.71134 4.53287 2.16679 -115.53555 641.83490
5935.0000 -120.71988 -115.73509 4.98479 2.17819 -115.38296 670.27667
5940.0000 -120.13462 -115.85695 4.27766 2.13151 -116.00801 603.47462
5945.0000 -118.89862 -114.62107 4.27755 2.18153 -115.33818 671.78128
5950.0000 -119.26005 -114.92823 4.33183 2.25487 -114.35615 695.44086
5955.0000 -120.40889 -115.78985 4.61903 2.21362 -114.90851 692.17498
5960.0000 -118.86020 -115.39451 3.46570 2.13777 -115.92420 599.97325
5965.0000 -119.49734 -114.60632 4.89102 2.17850 -115.37870 609.07240
5970.0000 -119.32927 -114.95722 4.37204 2.21479 -114.89282 668.11101
5975.0000 -119.49521 -115.78799 3.70722 2.19908 -115.10312 664.39706
5980.0000 -119.29812 -115.42566 3.87246 2.19670 -115.13506 647.16751
5985.0000 -117.93980 -113.65976 4.28003 2.23337 -114.64400 659.77525
5990.0000 -119.43644 -114.87282 4.56362 2.24662 -114.46653 710.92025
5995.0000 -119.23942 -115.57572 3.66370 2.18114 -115.34344 667.20117
6000.0000 -119.66946 -115.36948 4.29998 2.16994 -115.49344 658.83253
FREEZING PROCESS: loop number 25 T-loop= 617.00000000000000
main_MD> interactions number 25 at Temperature= 617.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.50115 -0.29571 1.17675
force_rgl> df(natom) 1.65685 2.50508 0.18062
6005.0000 -119.37372 -115.99578 3.37794 2.17015 -115.49059 633.56787
6010.0000 -119.78326 -116.21303 3.57023 2.13437 -115.96964 611.17450
6015.0000 -120.31200 -116.34703 3.96497 2.12136 -116.14394 588.86854
6020.0000 -120.76966 -116.68582 4.08384 2.09697 -116.47053 586.85824
6025.0000 -121.16534 -117.56545 3.59989 2.05590 -117.02037 605.85578
6030.0000 -121.09267 -116.74975 4.34292 2.06730 -116.86782 626.64359
6035.0000 -121.72187 -117.40812 4.31375 2.04410 -117.17838 625.89470
6040.0000 -120.50467 -116.64592 3.85875 2.03751 -117.26666 616.54316
6045.0000 -120.20146 -115.74876 4.45271 2.08835 -116.58596 631.38601
6050.0000 -119.52264 -115.03510 4.48754 2.14484 -115.82946 659.91445
6055.0000 -119.97290 -115.80965 4.16324 2.17789 -115.38686 647.44375
6060.0000 -119.72641 -115.84740 3.87901 2.14612 -115.81235 623.65011
6065.0000 -119.70461 -115.92470 3.77992 2.14116 -115.87874 628.83836
6070.0000 -120.30828 -116.92961 3.37866 2.09068 -116.55466 563.68752
6075.0000 -120.65026 -116.78374 3.86652 2.08252 -116.66392 572.44229
6080.0000 -119.96076 -116.06978 3.89098 2.07569 -116.75547 574.35810
6085.0000 -119.65260 -115.94880 3.70380 2.12944 -116.03564 594.96211
6090.0000 -119.40906 -115.16263 4.24643 2.12088 -116.15032 585.55430
6095.0000 -119.20980 -114.87880 4.33100 2.23134 -114.67122 691.71453
6100.0000 -120.02737 -115.64418 4.38319 2.18222 -115.32896 660.96546
6105.0000 -119.73488 -116.47987 3.25501 2.12948 -116.03515 614.91711
6110.0000 -120.19915 -116.40139 3.79776 2.09737 -116.46511 601.83669
6115.0000 -119.97261 -116.34022 3.63239 2.13139 -116.00961 636.97164
6120.0000 -120.10559 -116.87327 3.23232 2.11191 -116.27040 599.92607
6125.0000 -120.07507 -116.16758 3.90749 2.11155 -116.27519 596.35023
6130.0000 -120.27376 -116.42481 3.84896 2.10760 -116.32808 623.98154
6135.0000 -121.27769 -116.98979 4.28790 2.07644 -116.74543 569.61184
6140.0000 -120.34192 -116.62731 3.71461 2.08288 -116.65921 607.28929
6145.0000 -119.63469 -115.94558 3.68911 2.12191 -116.13650 610.74356
6150.0000 -119.65617 -116.32365 3.33251 2.12565 -116.08638 617.82858
6155.0000 -120.10412 -116.01469 4.08943 2.13795 -115.92179 621.12456
6160.0000 -119.36023 -115.49995 3.86028 2.12454 -116.10130 592.94164
6165.0000 -119.34263 -115.63434 3.70829 2.21967 -114.82744 686.28307
6170.0000 -119.79610 -115.99276 3.80334 2.12419 -116.10596 602.89762
6175.0000 -120.08311 -116.28046 3.80265 2.12036 -116.15727 613.45660
6180.0000 -120.13774 -115.61425 4.52349 2.12709 -116.06718 634.37273
6185.0000 -120.11094 -115.98363 4.12731 2.16317 -115.58399 656.94995
6190.0000 -120.07316 -115.88249 4.19068 2.13355 -115.98059 610.78098
6195.0000 -120.41487 -116.31629 4.09858 2.10116 -116.41441 583.94134
6200.0000 -119.56148 -116.35811 3.20337 2.09547 -116.49061 605.51926
6205.0000 -120.42386 -117.11385 3.31001 2.09271 -116.52758 615.63935
6210.0000 -119.69809 -115.84430 3.85379 2.10922 -116.30649 596.85467
6215.0000 -120.08379 -116.53202 3.55177 2.11988 -116.16372 602.98830
6220.0000 -120.35430 -116.32446 4.02984 2.11746 -116.19615 585.30808
6225.0000 -120.30943 -116.98092 3.32851 2.08714 -116.60207 576.79705
6230.0000 -120.30626 -116.40939 3.89687 2.08994 -116.56460 577.44666
6235.0000 -119.49948 -115.37893 4.12055 2.11736 -116.19739 580.55032
6240.0000 -118.91850 -115.06699 3.85151 2.19299 -115.18477 637.68024
6245.0000 -119.51536 -115.83040 3.68496 2.16620 -115.54344 648.93402
6250.0000 -119.17748 -115.26369 3.91379 2.19092 -115.21251 640.49424
FREEZING PROCESS: loop number 26 T-loop= 592.00000000000000
main_MD> interactions number 26 at Temperature= 592.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.95750 -2.04322 -0.62201
force_rgl> df(natom) -1.90739 -2.62780 0.35043
6255.0000 -120.17733 -115.92792 4.24941 2.17241 -115.46031 655.50378
6260.0000 -119.99157 -115.81443 4.17713 2.14511 -115.82581 609.75705
6265.0000 -120.24067 -115.89145 4.34922 2.16903 -115.50559 637.08310
6270.0000 -119.37914 -115.85153 3.52760 2.17926 -115.36862 655.58526
6275.0000 -120.03791 -115.57844 4.45947 2.20941 -114.96482 663.59523
6280.0000 -120.55614 -116.92000 3.63613 2.12318 -116.11958 574.33957
6285.0000 -120.45671 -116.68919 3.76752 2.06276 -116.92854 541.47905
6290.0000 -120.02088 -116.93520 3.08568 2.07579 -116.75411 537.30234
6295.0000 -120.79750 -117.02919 3.76831 2.08413 -116.64243 563.21139
6300.0000 -120.29598 -116.01486 4.28112 2.08914 -116.57533 581.12611
6305.0000 -118.57770 -115.25890 3.31880 2.15168 -115.73787 594.06523
6310.0000 -120.06359 -115.47411 4.58949 2.13291 -115.98923 593.55032
6315.0000 -119.18068 -115.53935 3.64133 2.16601 -115.54595 614.68893
6320.0000 -120.35997 -116.79006 3.56991 2.12519 -116.09257 591.16751
6325.0000 -120.38381 -116.99299 3.39082 2.06386 -116.91391 561.15010
6330.0000 -120.32227 -117.23958 3.08270 2.07220 -116.80219 538.98115
6335.0000 -120.40976 -116.78121 3.62855 2.08940 -116.57185 589.34510
6340.0000 -120.39587 -116.97707 3.41880 2.06356 -116.91787 558.70692
6345.0000 -120.38595 -116.46932 3.91663 2.04687 -117.14134 541.49866
6350.0000 -121.31908 -117.39557 3.92351 2.04220 -117.20390 551.18063
6355.0000 -121.08777 -116.72361 4.36416 2.04094 -117.22073 564.24165
6360.0000 -119.64732 -116.24900 3.39832 2.08547 -116.62451 576.28058
6365.0000 -120.41465 -116.47464 3.94001 2.11183 -116.27148 588.94424
6370.0000 -120.74351 -116.47552 4.26799 2.07273 -116.79511 606.09135
6375.0000 -120.31214 -117.42821 2.88393 2.05760 -116.99765 576.23888
6380.0000 -120.51704 -117.38950 3.12754 2.03168 -117.34482 534.42557
6385.0000 -119.62626 -115.91619 3.71007 2.07151 -116.81144 559.02037
6390.0000 -120.70051 -117.12559 3.57492 2.10776 -116.32597 606.17624
6395.0000 -120.41003 -116.34132 4.06871 2.08258 -116.66320 574.75185
6400.0000 -119.99171 -116.56945 3.42226 2.13433 -115.97017 619.95565
6405.0000 -120.44665 -116.65646 3.79020 2.06220 -116.93609 566.89879
6410.0000 -120.41054 -117.21723 3.19331 2.08908 -116.57620 565.06341
6415.0000 -120.77236 -117.63257 3.13979 2.02672 -117.41120 540.74943
6420.0000 -120.25973 -116.69432 3.56541 2.07173 -116.80849 580.48770
6425.0000 -119.81769 -115.91550 3.90219 2.12610 -116.08043 637.49910
6430.0000 -119.89946 -116.13843 3.76103 2.13732 -115.93014 640.40877
6435.0000 -120.05432 -116.62491 3.42942 2.09501 -116.49670 588.37100
6440.0000 -118.48657 -114.73317 3.75339 2.18086 -115.34711 650.62215
6445.0000 -119.32714 -115.91816 3.40898 2.15216 -115.73146 608.05779
6450.0000 -119.30228 -116.14099 3.16129 2.16685 -115.53470 652.82396
6455.0000 -120.05326 -116.26170 3.79156 2.14191 -115.86870 625.34674
6460.0000 -119.69604 -116.41788 3.27815 2.09913 -116.44152 594.73238
6465.0000 -119.74024 -116.38140 3.35884 2.07512 -116.76304 523.47538
6470.0000 -120.50760 -116.10274 4.40486 2.09451 -116.50341 558.71249
6475.0000 -120.76005 -117.50761 3.25244 2.06265 -116.92999 556.53700
6480.0000 -120.04665 -116.45997 3.58668 2.06605 -116.88447 555.05436
6485.0000 -120.41669 -116.12940 4.28729 2.12644 -116.07587 624.74543
6490.0000 -119.86360 -116.53857 3.32502 2.08806 -116.58980 591.05760
6495.0000 -120.19704 -116.80925 3.38779 2.11438 -116.23733 604.35763
6500.0000 -119.55984 -116.18815 3.37169 2.11445 -116.23646 608.20969
FREEZING PROCESS: loop number 27 T-loop= 567.00000000000000
main_MD> interactions number 27 at Temperature= 567.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.50887 -0.71085 -2.19813
force_rgl> df(natom) 1.88433 -1.49587 -2.58834
6505.0000 -120.65079 -117.76853 2.88226 2.03493 -117.30122 537.83512
6510.0000 -121.52968 -118.12409 3.40559 1.97918 -118.04771 508.97230
6515.0000 -120.88479 -117.24190 3.64289 1.98741 -117.93761 519.78737
6520.0000 -120.83130 -117.23823 3.59307 2.04848 -117.11982 549.99631
6525.0000 -120.60277 -116.71587 3.88691 2.03754 -117.26628 556.80337
6530.0000 -120.22139 -116.48813 3.73326 2.07484 -116.76677 566.03895
6535.0000 -120.59662 -117.16040 3.43622 2.08407 -116.64327 590.77588
6540.0000 -120.18261 -116.28547 3.89714 2.10706 -116.33543 615.94994
6545.0000 -120.92091 -117.16655 3.75437 2.04250 -117.19987 554.06343
6550.0000 -120.07124 -116.60073 3.47051 2.06287 -116.92706 567.50770
6555.0000 -121.00893 -117.34356 3.66537 2.05243 -117.06687 567.43365
6560.0000 -120.60766 -117.35821 3.24944 2.01828 -117.52412 529.69466
6565.0000 -120.66441 -116.70584 3.95857 2.05126 -117.08257 546.81057
6570.0000 -120.50307 -116.32025 4.18282 2.10787 -116.32454 609.03655
6575.0000 -119.81066 -116.66578 3.14488 2.09840 -116.45139 602.85997
6580.0000 -120.72061 -116.55522 4.16539 2.14130 -115.87691 614.43735
6585.0000 -119.83281 -116.24824 3.58457 2.09846 -116.45052 592.04939
6590.0000 -120.58344 -116.91497 3.66847 2.05171 -117.07651 573.01215
6595.0000 -120.40903 -116.24423 4.16480 2.08696 -116.60456 600.34703
6600.0000 -120.65538 -117.09476 3.56062 2.06909 -116.84375 589.11975
6605.0000 -119.94383 -116.30209 3.64175 2.08134 -116.67973 582.59290
6610.0000 -120.80267 -116.34855 4.45412 2.09481 -116.49938 596.87847
6615.0000 -120.02064 -116.27239 3.74825 2.07371 -116.78198 556.72607
6620.0000 -119.75061 -115.92856 3.82205 2.13423 -115.97161 612.24575
6625.0000 -119.37259 -115.64301 3.72959 2.14290 -115.85544 588.15333
6630.0000 -120.46434 -115.57166 4.89268 2.15910 -115.63853 631.25827
6635.0000 -119.76025 -115.82624 3.93401 2.13659 -115.93992 638.15571
6640.0000 -119.81392 -116.79722 3.01670 2.10435 -116.37167 580.57967
6645.0000 -120.57698 -116.76323 3.81374 2.06963 -116.83662 559.06302
6650.0000 -119.90523 -115.97516 3.93008 2.11201 -116.26903 572.08027
6655.0000 -119.41276 -115.95063 3.46213 2.13813 -115.91927 601.25147
6660.0000 -120.48134 -117.17020 3.31114 2.08912 -116.57567 558.82379
6665.0000 -121.48143 -117.92195 3.55948 2.00841 -117.65629 497.82771
6670.0000 -120.88444 -116.74508 4.13935 2.03803 -117.25968 534.57030
6675.0000 -120.25801 -116.58868 3.66934 2.10577 -116.35263 598.96761
6680.0000 -119.35044 -116.38752 2.96292 2.05494 -117.03333 536.48455
6685.0000 -120.10761 -116.60819 3.49942 2.11087 -116.28431 587.39203
6690.0000 -120.72987 -116.49570 4.23416 2.11801 -116.18873 591.60635
6695.0000 -119.74268 -116.33651 3.40617 2.11031 -116.29183 562.26739
6700.0000 -119.83593 -115.62630 4.20962 2.12556 -116.08768 566.96120
6705.0000 -119.43346 -115.84271 3.59075 2.14774 -115.79071 613.04977
6710.0000 -120.95033 -116.60243 4.34789 2.09967 -116.43437 577.22038
6715.0000 -120.54573 -117.02876 3.51697 2.04257 -117.19893 540.15750
6720.0000 -120.60517 -117.09564 3.50953 2.06515 -116.89654 548.70582
6725.0000 -120.04556 -117.13044 2.91512 2.05358 -117.05146 554.58974
6730.0000 -120.73251 -116.32486 4.40765 2.05869 -116.98307 550.38731
6735.0000 -121.03848 -117.01193 4.02655 2.09792 -116.45781 574.06957
6740.0000 -121.11324 -117.82036 3.29288 2.02105 -117.48703 536.40489
6745.0000 -120.76217 -117.38067 3.38150 2.03966 -117.23783 558.19924
6750.0000 -121.04805 -117.85515 3.19290 2.02972 -117.37095 526.55091
FREEZING PROCESS: loop number 28 T-loop= 542.00000000000000
main_MD> interactions number 28 at Temperature= 542.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.99748 -0.34347 1.24059
force_rgl> df(natom) -1.29047 1.37318 2.07753
6755.0000 -120.87551 -117.82586 3.04965 1.98644 -117.95053 490.72816
6760.0000 -120.92044 -117.58912 3.33132 1.99280 -117.86536 528.21796
6765.0000 -121.38939 -117.85244 3.53694 1.98826 -117.92612 502.22437
6770.0000 -120.90393 -116.86377 4.04016 2.03150 -117.34721 531.72740
6775.0000 -120.67053 -118.04013 2.63040 2.05716 -117.00356 548.45127
6780.0000 -120.93488 -117.71895 3.21593 1.99465 -117.84063 489.61185
6785.0000 -120.04832 -116.59018 3.45814 2.04210 -117.20525 543.56398
6790.0000 -119.35274 -115.68612 3.66662 2.10921 -116.30664 602.23826
6795.0000 -120.45081 -116.60220 3.84862 2.08970 -116.56789 567.94391
6800.0000 -120.26333 -117.16442 3.09891 2.08203 -116.67053 555.58785
6805.0000 -119.56953 -115.82894 3.74059 2.08966 -116.56835 551.44576
6810.0000 -119.58263 -115.99197 3.59066 2.14650 -115.80728 605.48474
6815.0000 -120.81514 -116.77230 4.04284 2.11346 -116.24965 588.26194
6820.0000 -120.63492 -117.65667 2.97825 2.05762 -116.99739 539.74129
6825.0000 -120.63102 -117.57255 3.05847 1.98406 -117.98247 466.48556
6830.0000 -121.12652 -117.33441 3.79211 2.00756 -117.66773 499.18216
6835.0000 -120.97530 -117.61619 3.35911 2.07109 -116.81701 573.32860
6840.0000 -120.31325 -116.45809 3.85516 2.04839 -117.12105 547.87030
6845.0000 -120.82655 -117.67159 3.15497 2.05917 -116.97667 542.39935
6850.0000 -121.05400 -117.84196 3.21204 2.04288 -117.19477 561.54400
6855.0000 -121.03851 -117.85730 3.18121 1.99029 -117.89892 521.51756
6860.0000 -120.65182 -117.50702 3.14480 1.98220 -118.00731 514.91038
6865.0000 -120.27105 -116.21207 4.05898 2.05487 -117.03428 560.77656
6870.0000 -120.22486 -117.00389 3.22096 2.08033 -116.69331 558.95737
6875.0000 -120.25532 -116.71859 3.53673 2.04047 -117.22705 508.74805
6880.0000 -120.59694 -117.34638 3.25056 2.03894 -117.24756 506.28609
6885.0000 -121.03247 -117.28563 3.74684 2.02034 -117.49664 520.90688
6890.0000 -120.59791 -117.69129 2.90662 2.01497 -117.56847 516.47005
6895.0000 -121.73672 -118.23515 3.50157 1.99733 -117.80470 516.65689
6900.0000 -120.55517 -117.73186 2.82331 1.99036 -117.89798 528.51758
6905.0000 -121.13584 -117.63672 3.49912 2.01519 -117.56556 543.63628
6910.0000 -120.69001 -116.94909 3.74092 2.01404 -117.58097 522.80854
6915.0000 -121.05519 -117.44422 3.61097 2.05359 -117.05136 568.92006
6920.0000 -121.73755 -118.11783 3.61972 1.99864 -117.78717 530.62563
6925.0000 -120.77370 -117.76541 3.00830 2.00752 -117.66826 517.88208
6930.0000 -120.95796 -118.04741 2.91055 1.99175 -117.87943 492.69041
6935.0000 -120.33558 -116.98306 3.35252 1.99983 -117.77122 511.84848
6940.0000 -120.75216 -117.80145 2.95070 2.01237 -117.60334 515.49944
6945.0000 -121.38265 -118.31498 3.06767 1.99823 -117.79272 508.21131
6950.0000 -121.07169 -117.29958 3.77211 1.98764 -117.93446 480.13018
6955.0000 -120.66274 -116.88177 3.78097 2.03561 -117.29207 535.73793
6960.0000 -119.99045 -116.40219 3.58826 2.11677 -116.20531 609.52241
6965.0000 -121.62320 -118.44793 3.17527 2.02684 -117.40959 544.22018
6970.0000 -121.19297 -118.20099 2.99198 1.96391 -118.25224 491.54814
6975.0000 -120.96976 -117.61866 3.35110 1.99684 -117.81122 520.43526
6980.0000 -121.43805 -118.28051 3.15755 1.97538 -118.09862 478.05419
6985.0000 -121.64045 -118.73524 2.90521 1.96308 -118.26329 489.58997
6990.0000 -121.44291 -118.72987 2.71304 1.92991 -118.70756 461.75330
6995.0000 -120.76047 -117.72112 3.03936 1.92524 -118.77004 491.55070
7000.0000 -120.39254 -117.10741 3.28513 2.03808 -117.25908 567.83561
FREEZING PROCESS: loop number 29 T-loop= 517.00000000000000
main_MD> interactions number 29 at Temperature= 517.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.23183 -0.72803 2.21254
force_rgl> df(natom) -0.38202 0.75703 -0.22001
7005.0000 -121.27965 -117.84673 3.43291 2.01984 -117.50336 534.86893
7010.0000 -122.06057 -117.91558 4.14498 1.98066 -118.02790 510.02938
7015.0000 -121.70478 -117.77507 3.92970 1.97537 -118.09875 513.31976
7020.0000 -121.42574 -118.05625 3.36949 1.97667 -118.08134 497.78869
7025.0000 -121.39000 -118.30136 3.08864 1.98065 -118.02810 499.48901
7030.0000 -120.63755 -117.55951 3.07803 1.96576 -118.22747 485.88061
7035.0000 -120.75202 -118.01952 2.73250 1.99286 -117.86458 487.50198
7040.0000 -121.09260 -117.64067 3.45193 1.99699 -117.80926 503.23595
7045.0000 -120.77313 -118.08575 2.68738 2.01991 -117.50242 508.12036
7050.0000 -120.46872 -117.99000 2.47872 2.00761 -117.66709 497.76125
7055.0000 -120.92944 -118.16633 2.76311 1.96517 -118.23540 445.26158
7060.0000 -120.28104 -117.53477 2.74627 2.03095 -117.35458 525.19151
7065.0000 -120.54075 -116.85632 3.68443 2.01146 -117.61554 507.25890
7070.0000 -120.65227 -117.44271 3.20956 2.05871 -116.98280 570.13108
7075.0000 -120.02141 -116.44864 3.57277 2.03307 -117.32619 535.20145
7080.0000 -119.74987 -116.03104 3.71884 2.08922 -116.57430 537.34182
7085.0000 -120.34940 -116.99581 3.35359 2.11952 -116.16849 583.52757
7090.0000 -120.55957 -116.27102 4.28856 2.08900 -116.57716 541.41356
7095.0000 -120.33402 -116.69365 3.64038 2.07484 -116.76680 551.77915
7100.0000 -120.69077 -117.10976 3.58101 2.03821 -117.25734 536.87215
7105.0000 -121.03304 -117.51261 3.52042 2.02831 -117.38993 546.98881
7110.0000 -120.52316 -117.87736 2.64579 1.98367 -117.98767 523.17036
7115.0000 -120.35259 -117.44978 2.90281 1.97946 -118.04400 493.12311
7120.0000 -120.61419 -117.11133 3.50286 2.01493 -117.56908 529.93757
7125.0000 -120.67180 -116.92780 3.74400 2.09509 -116.49569 575.53737
7130.0000 -120.78267 -116.87576 3.90691 2.04753 -117.13247 516.63369
7135.0000 -120.71000 -117.67842 3.03158 2.00879 -117.65130 517.56017
7140.0000 -120.85405 -117.15090 3.70315 2.00434 -117.71083 512.48121
7145.0000 -121.24771 -117.38213 3.86558 2.03028 -117.36351 544.06597
7150.0000 -121.19962 -117.56310 3.63652 2.01965 -117.50586 551.26386
7155.0000 -120.32452 -117.23427 3.09025 2.01071 -117.62555 501.61165
7160.0000 -121.13161 -117.63791 3.49370 2.03931 -117.24260 541.98945
7165.0000 -121.43242 -118.94091 2.49151 1.94466 -118.50999 470.37058
7170.0000 -121.98213 -118.23969 3.74244 1.92253 -118.80628 464.00568
7175.0000 -122.38197 -118.50577 3.87620 1.94370 -118.52288 495.88090
7180.0000 -121.40550 -118.34810 3.05741 1.94765 -118.46996 482.28184
7185.0000 -122.12971 -119.45490 2.67481 1.92210 -118.81214 473.71048
7190.0000 -121.21134 -118.22890 2.98245 1.92825 -118.72971 468.55402
7195.0000 -121.59380 -117.85431 3.73948 1.97087 -118.15909 506.97092
7200.0000 -120.80677 -117.61687 3.18990 2.01512 -117.56650 538.92613
7205.0000 -120.53059 -117.42172 3.10887 2.02252 -117.46739 513.81381
7210.0000 -120.46181 -116.99529 3.46652 2.05094 -117.08681 547.04676
7215.0000 -121.16654 -118.07254 3.09400 2.01086 -117.62354 569.71093
7220.0000 -121.56258 -118.45113 3.11145 1.92691 -118.74766 518.65526
7225.0000 -121.83730 -118.05502 3.78227 1.98946 -117.91007 565.82172
7230.0000 -121.10329 -117.82501 3.27828 1.97387 -118.11881 538.88775
7235.0000 -121.72468 -117.58767 4.13701 2.00014 -117.76703 563.93976
7240.0000 -121.53174 -118.09116 3.44058 2.00034 -117.76436 548.06322
7245.0000 -120.64603 -117.27942 3.36661 1.98514 -117.96797 526.12139
7250.0000 -120.68021 -117.97096 2.70925 2.00478 -117.70501 521.40805
FREEZING PROCESS: loop number 30 T-loop= 492.00000000000000
main_MD> interactions number 30 at Temperature= 492.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 4.46880 -1.01097 1.35795
force_rgl> df(natom) 1.93034 -0.72721 -1.71359
7255.0000 -120.72171 -117.63687 3.08484 2.01845 -117.52189 499.63753
7260.0000 -121.24643 -118.37340 2.87304 1.96337 -118.25950 466.76895
7265.0000 -120.22163 -117.71469 2.50694 1.95456 -118.37749 466.40719
7270.0000 -121.79513 -118.63075 3.16438 1.98869 -117.92041 505.33119
7275.0000 -121.24717 -118.63417 2.61300 1.94327 -118.52863 441.10099
7280.0000 -121.38099 -117.74577 3.63522 1.96466 -118.24214 468.04059
7285.0000 -120.33609 -117.62002 2.71607 1.99956 -117.77480 524.11009
7290.0000 -121.18231 -117.81480 3.36751 2.01060 -117.62708 511.62555
7295.0000 -121.57162 -118.48897 3.08265 1.97004 -118.17018 477.48552
7300.0000 -121.90852 -118.96062 2.94789 1.92742 -118.74086 487.02405
7305.0000 -122.16862 -119.23738 2.93123 1.88351 -119.32877 446.25343
7310.0000 -121.63379 -118.65578 2.97801 1.93398 -118.65297 498.81145
7315.0000 -122.82489 -119.15461 3.67028 1.92604 -118.75935 497.65918
7320.0000 -121.63798 -118.81972 2.81825 1.87342 -119.46393 452.67713
7325.0000 -121.68794 -118.46498 3.22296 1.90761 -119.00617 479.95922
7330.0000 -121.94405 -119.09833 2.84572 1.92951 -118.71293 498.07522
7335.0000 -121.62422 -118.55740 3.06682 1.94136 -118.55419 486.36902
7340.0000 -121.28163 -118.15184 3.12978 1.95148 -118.41861 479.26491
7345.0000 -121.78857 -118.50940 3.27917 1.96216 -118.27564 506.86728
7350.0000 -121.97866 -119.23611 2.74255 1.92759 -118.73858 484.70526
7355.0000 -122.19792 -119.68135 2.51657 1.89730 -119.14416 454.99231
7360.0000 -122.01547 -119.26317 2.75230 1.86902 -119.52284 421.07610
7365.0000 -122.13482 -119.44146 2.69335 1.87737 -119.41103 430.65059
7370.0000 -122.08161 -119.02471 3.05689 1.89773 -119.13846 447.70944
7375.0000 -121.92171 -118.50309 3.41862 1.90222 -119.07834 441.28469
7380.0000 -121.42823 -117.73862 3.68961 1.94873 -118.45546 489.09005
7385.0000 -121.70119 -118.72129 2.97990 1.98075 -118.02673 530.42338
7390.0000 -121.21966 -117.98401 3.23565 1.94021 -118.56960 483.08478
7395.0000 -120.67438 -117.47155 3.20283 1.97236 -118.13913 498.66945
7400.0000 -121.19342 -117.73534 3.45807 2.02668 -117.41164 547.24166
7405.0000 -121.29395 -118.50686 2.78709 1.99002 -117.90264 499.63209
7410.0000 -120.83755 -118.07705 2.76050 1.96597 -118.22461 484.75541
7415.0000 -121.84305 -118.16803 3.67502 1.98048 -118.03031 494.80670
7420.0000 -121.76721 -118.79203 2.97518 1.93851 -118.59241 455.52844
7425.0000 -121.27746 -118.06900 3.20846 1.95903 -118.31751 470.62763
7430.0000 -120.24172 -116.88412 3.35761 1.98197 -118.01038 496.64664
7435.0000 -121.22921 -118.32575 2.90347 1.99361 -117.85451 496.71040
7440.0000 -121.90312 -118.71005 3.19307 1.91131 -118.95663 440.85246
7445.0000 -121.54139 -118.53865 3.00274 1.90694 -119.01511 442.78675
7450.0000 -121.24008 -118.14986 3.09022 1.96895 -118.18479 483.76796
7455.0000 -121.57389 -118.81306 2.76082 1.94255 -118.53827 477.16823
7460.0000 -121.44022 -118.71075 2.72947 1.92591 -118.76112 466.49688
7465.0000 -121.46345 -117.78698 3.67646 1.97366 -118.12162 501.33702
7470.0000 -121.11433 -118.19830 2.91602 1.98801 -117.92947 498.57508
7475.0000 -121.36439 -117.77535 3.58904 2.00155 -117.74823 523.60871
7480.0000 -121.18136 -118.06750 3.11386 2.00798 -117.66215 525.94162
7485.0000 -121.44514 -118.43588 3.00926 1.96759 -118.20300 471.49211
7490.0000 -121.17738 -118.39084 2.78655 1.97554 -118.09651 473.85121
7495.0000 -120.93393 -118.38838 2.54555 1.96326 -118.26093 475.82900
7500.0000 -121.67364 -118.51906 3.15458 1.93280 -118.66887 448.11194
FREEZING PROCESS: loop number 31 T-loop= 467.00000000000000
main_MD> interactions number 31 at Temperature= 467.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.76874 -2.35618 -0.62397
force_rgl> df(natom) -0.75135 0.45868 0.22207
7505.0000 -121.65446 -118.78029 2.87417 1.95252 -118.40476 491.85703
7510.0000 -121.21999 -117.78205 3.43794 1.96262 -118.26957 518.60924
7515.0000 -121.28606 -118.60929 2.67677 1.99071 -117.89331 553.59266
7520.0000 -122.97449 -119.66491 3.30957 1.88106 -119.36158 448.42437
7525.0000 -121.56006 -118.66714 2.89292 1.90595 -119.02828 453.69932
7530.0000 -121.49897 -118.81945 2.67953 1.93784 -118.60132 451.48701
7535.0000 -121.55998 -118.69648 2.86349 1.92457 -118.77899 431.28858
7540.0000 -120.98852 -118.11990 2.86861 1.94689 -118.48019 442.53773
7545.0000 -122.00269 -118.93676 3.06593 1.95076 -118.42831 438.31584
7550.0000 -121.49259 -118.07710 3.41549 1.93618 -118.62352 431.84218
7555.0000 -121.50702 -118.86370 2.64333 1.94136 -118.55413 447.11008
7560.0000 -120.93538 -118.30719 2.62820 1.94325 -118.52889 448.27915
7565.0000 -121.71827 -118.71683 3.00144 1.94853 -118.45819 461.20635
7570.0000 -121.89996 -119.02818 2.87177 1.89953 -119.11428 418.30997
7575.0000 -121.50232 -118.64032 2.86200 1.92789 -118.73460 451.76799
7580.0000 -121.48789 -118.17680 3.31108 1.94170 -118.54968 478.76678
7585.0000 -121.90382 -118.98228 2.92154 1.93540 -118.63395 459.64861
7590.0000 -121.88032 -118.21696 3.66336 1.96267 -118.26879 489.79613
7595.0000 -121.95290 -118.83993 3.11296 1.95179 -118.41452 507.44772
7600.0000 -122.37624 -119.60358 2.77266 1.86763 -119.54153 429.04910
7605.0000 -121.73820 -118.88886 2.84934 1.88952 -119.24833 446.68782
7610.0000 -121.67411 -119.19684 2.47727 1.91699 -118.88050 445.55170
7615.0000 -121.59996 -118.45861 3.14135 1.91736 -118.87554 428.11035
7620.0000 -121.73027 -118.97351 2.75675 1.88825 -119.26534 415.19852
7625.0000 -121.30761 -117.67132 3.63628 1.95696 -118.34531 464.85053
7630.0000 -121.44378 -117.95253 3.49125 1.97625 -118.08699 483.57334
7635.0000 -121.77857 -118.66444 3.11414 1.96555 -118.23029 488.94215
7640.0000 -121.39928 -118.47081 2.92847 1.95933 -118.31352 486.80390
7645.0000 -121.48196 -118.59149 2.89047 1.91372 -118.92434 442.67082
7650.0000 -121.37725 -118.28129 3.09596 1.98366 -117.98778 520.11995
7655.0000 -121.46753 -118.73624 2.73128 1.94133 -118.55457 488.04193
7660.0000 -121.28639 -118.55337 2.73301 1.91604 -118.89318 443.87973
7665.0000 -121.60364 -118.33585 3.26779 1.93385 -118.65480 469.99306
7670.0000 -121.75544 -118.54782 3.20762 1.93960 -118.57769 486.65052
7675.0000 -122.20556 -118.95287 3.25269 1.93171 -118.68345 485.52297
7680.0000 -122.43037 -119.11017 3.32020 1.92783 -118.73541 471.26932
7685.0000 -123.19211 -120.40916 2.78296 1.85506 -119.70981 437.73718
7690.0000 -122.27813 -118.89836 3.37977 1.87400 -119.45619 477.10320
7695.0000 -122.36154 -119.33625 3.02530 1.91825 -118.86367 495.48876
7700.0000 -122.48121 -119.66435 2.81686 1.87490 -119.44411 471.51316
7705.0000 -122.73552 -119.61106 3.12446 1.84971 -119.78147 452.01123
7710.0000 -122.37337 -119.66846 2.70491 1.87307 -119.46869 468.91100
7715.0000 -122.37584 -119.54850 2.82734 1.87634 -119.42486 468.22868
7720.0000 -122.25320 -118.99041 3.26279 1.92068 -118.83104 514.32878
7725.0000 -122.48296 -119.21487 3.26809 1.89752 -119.14123 485.63436
7730.0000 -123.01664 -119.84760 3.16904 1.88669 -119.28620 488.09100
7735.0000 -122.47902 -119.43261 3.04641 1.87839 -119.39733 470.85333
7740.0000 -123.07353 -119.89831 3.17522 1.83789 -119.93974 436.15565
7745.0000 -122.20369 -119.60292 2.60077 1.82556 -120.10484 425.31091
7750.0000 -122.65941 -119.16784 3.49158 1.87379 -119.45901 470.40291
FREEZING PROCESS: loop number 32 T-loop= 442.00000000000000
main_MD> interactions number 32 at Temperature= 442.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.29036 -2.42966 0.11743
force_rgl> df(natom) -0.80245 2.07651 -0.18830
7755.0000 -122.32982 -119.33923 2.99059 1.87333 -119.46517 471.83616
7760.0000 -122.26424 -119.28332 2.98093 1.90151 -119.08784 496.23082
7765.0000 -122.36323 -118.84752 3.51572 1.92831 -118.72897 508.21975
7770.0000 -122.39022 -120.00066 2.38957 1.87341 -119.46405 477.86131
7775.0000 -122.52673 -119.94488 2.58185 1.84370 -119.86185 443.56885
7780.0000 -122.71503 -119.96637 2.74866 1.84254 -119.87746 450.22175
7785.0000 -123.55309 -121.10826 2.44483 1.78668 -120.62538 391.54521
7790.0000 -122.68724 -119.96884 2.71840 1.81165 -120.29111 422.37838
7795.0000 -122.89003 -119.94732 2.94271 1.82281 -120.14168 416.48222
7800.0000 -123.19424 -120.26494 2.92930 1.82796 -120.07270 428.67157
7805.0000 -122.41724 -120.17560 2.24164 1.80737 -120.34838 406.96278
7810.0000 -122.26072 -119.60994 2.65078 1.83388 -119.99333 427.28685
7815.0000 -122.87191 -120.14446 2.72745 1.82859 -120.06422 423.10136
7820.0000 -122.89094 -120.41954 2.47140 1.81994 -120.18000 413.91705
7825.0000 -122.66762 -120.31251 2.35511 1.80343 -120.40111 412.55776
7830.0000 -121.65083 -119.02252 2.62831 1.85305 -119.73672 454.62233
7835.0000 -122.29074 -119.43210 2.85864 1.92580 -118.76259 523.01359
7840.0000 -122.72582 -119.52439 3.20143 1.85301 -119.73725 450.10667
7845.0000 -122.24863 -119.96577 2.28286 1.83755 -119.94423 432.79232
7850.0000 -121.94675 -119.06524 2.88151 1.86228 -119.61304 465.39241
7855.0000 -122.67204 -119.99270 2.67934 1.86218 -119.61446 454.89145
7860.0000 -122.66489 -119.87348 2.79141 1.82740 -120.08022 423.72476
7865.0000 -122.84098 -119.65916 3.18182 1.85678 -119.68673 462.34673
7870.0000 -122.41343 -119.25214 3.16129 1.88717 -119.27980 487.38348
7875.0000 -122.09378 -119.55411 2.53967 1.89198 -119.21545 485.33996
7880.0000 -121.75587 -119.40023 2.35565 1.87181 -119.48556 441.58807
7885.0000 -122.13116 -119.38072 2.75044 1.89206 -119.21440 443.25923
7890.0000 -122.69744 -119.65418 3.04326 1.88233 -119.34466 452.87891
7895.0000 -122.90120 -119.79352 3.10767 1.88903 -119.25487 471.95279
7900.0000 -122.10010 -118.08661 4.01349 1.94118 -118.55662 500.49110
7905.0000 -121.46357 -118.41953 3.04403 1.94126 -118.55552 502.48901
7910.0000 -121.35162 -118.28768 3.06395 1.97236 -118.13912 533.79510
7915.0000 -122.26318 -119.64807 2.61510 1.92378 -118.78959 478.88529
7920.0000 -121.80098 -118.96576 2.83521 1.92403 -118.78619 488.51960
7925.0000 -121.75516 -118.97951 2.77565 1.89820 -119.13213 459.45530
7930.0000 -122.34180 -119.42600 2.91580 1.89701 -119.14800 459.70322
7935.0000 -122.17678 -119.49683 2.67995 1.86195 -119.61746 429.78471
7940.0000 -122.41587 -120.08597 2.32991 1.83456 -119.98431 401.41500
7945.0000 -122.57013 -119.67144 2.89869 1.84878 -119.79394 416.99273
7950.0000 -122.44475 -119.38979 3.05495 1.85833 -119.66599 416.93247
7955.0000 -121.98949 -119.67596 2.31353 1.84054 -119.90425 399.42263
7960.0000 -121.82407 -118.87429 2.94978 1.87205 -119.48227 440.29861
7965.0000 -122.27169 -119.86334 2.40835 1.86919 -119.52053 425.52931
7970.0000 -122.18962 -119.21123 2.97839 1.84989 -119.77905 410.58073
7975.0000 -122.06784 -118.88404 3.18380 1.88279 -119.33850 447.11786
7980.0000 -122.04928 -119.58044 2.46884 1.88498 -119.30915 435.13128
7985.0000 -121.85129 -118.35693 3.49436 1.92713 -118.74470 511.83108
7990.0000 -122.03626 -118.33823 3.69803 1.92624 -118.75662 515.40037
7995.0000 -122.04075 -119.04305 2.99770 1.97175 -118.14729 535.35080
8000.0000 -122.77756 -119.91804 2.85952 1.89541 -119.16943 485.36699
FREEZING PROCESS: loop number 33 T-loop= 417.00000000000000
main_MD> interactions number 33 at Temperature= 417.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.52959 -0.50251 1.48240
force_rgl> df(natom) -0.66804 -0.21639 0.82851
8005.0000 -122.52982 -119.89295 2.63687 1.83988 -119.91305 441.31382
8010.0000 -122.75023 -119.84883 2.90141 1.85096 -119.76463 453.38884
8015.0000 -122.96779 -119.90408 3.06372 1.84226 -119.88120 445.75283
8020.0000 -122.33802 -119.29424 3.04378 1.85439 -119.71880 455.43552
8025.0000 -122.77067 -119.69226 3.07841 1.86260 -119.60880 464.17635
8030.0000 -123.11111 -120.55910 2.55200 1.82880 -120.06148 431.56829
8035.0000 -122.81475 -120.87722 1.93753 1.78357 -120.66708 382.39448
8040.0000 -122.97677 -120.17872 2.79805 1.78641 -120.62910 389.95391
8045.0000 -122.80224 -120.45251 2.34972 1.80749 -120.34675 405.53845
8050.0000 -122.70675 -119.86040 2.84635 1.80717 -120.35111 410.45077
8055.0000 -123.38372 -120.76296 2.62076 1.79108 -120.56647 395.67016
8060.0000 -122.88983 -120.44053 2.44930 1.76018 -120.98026 363.10052
8065.0000 -122.88582 -119.62507 3.26075 1.83355 -119.99778 436.54785
8070.0000 -122.76889 -119.95384 2.81505 1.85781 -119.67291 451.49957
8075.0000 -122.75015 -120.05757 2.69258 1.82736 -120.08068 426.77579
8080.0000 -123.04892 -120.26615 2.78277 1.80411 -120.39201 401.36049
8085.0000 -122.89458 -120.28674 2.60784 1.82336 -120.13424 424.01051
8090.0000 -122.97590 -120.40772 2.56817 1.82174 -120.15589 431.01076
8095.0000 -123.59281 -121.28769 2.30513 1.77907 -120.72740 378.86474
8100.0000 -123.55575 -121.27653 2.27921 1.75524 -121.04649 365.66325
8105.0000 -123.25124 -120.72207 2.52917 1.76377 -120.93223 373.07423
8110.0000 -122.92523 -120.61406 2.31116 1.82222 -120.14956 426.34836
8115.0000 -123.05354 -120.48462 2.56891 1.79205 -120.55354 399.77075
8120.0000 -123.01860 -120.51713 2.50147 1.78771 -120.61158 388.32161
8125.0000 -122.90589 -120.33061 2.57528 1.80415 -120.39144 406.75812
8130.0000 -123.37417 -120.64598 2.72819 1.80292 -120.40792 414.07790
8135.0000 -122.89664 -120.29121 2.60543 1.80690 -120.35461 408.84980
8140.0000 -122.80480 -119.88534 2.91946 1.83376 -119.99500 431.76672
8145.0000 -123.55587 -121.10390 2.45197 1.80270 -120.41089 403.99825
8150.0000 -122.74839 -120.54853 2.19986 1.76574 -120.90578 372.97869
8155.0000 -123.12801 -120.99650 2.13151 1.77977 -120.71791 383.82919
8160.0000 -123.11844 -119.98069 3.13775 1.81158 -120.29201 409.91726
8165.0000 -122.97016 -120.32509 2.64508 1.83069 -120.03614 433.49660
8170.0000 -123.01676 -120.86256 2.15420 1.78726 -120.61766 389.38871
8175.0000 -122.53967 -120.12565 2.41402 1.78983 -120.58323 392.97904
8180.0000 -122.54267 -120.10895 2.43371 1.86183 -119.61914 460.83621
8185.0000 -122.61865 -120.33665 2.28200 1.78834 -120.60317 387.81957
8190.0000 -123.50370 -121.09699 2.40671 1.78900 -120.59435 395.21357
8195.0000 -123.06608 -120.28154 2.78454 1.79345 -120.53473 394.44695
8200.0000 -123.46630 -120.92091 2.54538 1.77317 -120.80628 379.91875
8205.0000 -122.77201 -120.17512 2.59689 1.79053 -120.57389 391.51410
8210.0000 -122.31862 -119.36074 2.95787 1.86823 -119.53343 458.86699
8215.0000 -122.91967 -120.48539 2.43429 1.84396 -119.85840 443.31928
8220.0000 -122.87875 -119.91563 2.96312 1.82334 -120.13458 429.53723
8225.0000 -122.77629 -119.73767 3.03862 1.84878 -119.79385 445.87814
8230.0000 -122.31977 -119.39223 2.92754 1.88503 -119.30852 466.35291
8235.0000 -122.82785 -119.87444 2.95341 1.84993 -119.77848 448.34526
8240.0000 -122.95127 -119.78700 3.16426 1.82959 -120.05090 433.92433
8245.0000 -123.08103 -120.01479 3.06624 1.82934 -120.05415 430.07878
8250.0000 -123.16704 -120.51362 2.65342 1.79816 -120.47174 394.13269
FREEZING PROCESS: loop number 34 T-loop= 392.00000000000000
main_MD> interactions number 34 at Temperature= 392.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.39283 -3.12288 1.73465
force_rgl> df(natom) -1.62662 -1.77699 2.29302
8255.0000 -123.26152 -120.82657 2.43495 1.78706 -120.62033 387.00024
8260.0000 -123.08815 -120.54066 2.54748 1.78245 -120.68212 388.37007
8265.0000 -123.16132 -120.54758 2.61374 1.79271 -120.54475 394.77772
8270.0000 -123.20278 -120.79897 2.40380 1.78565 -120.63921 388.83640
8275.0000 -123.11719 -120.93645 2.18074 1.78492 -120.64900 387.07942
8280.0000 -123.43084 -120.89532 2.53552 1.74465 -121.18818 349.39037
8285.0000 -122.84282 -120.30836 2.53446 1.76481 -120.91825 366.72077
8290.0000 -122.75999 -120.22458 2.53540 1.80477 -120.38322 408.00930
8295.0000 -122.60216 -120.35921 2.24295 1.80564 -120.37159 408.20361
8300.0000 -123.46428 -120.99456 2.46973 1.79459 -120.51953 394.87873
8305.0000 -123.15768 -120.75337 2.40431 1.74984 -121.11874 354.19699
8310.0000 -122.72572 -120.32168 2.40404 1.79641 -120.49515 400.51804
8315.0000 -122.56805 -120.33601 2.23204 1.80743 -120.34755 413.19474
8320.0000 -123.15602 -120.38624 2.76978 1.81379 -120.26241 408.88970
8325.0000 -123.00268 -120.00473 2.99795 1.81712 -120.21782 425.37078
8330.0000 -123.08479 -120.27794 2.80685 1.81081 -120.30230 411.25679
8335.0000 -122.65050 -120.40176 2.24874 1.81336 -120.26815 419.11934
8340.0000 -123.21119 -120.65119 2.55999 1.79469 -120.51811 396.37513
8345.0000 -123.03809 -120.13108 2.90701 1.80860 -120.33189 405.28275
8350.0000 -123.26618 -120.83074 2.43544 1.78680 -120.62388 389.43863
8355.0000 -123.03795 -120.71217 2.32577 1.74791 -121.14454 354.26254
8360.0000 -123.72628 -120.78892 2.93737 1.76759 -120.88107 378.94398
8365.0000 -122.71735 -120.29999 2.41736 1.77948 -120.72182 386.30656
8370.0000 -122.87028 -120.16400 2.70628 1.81579 -120.23558 415.13670
8375.0000 -123.17167 -120.73221 2.43946 1.81173 -120.28994 407.67130
8380.0000 -123.07335 -120.73539 2.33796 1.78111 -120.70003 377.60814
8385.0000 -123.04131 -120.98338 2.05793 1.78892 -120.59544 398.41612
8390.0000 -123.73276 -121.69926 2.03350 1.72317 -121.47587 331.16212
8395.0000 -123.60373 -121.25252 2.35121 1.72182 -121.49397 328.56297
8400.0000 -123.06369 -120.80089 2.26279 1.75524 -121.04637 356.96613
8405.0000 -123.25860 -120.53899 2.71962 1.78869 -120.59855 383.77346
8410.0000 -123.48967 -121.05454 2.43513 1.78695 -120.62181 389.15115
8415.0000 -122.93566 -120.01827 2.91739 1.78726 -120.61762 391.34158
8420.0000 -123.06929 -120.15862 2.91067 1.79978 -120.44999 405.75894
8425.0000 -122.94046 -120.61685 2.32361 1.81163 -120.29136 407.06266
8430.0000 -123.08605 -120.61614 2.46991 1.79580 -120.50329 401.99045
8435.0000 -122.99451 -120.85684 2.13767 1.76524 -120.91247 368.79882
8440.0000 -123.06557 -120.48279 2.58278 1.77514 -120.77998 377.44369
8445.0000 -123.20660 -121.20793 1.99867 1.76693 -120.88988 369.07447
8450.0000 -123.48346 -120.90075 2.58271 1.77613 -120.76676 375.20140
8455.0000 -123.66635 -121.69237 1.97397 1.72435 -121.46001 329.73814
8460.0000 -123.55754 -121.00435 2.55319 1.73111 -121.36956 339.03828
8465.0000 -122.95741 -121.11816 1.83925 1.78620 -120.63189 389.51003
8470.0000 -123.11941 -120.45172 2.66769 1.77883 -120.73050 382.71984
8475.0000 -122.94321 -120.53481 2.40840 1.80372 -120.39723 407.80132
8480.0000 -123.17632 -120.82647 2.34986 1.78279 -120.67754 386.39618
8485.0000 -123.36811 -120.82499 2.54312 1.76635 -120.89765 371.79602
8490.0000 -122.73795 -119.95855 2.77940 1.81289 -120.27446 416.14251
8495.0000 -123.20518 -120.62378 2.58140 1.79113 -120.56585 390.75192
8500.0000 -122.91902 -120.38873 2.53029 1.81148 -120.29340 420.87964
FREEZING PROCESS: loop number 35 T-loop= 367.00000000000000
main_MD> interactions number 35 at Temperature= 367.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.08437 -1.55388 -0.09659
force_rgl> df(natom) 0.98421 -2.26425 -0.14323
8505.0000 -123.02374 -120.45937 2.56437 1.79685 -120.48920 397.85951
8510.0000 -122.83986 -120.64327 2.19660 1.79212 -120.55252 392.20634
8515.0000 -123.05698 -120.93897 2.11800 1.76554 -120.90851 370.83873
8520.0000 -122.95184 -120.52423 2.42762 1.77452 -120.78829 373.79483
8525.0000 -123.01956 -120.52787 2.49169 1.76313 -120.94074 371.92919
8530.0000 -123.13433 -120.58467 2.54966 1.77746 -120.74889 379.60338
8535.0000 -123.55899 -121.02537 2.53362 1.75977 -120.98573 364.88771
8540.0000 -123.09995 -120.92134 2.17861 1.76322 -120.93959 371.89425
8545.0000 -123.00462 -120.79856 2.20606 1.76454 -120.92193 368.07354
8550.0000 -123.53979 -121.40859 2.13120 1.75359 -121.06847 361.45684
8555.0000 -123.69517 -121.48900 2.20617 1.70298 -121.74623 310.52644
8560.0000 -123.17197 -120.89112 2.28085 1.72995 -121.38508 330.34212
8565.0000 -123.46288 -121.35817 2.10470 1.76194 -120.95678 366.37672
8570.0000 -123.47034 -121.09843 2.37192 1.73713 -121.28893 338.92510
8575.0000 -122.98558 -120.65348 2.33211 1.77321 -120.80585 374.73132
8580.0000 -123.08038 -120.72208 2.35830 1.78630 -120.63051 386.63334
8585.0000 -123.54248 -121.42244 2.12004 1.75170 -121.09379 359.31668
8590.0000 -123.24955 -120.74127 2.50827 1.75796 -121.00994 353.46303
8595.0000 -123.48311 -121.17814 2.30497 1.77460 -120.78716 378.32814
8600.0000 -123.64483 -121.07978 2.56505 1.76523 -120.91260 368.58940
8605.0000 -123.45417 -121.35325 2.10092 1.72793 -121.41215 333.07156
8610.0000 -123.40272 -121.19331 2.20941 1.72584 -121.44008 331.60727
8615.0000 -123.49993 -120.96809 2.53184 1.74131 -121.23297 346.95756
8620.0000 -123.60024 -120.64933 2.95091 1.77076 -120.83861 372.47406
8625.0000 -123.14039 -120.68952 2.45087 1.80127 -120.43004 398.08032
8630.0000 -123.70514 -121.52071 2.18444 1.76237 -120.95096 363.98916
8635.0000 -123.16832 -120.99307 2.17526 1.72611 -121.43655 330.57405
8640.0000 -123.68392 -121.84585 1.83806 1.74091 -121.23836 346.97718
8645.0000 -123.32338 -120.94217 2.38121 1.73088 -121.37257 340.40848
8650.0000 -122.96445 -120.94704 2.01742 1.75306 -121.07567 355.73519
8655.0000 -123.65124 -121.40582 2.24542 1.73499 -121.31755 341.77495
8660.0000 -123.25315 -121.25194 2.00120 1.73567 -121.30841 338.21739
8665.0000 -123.50614 -121.05463 2.45151 1.75568 -121.04054 361.00739
8670.0000 -123.27191 -120.80932 2.46259 1.75857 -121.00187 364.94981
8675.0000 -123.21976 -120.79338 2.42638 1.77511 -120.78042 379.70783
8680.0000 -122.66577 -120.43996 2.22581 1.76160 -120.96125 361.40665
8685.0000 -123.14108 -121.20674 1.93434 1.78983 -120.58326 388.67315
8690.0000 -123.64831 -121.26094 2.38738 1.73873 -121.26751 341.46519
8695.0000 -123.68095 -121.50894 2.17200 1.74237 -121.21877 344.74132
8700.0000 -122.42219 -120.56143 1.86076 1.75701 -121.02274 364.16647
8705.0000 -123.45655 -121.24126 2.21529 1.78837 -120.60286 395.29000
8710.0000 -123.18275 -120.73018 2.45257 1.75655 -121.02889 359.63055
8715.0000 -123.39399 -121.13398 2.26001 1.77380 -120.79790 381.61298
8720.0000 -123.42685 -121.13671 2.29014 1.75097 -121.10365 356.01673
8725.0000 -123.40002 -121.61017 1.78985 1.72538 -121.44630 331.87554
8730.0000 -123.17044 -120.49410 2.67634 1.74381 -121.19954 348.06096
8735.0000 -122.89249 -120.94754 1.94495 1.77486 -120.78366 373.12645
8740.0000 -122.98011 -120.58231 2.39780 1.76625 -120.89899 374.58740
8745.0000 -123.25727 -120.99497 2.26230 1.77796 -120.74225 383.60407
8750.0000 -122.79953 -120.71901 2.08052 1.78623 -120.63144 389.86753
FREEZING PROCESS: loop number 36 T-loop= 342.00000000000000
main_MD> interactions number 36 at Temperature= 342.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.04990 0.92758 1.49114
force_rgl> df(natom) -0.48315 -1.15329 -0.99475
8755.0000 -123.34192 -121.14806 2.19386 1.75235 -121.08508 352.58462
8760.0000 -123.51275 -121.06271 2.45004 1.74931 -121.12589 353.88724
8765.0000 -123.48845 -121.31981 2.16865 1.73115 -121.36905 343.18873
8770.0000 -123.43788 -121.26294 2.17494 1.73797 -121.27767 343.21362
8775.0000 -123.21801 -120.49809 2.71992 1.75838 -121.00434 365.38144
8780.0000 -123.32713 -120.91879 2.40834 1.75819 -121.00688 366.11484
8785.0000 -123.31100 -120.81416 2.49684 1.75567 -121.04070 359.65071
8790.0000 -123.56743 -121.62837 1.93906 1.75014 -121.11476 357.05951
8795.0000 -123.62227 -121.36015 2.26213 1.71919 -121.52916 325.35941
8800.0000 -123.42529 -121.37171 2.05358 1.72133 -121.50052 325.08688
8805.0000 -123.52434 -121.25069 2.27365 1.74512 -121.18199 344.94146
8810.0000 -123.14959 -121.14802 2.00157 1.74279 -121.21318 347.56723
8815.0000 -123.33200 -120.86339 2.46861 1.75898 -120.99637 367.93614
8820.0000 -123.96293 -121.76199 2.20094 1.74341 -121.20483 349.90005
8825.0000 -123.45353 -121.61506 1.83846 1.72423 -121.46172 330.07912
8830.0000 -123.49199 -121.30881 2.18318 1.72242 -121.48584 327.60101
8835.0000 -123.24703 -121.26772 1.97931 1.73760 -121.28257 343.75017
8840.0000 -123.72733 -121.40162 2.32571 1.73646 -121.29785 348.70800
8845.0000 -123.77644 -121.42805 2.34838 1.74458 -121.18911 353.71879
8850.0000 -123.12409 -121.16065 1.96344 1.74187 -121.22552 348.42225
8855.0000 -123.49205 -121.59217 1.89988 1.71820 -121.54236 323.30042
8860.0000 -123.38743 -121.44947 1.93796 1.70970 -121.65619 316.28616
8865.0000 -122.96460 -121.03736 1.92724 1.74122 -121.23423 341.03225
8870.0000 -123.33773 -121.18894 2.14879 1.74820 -121.14064 356.74527
8875.0000 -123.37253 -121.41275 1.95979 1.72862 -121.40287 330.92775
8880.0000 -122.97755 -120.71833 2.25922 1.78388 -120.66293 386.44858
8885.0000 -123.88783 -121.61474 2.27309 1.74716 -121.15462 352.07636
8890.0000 -123.61061 -121.39918 2.21143 1.72535 -121.44668 336.46707
8895.0000 -123.47544 -121.24124 2.23420 1.73803 -121.27686 343.31353
8900.0000 -122.36693 -120.46609 1.90085 1.74664 -121.16159 352.25859
8905.0000 -123.35522 -121.02420 2.33101 1.78072 -120.70520 384.38610
8910.0000 -123.21053 -121.06708 2.14345 1.75263 -121.08142 361.78717
8915.0000 -123.58931 -121.33364 2.25567 1.73517 -121.31519 343.30665
8920.0000 -123.64000 -121.84935 1.79065 1.71677 -121.56160 325.73294
8925.0000 -123.21644 -121.08632 2.13012 1.72791 -121.41241 336.90802
8930.0000 -123.12530 -120.91864 2.20666 1.77445 -120.78925 375.56052
8935.0000 -123.25351 -120.56839 2.68512 1.77951 -120.72148 382.85728
8940.0000 -122.96618 -120.52175 2.44443 1.77428 -120.79148 378.55074
8945.0000 -123.27483 -121.05635 2.21848 1.75927 -120.99244 366.88424
8950.0000 -123.46522 -121.54848 1.91674 1.74333 -121.20593 349.62487
8955.0000 -123.77008 -121.50563 2.26446 1.72977 -121.38753 338.95939
8960.0000 -123.27660 -121.39069 1.88591 1.73171 -121.36153 333.90219
8965.0000 -123.84397 -121.81902 2.02495 1.71460 -121.59058 319.71072
8970.0000 -123.70056 -120.87823 2.82234 1.72976 -121.38763 335.69160
8975.0000 -123.54594 -121.64835 1.89759 1.73682 -121.29306 338.47941
8980.0000 -123.26909 -121.42578 1.84330 1.72225 -121.48824 328.30818
8985.0000 -123.33415 -121.33790 1.99625 1.71374 -121.60216 318.44104
8990.0000 -123.74726 -121.60004 2.14722 1.72379 -121.46755 326.99112
8995.0000 -123.75744 -121.81217 1.94527 1.71293 -121.61303 316.43647
9000.0000 -123.80297 -121.62182 2.18115 1.69920 -121.79680 307.67981
FREEZING PROCESS: loop number 37 T-loop= 317.00000000000000
main_MD> interactions number 37 at Temperature= 317.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.49499 0.05372 0.99723
force_rgl> df(natom) 2.40074 0.91371 1.79567
9005.0000 -123.80493 -121.79139 2.01354 1.70452 -121.72559 308.86003
9010.0000 -123.65681 -121.84376 1.81305 1.66814 -122.21277 276.11108
9015.0000 -124.04782 -122.08525 1.96257 1.67914 -122.06544 286.62157
9020.0000 -123.61458 -121.77553 1.83905 1.69000 -121.92003 293.86171
9025.0000 -123.78955 -121.82129 1.96826 1.69808 -121.81180 302.59961
9030.0000 -123.73547 -121.74709 1.98837 1.70254 -121.75217 307.70775
9035.0000 -123.73223 -121.74708 1.98515 1.70509 -121.71796 305.75030
9040.0000 -123.76804 -121.80965 1.95839 1.68922 -121.93040 297.75199
9045.0000 -124.20550 -122.10381 2.10169 1.68428 -121.99663 289.44715
9050.0000 -123.65015 -121.93521 1.71494 1.68755 -121.95286 290.70655
9055.0000 -123.88295 -122.20890 1.67405 1.66726 -122.22453 271.86634
9060.0000 -123.63850 -121.23729 2.40121 1.70244 -121.75342 308.91299
9065.0000 -123.88247 -121.89485 1.98762 1.71969 -121.52246 324.90703
9070.0000 -123.36902 -121.56852 1.80051 1.69637 -121.83477 303.54039
9075.0000 -123.59374 -121.39445 2.19929 1.71807 -121.54419 325.24195
9080.0000 -123.45222 -121.61273 1.83949 1.71460 -121.59067 317.28934
9085.0000 -123.95350 -122.01529 1.93822 1.70320 -121.74332 306.63112
9090.0000 -123.91942 -121.67618 2.24324 1.70848 -121.67256 311.04070
9095.0000 -123.15747 -121.20145 1.95602 1.71651 -121.56505 322.75003
9100.0000 -123.28913 -121.22758 2.06155 1.73122 -121.36811 332.30262
9105.0000 -123.30987 -121.10830 2.20157 1.73306 -121.34337 338.17047
9110.0000 -123.94480 -121.83284 2.11196 1.71276 -121.61528 320.38766
9115.0000 -123.83317 -121.93059 1.90258 1.70093 -121.77360 306.97651
9120.0000 -123.72035 -121.46062 2.25973 1.69582 -121.84210 303.58656
9125.0000 -124.07883 -121.69122 2.38761 1.72355 -121.47076 327.14006
9130.0000 -123.64153 -121.78830 1.85322 1.70079 -121.77555 307.82952
9135.0000 -123.52853 -122.07370 1.45483 1.69457 -121.85883 300.03305
9140.0000 -123.60650 -121.66327 1.94323 1.69702 -121.82608 302.49154
9145.0000 -123.57606 -121.35881 2.21725 1.69725 -121.82288 300.09223
9150.0000 -123.84645 -121.89252 1.95394 1.72489 -121.45279 329.76749
9155.0000 -123.59704 -121.78299 1.81405 1.70194 -121.76019 309.49646
9160.0000 -123.44623 -121.74883 1.69740 1.69997 -121.78651 306.60503
9165.0000 -123.71232 -121.79240 1.91992 1.71550 -121.57851 322.51877
9170.0000 -123.99148 -122.35236 1.63911 1.68182 -122.02962 287.65879
9175.0000 -123.63111 -121.96731 1.66380 1.68757 -121.95257 295.99624
9180.0000 -124.15617 -122.42429 1.73188 1.69024 -121.91678 299.57256
9185.0000 -123.77797 -121.92683 1.85114 1.66499 -122.25491 270.39321
9190.0000 -123.80588 -122.08708 1.71880 1.67162 -122.16620 278.80794
9195.0000 -123.36804 -121.58347 1.78456 1.71459 -121.59080 318.73669
9200.0000 -123.20907 -121.52628 1.68279 1.70414 -121.73065 308.74057
9205.0000 -123.56499 -121.52815 2.03684 1.72384 -121.46685 325.76810
9210.0000 -123.78346 -121.80448 1.97899 1.68893 -121.93430 292.51589
9215.0000 -123.73290 -121.86087 1.87203 1.68936 -121.92866 297.02227
9220.0000 -123.96173 -122.44345 1.51828 1.67957 -122.05973 285.37144
9225.0000 -123.96476 -121.89856 2.06620 1.67841 -122.07523 283.13546
9230.0000 -123.83794 -121.90571 1.93223 1.69264 -121.88473 297.46952
9235.0000 -123.94236 -122.17644 1.76593 1.68593 -121.97449 290.43679
9240.0000 -123.80477 -121.70254 2.10222 1.67745 -122.08804 281.71856
9245.0000 -123.53320 -121.57516 1.95804 1.69686 -121.82815 300.68908
9250.0000 -123.40999 -121.04519 2.36480 1.72355 -121.47072 337.13736
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 9 [min], 26.3795738 [s].
main_MD> Deallocating global variables
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