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nanoparticlesims/growth_Melting_Silver_ICO_4091/freezeSims/run_63/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_63.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 = 63 ntipo2 = 0
read_input> Finish reading input
main_MD> Allocating global variables
main_MD> Number of outputs that will be created: 1600
main_MD> Size of nv and nvoiz: 63 6300
main_MD> Size of nv and nvoiz: 63 6300
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 = 63
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> 0.18270983010447647 2.3051106185324639E-002 -9.3576462265858251E-002 initial drift of cluster / NP1 for coalescence
init> 0.31690597467294362 0.32984544399355981 0.26359696641281699 scaling for velocity /for coalescence NP1
init.f90 > facguy = 3.5722054089766505E-003
preparo> IN BIGVOI : LIMIT 1.2247448652052084 1.2247448652052084 1.2247448652052084
preparo> END t=0 TIME STEP
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.72215 -0.23351 -0.82384
force_rgl> df(natom) 2.66452 -1.71978 1.01248
preparo> THERMALIZATION PROCESS AT 1112.6025415511751
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -136.83877103416137 9.2041625853600895 -146.04293361952145 6.5860218904341167E-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 32
FREEZING PROCESS: loop number 1 T-loop= 1082.0000000000000
main_MD> interactions number 1 at Temperature= 1082.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.42807 -0.10357 0.07907
force_rgl> df(natom) 1.07121 1.43444 2.85558
5.0000 -148.48029 -138.97184 9.50845 3.03189 -137.84646 1175.60799
10.0000 -147.69732 -138.81153 8.88579 2.94021 -139.29794 1122.59985
15.0000 -147.02481 -137.81062 9.21420 3.00762 -138.23061 1154.61478
20.0000 -147.95769 -138.36845 9.58924 3.06011 -137.39957 1240.32760
25.0000 -149.04028 -139.45007 9.59021 2.95050 -139.13503 1094.37486
30.0000 -147.43204 -139.20535 8.22669 2.97792 -138.70093 1127.13512
35.0000 -149.70349 -140.10766 9.59583 2.91512 -139.69521 1091.68309
40.0000 -147.38179 -138.00512 9.37667 2.98333 -138.61532 1121.14266
45.0000 -147.89105 -139.51629 8.37476 2.99324 -138.45832 1176.79179
50.0000 -149.39393 -141.67657 7.71736 2.84046 -140.87730 1072.69975
55.0000 -147.71316 -138.93963 8.77353 2.85645 -140.62407 1087.60897
60.0000 -147.22851 -139.49379 7.73472 2.96720 -138.87061 1154.41143
65.0000 -146.65353 -137.79411 8.85943 2.99029 -138.50498 1111.83333
70.0000 -149.66973 -141.39556 8.27417 2.93583 -139.36733 1129.22622
75.0000 -148.46159 -140.08885 8.37275 2.85205 -140.69377 1079.82104
80.0000 -148.73899 -140.47388 8.26511 2.86187 -140.53833 1085.63984
85.0000 -150.20044 -141.36119 8.83925 2.90957 -139.78310 1106.22948
90.0000 -148.93349 -139.35654 9.57695 2.91011 -139.77451 1116.65277
95.0000 -149.92672 -141.08243 8.84429 2.87068 -140.39881 1088.12542
100.0000 -148.76947 -138.68515 10.08433 2.99421 -138.44292 1148.22858
105.0000 -146.72942 -136.93667 9.79275 2.97965 -138.67345 1133.99081
110.0000 -150.39660 -140.65861 9.73799 2.98946 -138.51820 1162.12589
115.0000 -148.63864 -140.53655 8.10209 2.87360 -140.35258 1047.10541
120.0000 -149.45860 -140.26326 9.19534 2.87221 -140.37460 1085.86730
125.0000 -149.59475 -140.67621 8.91854 2.82569 -141.11118 1041.73091
130.0000 -148.05639 -138.85546 9.20093 2.92224 -139.58243 1096.75706
135.0000 -147.92409 -139.83870 8.08538 2.89911 -139.94871 1111.45533
140.0000 -149.60006 -141.48568 8.11438 2.87128 -140.38930 1053.72048
145.0000 -149.18666 -140.79081 8.39585 2.84623 -140.78586 1014.88184
150.0000 -147.90413 -138.14385 9.76027 2.94486 -139.22433 1072.93348
155.0000 -149.61482 -141.14680 8.46802 2.98422 -138.60122 1137.43740
160.0000 -147.46823 -138.97385 8.49439 2.86904 -140.42473 1085.77204
165.0000 -148.84789 -139.34111 9.50678 2.96378 -138.92483 1158.99470
170.0000 -148.64767 -139.48310 9.16456 2.93504 -139.37989 1119.77794
175.0000 -148.03778 -139.24397 8.79382 2.87803 -140.28241 1062.88944
180.0000 -148.15932 -139.26432 8.89500 2.97194 -138.79566 1144.52819
185.0000 -149.84895 -141.00302 8.84593 2.93927 -139.31286 1121.84022
190.0000 -149.04428 -140.10710 8.93717 2.88394 -140.18893 1111.38905
195.0000 -148.13431 -139.10879 9.02552 2.91476 -139.70090 1081.66108
200.0000 -148.05877 -140.84723 7.21154 2.93816 -139.33035 1109.78083
205.0000 -148.64271 -138.10680 10.53591 2.92861 -139.48163 1111.03439
210.0000 -148.14765 -138.34109 9.80657 3.00153 -138.32708 1173.67070
215.0000 -149.91489 -140.99196 8.92293 2.90599 -139.83980 1066.49020
220.0000 -148.77952 -140.81539 7.96413 2.83503 -140.96325 1071.21457
225.0000 -148.92711 -140.02282 8.90429 2.83223 -141.00757 1052.33482
230.0000 -148.76657 -138.60506 10.16151 2.91449 -139.70521 1097.91544
235.0000 -148.54127 -141.28737 7.25390 2.87206 -140.37696 1111.14367
240.0000 -149.89700 -142.57926 7.31775 2.77359 -141.93609 971.25206
245.0000 -150.78889 -142.40992 8.37897 2.78522 -141.75188 1000.01234
250.0000 -150.40514 -141.79368 8.61146 2.81069 -141.34861 1047.15927
FREEZING PROCESS: loop number 2 T-loop= 1057.0000000000000
main_MD> interactions number 2 at Temperature= 1057.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.73878 -3.65793 3.88308
force_rgl> df(natom) 0.36748 -1.69070 -0.05544
255.0000 -152.00282 -143.74853 8.25429 2.73817 -142.49686 989.92050
260.0000 -148.64962 -140.89072 7.75890 2.74372 -142.40897 975.09308
265.0000 -150.25385 -142.80879 7.44506 2.78618 -141.73666 986.95212
270.0000 -147.54919 -139.69670 7.85249 2.85862 -140.58969 1089.73065
275.0000 -147.53809 -138.25847 9.27963 2.98962 -138.51558 1159.50903
280.0000 -148.38461 -139.14819 9.23642 3.00608 -138.25510 1154.79038
285.0000 -149.10638 -142.24420 6.86217 2.87979 -140.25463 1063.01539
290.0000 -150.05519 -141.41338 8.64182 2.84197 -140.85339 1019.50993
295.0000 -148.65697 -139.92611 8.73086 2.88709 -140.13902 1070.39250
300.0000 -149.22762 -138.26398 10.96364 2.92145 -139.59496 1124.45792
305.0000 -147.55863 -137.77307 9.78557 2.98975 -138.51356 1152.87725
310.0000 -147.88553 -139.12371 8.76182 3.00027 -138.34706 1159.81302
315.0000 -149.15175 -139.14810 10.00365 2.94854 -139.16608 1075.05974
320.0000 -147.29389 -138.32604 8.96785 2.96989 -138.82809 1140.69739
325.0000 -147.57916 -138.97101 8.60815 3.01108 -138.17587 1153.81924
330.0000 -149.19481 -139.75584 9.43897 2.92432 -139.54948 1133.14163
335.0000 -149.79196 -140.84988 8.94208 2.82846 -141.06732 1035.44864
340.0000 -150.03476 -141.70752 8.32724 2.76869 -142.01364 987.95255
345.0000 -150.11470 -141.10981 9.00489 2.82362 -141.14388 1049.39501
350.0000 -150.71296 -142.28000 8.43295 2.83848 -140.90868 1036.77730
355.0000 -149.25334 -140.33407 8.91928 2.80427 -141.45028 997.32923
360.0000 -150.80400 -141.36444 9.43956 2.82201 -141.16949 1031.78969
365.0000 -148.71390 -139.87570 8.83820 2.84307 -140.83600 1056.05905
370.0000 -150.23885 -140.97892 9.25993 2.91568 -139.68630 1112.95889
375.0000 -149.46404 -140.28681 9.17723 2.80692 -141.40829 1040.76889
380.0000 -150.05497 -141.30797 8.74700 2.90528 -139.85094 1120.64821
385.0000 -149.48694 -142.23513 7.25181 2.77539 -141.90760 1003.36547
390.0000 -150.97653 -141.27204 9.70449 2.77745 -141.87485 1011.35984
395.0000 -150.38392 -141.67288 8.71103 2.80305 -141.46967 1029.75956
400.0000 -149.51277 -139.09278 10.41999 2.88124 -140.23166 1089.10102
405.0000 -148.53220 -138.72082 9.81138 2.96425 -138.91739 1162.25028
410.0000 -148.81421 -140.41183 8.40238 2.92652 -139.51476 1099.42183
415.0000 -148.61488 -140.86940 7.74548 2.81840 -141.22664 1009.40326
420.0000 -149.82188 -140.56140 9.26049 2.86190 -140.53791 1049.39584
425.0000 -147.04221 -138.06557 8.97664 2.90045 -139.92752 1075.68837
430.0000 -147.37312 -138.11194 9.26118 3.07057 -137.23393 1230.85116
435.0000 -147.67168 -140.07706 7.59463 2.98104 -138.65153 1120.87903
440.0000 -147.54397 -139.87369 7.67029 2.88627 -140.15191 1089.91794
445.0000 -148.62896 -139.36189 9.26707 2.90955 -139.78339 1075.00132
450.0000 -150.06138 -139.65842 10.40295 2.87022 -140.40614 1085.31114
455.0000 -150.90835 -142.24206 8.66629 2.81557 -141.27140 1079.38769
460.0000 -150.24353 -141.85789 8.38564 2.78053 -141.82616 1010.38953
465.0000 -150.03833 -141.85928 8.17906 2.85657 -140.62217 1049.21241
470.0000 -148.11958 -139.83193 8.28766 2.88380 -140.19113 1084.08961
475.0000 -147.67181 -138.51902 9.15279 2.96515 -138.90310 1111.99498
480.0000 -149.47518 -140.20751 9.26767 2.97733 -138.71020 1192.72786
485.0000 -150.08451 -141.37893 8.70558 2.89828 -139.96180 1096.01486
490.0000 -148.83524 -140.58077 8.25447 2.81715 -141.24632 1012.96567
495.0000 -151.48392 -143.36699 8.11693 2.78582 -141.74240 999.85467
500.0000 -151.29242 -141.24258 10.04984 2.66393 -143.67222 930.64483
FREEZING PROCESS: loop number 3 T-loop= 1032.0000000000000
main_MD> interactions number 3 at Temperature= 1032.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.04752 0.36369 -1.48156
force_rgl> df(natom) 2.35620 -2.64659 1.14578
505.0000 -150.22611 -141.96736 8.25875 2.85950 -140.57587 1040.78048
510.0000 -150.21707 -141.35172 8.86535 2.81121 -141.34042 1072.63672
515.0000 -149.23042 -140.01320 9.21723 2.89811 -139.96447 1084.44037
520.0000 -149.38847 -140.24416 9.14431 2.86276 -140.52420 1092.62311
525.0000 -147.03360 -139.52818 7.50542 2.89436 -140.02384 1059.05022
530.0000 -149.49188 -141.20521 8.28667 2.84051 -140.87651 1036.65635
535.0000 -149.65275 -140.93343 8.71932 2.89016 -140.09034 1093.49412
540.0000 -149.66366 -140.25690 9.40676 2.83268 -141.00040 1044.75631
545.0000 -150.71406 -141.63037 9.08369 2.87558 -140.32124 1065.90756
550.0000 -149.14853 -140.67891 8.46963 2.81774 -141.23707 1039.04942
555.0000 -149.18441 -141.69644 7.48796 2.83559 -140.95442 1059.80877
560.0000 -149.04811 -141.28367 7.76444 2.79154 -141.65177 1029.34236
565.0000 -150.53258 -143.00128 7.53130 2.75985 -142.15351 990.64517
570.0000 -149.67145 -141.02812 8.64333 2.76766 -142.02985 1003.96753
575.0000 -149.33945 -142.02180 7.31765 2.81554 -141.27188 1022.76202
580.0000 -150.06886 -141.37998 8.68889 2.80520 -141.43560 1015.19194
585.0000 -149.26378 -140.82557 8.43822 2.83742 -140.92542 1059.12566
590.0000 -148.76923 -140.47738 8.29185 2.89623 -139.99433 1097.73645
595.0000 -149.48815 -141.60717 7.88098 2.81682 -141.25162 1053.81265
600.0000 -150.06390 -140.16688 9.89702 2.86087 -140.55409 1090.54957
605.0000 -148.85368 -140.54195 8.31173 2.88782 -140.12737 1097.94250
610.0000 -150.88796 -141.24929 9.63867 2.88138 -140.22946 1017.21437
615.0000 -150.13351 -141.98044 8.15306 2.81876 -141.22080 1060.53906
620.0000 -150.16212 -141.27829 8.88382 2.75455 -142.23749 942.23116
625.0000 -150.35529 -141.87861 8.47667 2.77311 -141.94370 998.46804
630.0000 -149.40004 -140.69159 8.70846 2.80681 -141.41002 992.63254
635.0000 -148.82981 -140.65218 8.17763 2.90164 -139.90866 1086.55270
640.0000 -150.13701 -142.60067 7.53634 2.77646 -141.89065 971.60543
645.0000 -150.49788 -142.49884 7.99904 2.78907 -141.69089 1019.17036
650.0000 -150.87047 -144.14732 6.72315 2.67406 -143.51189 952.90161
655.0000 -149.47451 -141.52909 7.94542 2.73261 -142.58481 980.99215
660.0000 -149.74521 -140.59861 9.14660 2.80988 -141.36154 1049.67897
665.0000 -148.47845 -140.43539 8.04306 2.82038 -141.19526 1009.12731
670.0000 -148.94717 -138.94692 10.00024 2.89433 -140.02440 1074.64833
675.0000 -147.52725 -138.29755 9.22969 2.94977 -139.14655 1137.41612
680.0000 -148.15245 -139.41056 8.74189 2.94681 -139.19343 1126.59255
685.0000 -148.98622 -139.18241 9.80381 2.92980 -139.46271 1107.30542
690.0000 -149.49718 -141.71801 7.77917 2.82882 -141.06160 1023.17378
695.0000 -151.19729 -139.90163 11.29566 2.85853 -140.59113 1084.57102
700.0000 -147.67598 -140.70585 6.97012 2.85761 -140.60580 1029.53998
705.0000 -150.57187 -142.76602 7.80585 2.82326 -141.14956 1029.01554
710.0000 -150.89074 -142.41115 8.47959 2.72581 -142.69257 992.38273
715.0000 -150.14560 -142.26432 7.88129 2.73157 -142.60140 961.93506
720.0000 -150.92828 -142.66697 8.26131 2.75963 -142.15699 968.35083
725.0000 -148.15665 -140.28058 7.87607 2.83988 -140.88644 1044.42260
730.0000 -148.48951 -140.61444 7.87507 2.85415 -140.66055 1041.95305
735.0000 -149.04115 -139.75684 9.28431 2.86772 -140.44570 1079.99732
740.0000 -149.50425 -138.62132 10.88293 2.94900 -139.15881 1149.97740
745.0000 -149.18763 -140.47999 8.70763 2.87721 -140.29538 1068.75375
750.0000 -151.43010 -141.82709 9.60301 2.83055 -141.03426 1053.49739
FREEZING PROCESS: loop number 4 T-loop= 1007.0000000000000
main_MD> interactions number 4 at Temperature= 1007.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.88387 3.89763 -2.68565
force_rgl> df(natom) -0.73232 3.07603 -2.90893
755.0000 -149.94705 -141.61552 8.33153 2.78230 -141.79820 1030.18476
760.0000 -150.63730 -142.70707 7.93023 2.72966 -142.63158 987.81740
765.0000 -148.54817 -141.12404 7.42412 2.76589 -142.05798 985.66681
770.0000 -150.52722 -142.78412 7.74310 2.70909 -142.95730 966.67661
775.0000 -150.29679 -142.27450 8.02229 2.70805 -142.97379 984.06569
780.0000 -150.22361 -142.21252 8.01109 2.76185 -142.12185 1010.10618
785.0000 -151.23863 -143.07610 8.16253 2.75845 -142.17578 1015.96418
790.0000 -151.08503 -143.47379 7.61124 2.71380 -142.88270 985.17914
795.0000 -146.78990 -139.19587 7.59403 2.84010 -140.88305 1042.88292
800.0000 -150.22362 -141.91243 8.31119 2.80605 -141.42217 975.51476
805.0000 -150.68187 -141.62724 9.05463 2.75383 -142.24882 999.03483
810.0000 -150.66853 -141.13161 9.53692 2.82314 -141.15151 1050.45970
815.0000 -150.22143 -141.75802 8.46341 2.79472 -141.60146 992.70459
820.0000 -149.83025 -140.27748 9.55277 2.82457 -141.12894 1026.22970
825.0000 -150.49036 -142.97484 7.51552 2.79502 -141.59680 1009.83844
830.0000 -152.86655 -142.50898 10.35757 2.71314 -142.89311 998.11049
835.0000 -150.68714 -141.85324 8.83390 2.69739 -143.14257 950.57343
840.0000 -149.58436 -141.01507 8.56929 2.78786 -141.71003 1014.58581
845.0000 -151.79966 -143.92336 7.87630 2.73226 -142.59046 963.11914
850.0000 -148.62132 -140.83459 7.78673 2.78036 -141.82888 1002.56364
855.0000 -150.32020 -143.27635 7.04385 2.73516 -142.54444 981.38338
860.0000 -150.95312 -143.83206 7.12106 2.69932 -143.11195 952.63222
865.0000 -152.86961 -144.80488 8.06473 2.66073 -143.72297 926.65717
870.0000 -151.79457 -144.38222 7.41235 2.62386 -144.30675 915.06956
875.0000 -149.81118 -141.35524 8.45594 2.78319 -141.78408 1006.93759
880.0000 -150.08640 -143.57437 6.51203 2.79179 -141.64782 1006.35882
885.0000 -149.64104 -142.27855 7.36249 2.73228 -142.59014 980.31856
890.0000 -150.50429 -142.46983 8.03446 2.81370 -141.30098 1020.98882
895.0000 -150.04595 -141.02399 9.02196 2.76146 -142.12814 1009.16729
900.0000 -148.71577 -140.48580 8.22997 2.91487 -139.69918 1117.29953
905.0000 -149.58750 -139.58459 10.00291 2.83456 -140.97072 1053.47410
910.0000 -150.07495 -140.85322 9.22173 2.87027 -140.40524 1086.77008
915.0000 -149.76902 -142.15867 7.61035 2.80294 -141.47139 1057.96469
920.0000 -150.27362 -142.76476 7.50886 2.74949 -142.31757 987.95802
925.0000 -149.81840 -140.84953 8.96887 2.74264 -142.42614 999.07435
930.0000 -150.06670 -142.04767 8.01903 2.83836 -140.91048 1081.06563
935.0000 -151.60631 -142.31442 9.29189 2.75093 -142.29474 1009.66788
940.0000 -150.49922 -142.18227 8.31694 2.81114 -141.34143 1046.88291
945.0000 -148.94805 -140.45356 8.49449 2.80226 -141.48212 1022.09819
950.0000 -149.86801 -141.30872 8.55928 2.87658 -140.30542 1072.26469
955.0000 -150.02226 -142.47501 7.54725 2.81958 -141.20796 1023.54085
960.0000 -150.38768 -141.79551 8.59216 2.77407 -141.92838 1014.74500
965.0000 -150.55519 -141.47840 9.07680 2.84573 -140.79390 1037.81188
970.0000 -148.95518 -139.97042 8.98475 2.77863 -141.85620 992.14102
975.0000 -148.45667 -141.15903 7.29764 2.90480 -139.85859 1104.57192
980.0000 -150.74740 -142.57941 8.16799 2.79804 -141.54891 1046.93505
985.0000 -148.44106 -140.74008 7.70098 2.79733 -141.56016 1008.41592
990.0000 -150.06094 -142.19555 7.86539 2.77764 -141.87187 1010.98432
995.0000 -151.99253 -143.49459 8.49794 2.74278 -142.42389 998.94031
1000.0000 -150.87347 -142.97028 7.90319 2.69282 -143.21482 956.46430
FREEZING PROCESS: loop number 5 T-loop= 982.00000000000000
main_MD> interactions number 5 at Temperature= 982.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.06962 -0.53430 0.07779
force_rgl> df(natom) 1.06656 2.91661 0.66055
1005.0000 -150.32576 -142.62739 7.69837 2.71283 -142.89798 964.98550
1010.0000 -152.49381 -143.86319 8.63062 2.68838 -143.28518 941.81291
1015.0000 -151.72355 -144.04596 7.67759 2.67121 -143.55701 911.57350
1020.0000 -149.79587 -141.20884 8.58703 2.75829 -142.17822 1002.85576
1025.0000 -151.62499 -143.16726 8.45773 2.75438 -142.24014 981.04861
1030.0000 -150.87080 -142.04814 8.82266 2.67923 -143.43004 932.36459
1035.0000 -150.74726 -142.50595 8.24131 2.72675 -142.67771 932.39793
1040.0000 -151.08024 -143.06070 8.01954 2.74237 -142.43033 977.23383
1045.0000 -148.19606 -139.73977 8.45629 2.79558 -141.58790 988.47740
1050.0000 -148.17570 -139.02154 9.15416 2.87402 -140.34590 1061.68123
1055.0000 -150.16696 -141.30629 8.86067 2.96054 -138.97600 1135.94017
1060.0000 -149.21521 -140.72359 8.49163 2.82287 -141.15574 1002.82053
1065.0000 -148.70186 -140.61129 8.09057 2.84909 -140.74070 1068.57662
1070.0000 -150.32114 -142.13405 8.18709 2.83027 -141.03864 1064.32030
1075.0000 -147.93054 -140.94460 6.98594 2.77852 -141.85798 997.77332
1080.0000 -147.67302 -139.95860 7.71442 2.84386 -140.82340 1041.95190
1085.0000 -149.25319 -139.41275 9.84044 2.92121 -139.59885 1080.52567
1090.0000 -151.92470 -143.73252 8.19218 2.80325 -141.46636 1026.07666
1095.0000 -153.00003 -145.28519 7.71485 2.60026 -144.68034 917.46335
1100.0000 -150.99701 -143.21944 7.77757 2.71987 -142.78656 981.65979
1105.0000 -149.83854 -142.33688 7.50165 2.74994 -142.31046 978.01832
1110.0000 -150.45430 -141.32732 9.12698 2.86993 -140.41075 1043.82856
1115.0000 -150.26967 -141.33574 8.93392 2.79264 -141.63450 1004.44971
1120.0000 -148.84956 -140.24134 8.60822 2.83541 -140.95721 1030.78880
1125.0000 -151.86240 -143.09891 8.76349 2.80945 -141.36825 1047.90063
1130.0000 -151.63765 -144.13204 7.50561 2.68612 -143.32091 941.12943
1135.0000 -151.86011 -143.73756 8.12256 2.60898 -144.54223 878.45227
1140.0000 -152.64981 -145.15017 7.49964 2.66082 -143.72159 972.56905
1145.0000 -150.89192 -142.49366 8.39826 2.69360 -143.20245 940.52735
1150.0000 -150.86607 -143.28018 7.58589 2.72400 -142.72126 976.43818
1155.0000 -151.90615 -144.56878 7.33737 2.63967 -144.05635 887.85694
1160.0000 -151.04708 -142.39306 8.65403 2.65501 -143.81358 911.89671
1165.0000 -149.25446 -141.06936 8.18509 2.74179 -142.43956 984.62886
1170.0000 -150.44444 -142.17095 8.27349 2.81636 -141.25890 1043.66129
1175.0000 -149.16762 -142.14285 7.02478 2.76962 -141.99892 1024.24125
1180.0000 -150.22087 -141.17758 9.04329 2.78586 -141.74173 1054.72112
1185.0000 -149.53418 -140.99718 8.53700 2.83055 -141.03421 1034.94775
1190.0000 -148.80892 -139.91787 8.89105 2.83061 -141.03320 1050.21339
1195.0000 -150.01566 -141.94746 8.06820 2.83769 -140.92120 1045.46245
1200.0000 -151.13702 -144.89376 6.24326 2.62578 -144.27625 915.60685
1205.0000 -151.71365 -143.41760 8.29605 2.63156 -144.18476 892.34493
1210.0000 -149.95202 -142.45613 7.49589 2.71282 -142.89817 937.01653
1215.0000 -152.58553 -146.18924 6.39629 2.61216 -144.49198 908.08933
1220.0000 -152.58839 -146.59261 5.99578 2.49857 -146.29033 797.81173
1225.0000 -152.50406 -144.48095 8.02311 2.55307 -145.42748 819.72125
1230.0000 -150.08375 -141.97147 8.11228 2.69010 -143.25795 934.21479
1235.0000 -150.80220 -142.64924 8.15296 2.78263 -141.79285 990.97049
1240.0000 -151.33801 -143.25012 8.08789 2.69218 -143.22505 939.86446
1245.0000 -149.99324 -142.01889 7.97435 2.68903 -143.27480 945.26539
1250.0000 -149.90800 -141.03396 8.87404 2.78374 -141.77540 1011.60081
FREEZING PROCESS: loop number 6 T-loop= 957.00000000000000
main_MD> interactions number 6 at Temperature= 957.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.53213 1.77607 1.60539
force_rgl> df(natom) 1.79779 -2.26682 -2.20768
1255.0000 -151.48990 -144.34703 7.14287 2.66350 -143.67911 934.06628
1260.0000 -151.76986 -145.03361 6.73626 2.66308 -143.68570 901.82051
1265.0000 -150.68478 -141.73939 8.94539 2.69489 -143.18202 942.28103
1270.0000 -151.32733 -143.14523 8.18210 2.71578 -142.85140 910.95181
1275.0000 -151.78694 -145.60541 6.18152 2.63240 -144.17141 901.69861
1280.0000 -150.77817 -142.25929 8.51888 2.67859 -143.44010 963.10716
1285.0000 -149.95528 -141.82033 8.13495 2.73508 -142.54569 976.70162
1290.0000 -150.46779 -141.87132 8.59647 2.77977 -141.83814 1027.99479
1295.0000 -150.56780 -142.25272 8.31507 2.74717 -142.35436 1001.62932
1300.0000 -149.10707 -142.43033 6.67674 2.66940 -143.58563 901.04783
1305.0000 -149.41664 -140.82542 8.59122 2.73125 -142.60641 953.50503
1310.0000 -149.71851 -141.19163 8.52687 2.77972 -141.83902 955.66903
1315.0000 -151.10671 -143.01642 8.09029 2.76183 -142.12223 1020.19549
1320.0000 -149.81641 -140.19045 9.62596 2.83493 -140.96481 1094.72305
1325.0000 -149.37683 -140.51079 8.86605 2.81043 -141.35270 1040.89738
1330.0000 -150.48628 -141.35031 9.13597 2.79083 -141.66310 1019.77244
1335.0000 -151.42928 -141.87116 9.55812 2.81966 -141.20660 1026.23498
1340.0000 -148.68941 -140.43150 8.25791 2.78795 -141.70871 961.82700
1345.0000 -150.14517 -142.63452 7.51065 2.80824 -141.38749 1055.36987
1350.0000 -150.75126 -142.99224 7.75902 2.67236 -143.53886 923.79208
1355.0000 -150.74025 -143.32443 7.41582 2.67573 -143.48545 940.56187
1360.0000 -150.45797 -143.41813 7.03984 2.68664 -143.31270 931.62700
1365.0000 -150.70368 -143.59706 7.10662 2.65323 -143.84170 911.70597
1370.0000 -150.16825 -143.59636 6.57190 2.70592 -143.00746 928.84162
1375.0000 -151.68122 -144.07033 7.61089 2.66008 -143.73320 934.39730
1380.0000 -150.68066 -144.13372 6.54695 2.65664 -143.78771 926.86045
1385.0000 -150.29366 -144.01288 6.28078 2.61935 -144.37818 888.96955
1390.0000 -151.00751 -143.49625 7.51126 2.68558 -143.32947 923.13125
1395.0000 -150.84375 -143.49317 7.35058 2.73599 -142.53131 964.16546
1400.0000 -150.23555 -142.92551 7.31004 2.70094 -143.08630 957.81080
1405.0000 -150.10981 -141.75750 8.35231 2.73591 -142.53264 923.96757
1410.0000 -152.11133 -143.53543 8.57590 2.70076 -143.08912 947.54710
1415.0000 -151.91128 -143.51741 8.39387 2.60455 -144.61248 884.69315
1420.0000 -150.27642 -142.68948 7.58694 2.75175 -142.28178 963.29705
1425.0000 -150.09693 -142.16232 7.93461 2.74847 -142.33376 987.20749
1430.0000 -149.77848 -142.56131 7.21717 2.72198 -142.75313 997.38684
1435.0000 -152.36223 -144.27961 8.08261 2.69655 -143.15580 934.99724
1440.0000 -149.71214 -142.31270 7.39944 2.65351 -143.83718 899.32910
1445.0000 -150.94888 -142.97505 7.97383 2.74024 -142.46401 1016.59360
1450.0000 -150.14557 -142.05038 8.09519 2.71859 -142.80680 968.19166
1455.0000 -151.58593 -144.55883 7.02710 2.72844 -142.65089 950.14809
1460.0000 -151.53369 -144.33475 7.19894 2.65244 -143.85424 903.02217
1465.0000 -151.90807 -144.03169 7.87639 2.66252 -143.69464 965.44656
1470.0000 -152.53141 -145.85667 6.67475 2.57464 -145.08594 878.50451
1475.0000 -152.03511 -144.92435 7.11076 2.55013 -145.47400 884.53310
1480.0000 -150.34109 -142.83471 7.50638 2.66358 -143.67777 943.57274
1485.0000 -149.39067 -141.81487 7.57579 2.69158 -143.23452 923.87687
1490.0000 -151.42235 -143.20767 8.21468 2.68546 -143.33145 925.57099
1495.0000 -151.42227 -143.43848 7.98379 2.64909 -143.90730 913.36923
1500.0000 -152.67382 -144.10499 8.56883 2.65469 -143.81858 901.91939
FREEZING PROCESS: loop number 7 T-loop= 932.00000000000000
main_MD> interactions number 7 at Temperature= 932.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.02584 1.16014 0.33078
force_rgl> df(natom) 0.57636 -0.68483 0.69285
1505.0000 -150.92764 -143.20381 7.72383 2.65920 -143.74709 917.77129
1510.0000 -149.95528 -143.23646 6.71882 2.72540 -142.69908 981.55168
1515.0000 -152.38623 -145.34446 7.04177 2.59523 -144.75992 897.45594
1520.0000 -152.05167 -144.71311 7.33856 2.56053 -145.30944 833.73385
1525.0000 -151.15088 -144.52143 6.62945 2.65503 -143.81324 904.62670
1530.0000 -150.69855 -142.97814 7.72041 2.63201 -144.17772 884.34391
1535.0000 -151.49533 -144.15164 7.34368 2.65719 -143.77902 908.39077
1540.0000 -151.39105 -143.77796 7.61309 2.64732 -143.93520 928.35060
1545.0000 -149.14683 -141.43696 7.70987 2.76007 -142.15005 1009.89297
1550.0000 -151.59340 -143.06867 8.52473 2.72000 -142.78450 963.21827
1555.0000 -150.96426 -143.73333 7.23093 2.66433 -143.66591 918.61926
1560.0000 -150.29346 -142.93610 7.35736 2.65391 -143.83095 933.73201
1565.0000 -151.16809 -144.78693 6.38115 2.56721 -145.20369 868.86995
1570.0000 -151.05550 -142.11190 8.94360 2.66398 -143.67149 892.99986
1575.0000 -151.03125 -142.13565 8.89560 2.76508 -142.07074 1012.54655
1580.0000 -150.86359 -142.26992 8.59367 2.77317 -141.94271 1018.92039
1585.0000 -151.94787 -144.44494 7.50293 2.69479 -143.18366 949.03068
1590.0000 -150.16286 -143.51491 6.64795 2.60161 -144.65901 858.49879
1595.0000 -150.74633 -143.14388 7.60245 2.69342 -143.20539 894.03217
1600.0000 -151.50058 -143.52757 7.97301 2.70340 -143.04728 958.04025
1605.0000 -152.05916 -144.23697 7.82219 2.62998 -144.20973 907.41597
1610.0000 -151.53844 -144.68084 6.85760 2.67094 -143.56126 930.09479
1615.0000 -150.84000 -142.80034 8.03965 2.67820 -143.44628 947.55987
1620.0000 -150.92363 -142.96236 7.96127 2.68974 -143.26360 932.55458
1625.0000 -150.36896 -141.62654 8.74241 2.70959 -142.94934 951.50036
1630.0000 -151.91155 -143.62253 8.28902 2.68739 -143.30079 913.58985
1635.0000 -150.87371 -142.87585 7.99786 2.63149 -144.18590 888.88940
1640.0000 -151.87031 -144.11485 7.75546 2.69983 -143.10388 995.30188
1645.0000 -151.19892 -143.37158 7.82734 2.61225 -144.49046 904.75677
1650.0000 -150.35045 -142.01731 8.33313 2.69660 -143.15507 958.79276
1655.0000 -149.26765 -141.17489 8.09276 2.75686 -142.20094 1010.39080
1660.0000 -150.58919 -143.57177 7.01741 2.72639 -142.68333 984.46883
1665.0000 -153.31533 -146.59019 6.72513 2.56217 -145.28340 873.56870
1670.0000 -153.82204 -146.90496 6.91707 2.46474 -146.82610 811.30712
1675.0000 -152.78115 -146.02997 6.75118 2.50203 -146.23563 819.06785
1680.0000 -152.18016 -144.86395 7.31621 2.51753 -145.99027 850.82705
1685.0000 -150.74748 -144.60032 6.14715 2.56981 -145.16254 854.18203
1690.0000 -151.40778 -144.84322 6.56456 2.57721 -145.04535 834.56971
1695.0000 -151.79562 -144.63571 7.15991 2.56613 -145.22078 861.41174
1700.0000 -152.47657 -144.48794 7.98864 2.57252 -145.11955 877.86726
1705.0000 -151.67523 -144.01862 7.65661 2.58664 -144.89606 890.56586
1710.0000 -151.25938 -144.66289 6.59649 2.60616 -144.58689 873.12802
1715.0000 -150.70515 -142.79406 7.91109 2.62591 -144.27423 897.87584
1720.0000 -151.26673 -145.22197 6.04476 2.66872 -143.59648 949.00764
1725.0000 -151.98318 -144.40996 7.57322 2.61222 -144.49095 889.80690
1730.0000 -152.81667 -144.14010 8.67657 2.62846 -144.23382 891.47781
1735.0000 -150.43315 -142.31680 8.11635 2.66732 -143.61866 954.00885
1740.0000 -149.97345 -142.26086 7.71259 2.77986 -141.83682 1000.31496
1745.0000 -150.42964 -143.14960 7.28005 2.73967 -142.47311 985.48949
1750.0000 -150.35773 -143.05859 7.29914 2.69493 -143.18141 947.41146
FREEZING PROCESS: loop number 8 T-loop= 907.00000000000000
main_MD> interactions number 8 at Temperature= 907.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.53956 0.55815 0.35289
force_rgl> df(natom) 0.80287 -11.11777 1.12945
1755.0000 -150.51165 -143.90226 6.60939 2.68150 -143.39409 956.60873
1760.0000 -151.35130 -142.85753 8.49377 2.67938 -143.42769 951.31533
1765.0000 -149.12711 -142.06611 7.06101 2.74279 -142.42372 978.24939
1770.0000 -152.68684 -144.48280 8.20405 2.69303 -143.21148 955.75531
1775.0000 -152.04407 -144.04895 7.99511 2.61706 -144.41434 900.41383
1780.0000 -151.71613 -142.74586 8.97027 2.68106 -143.40104 990.84001
1785.0000 -152.27722 -145.14532 7.13190 2.64219 -144.01646 908.44723
1790.0000 -151.83970 -145.67302 6.16668 2.51515 -146.02789 841.86235
1795.0000 -152.54191 -146.41252 6.12939 2.49764 -146.30514 810.97469
1800.0000 -154.11516 -146.47177 7.64338 2.50306 -146.21939 807.52714
1805.0000 -152.40712 -145.29741 7.10971 2.55243 -145.43759 861.05823
1810.0000 -152.40117 -145.40839 6.99278 2.54450 -145.56318 841.78992
1815.0000 -151.91249 -144.86620 7.04629 2.53499 -145.71370 856.76190
1820.0000 -152.38839 -144.35824 8.03015 2.62163 -144.34199 890.63820
1825.0000 -151.61336 -145.29233 6.32104 2.52999 -145.79290 815.84770
1830.0000 -153.26821 -144.39389 8.87432 2.59368 -144.78460 904.21980
1835.0000 -151.09279 -144.28659 6.80619 2.62277 -144.32395 892.27285
1840.0000 -151.95522 -144.56921 7.38601 2.61788 -144.40142 868.56427
1845.0000 -151.86823 -145.73309 6.13514 2.52364 -145.89352 839.03489
1850.0000 -151.23488 -144.97640 6.25847 2.53137 -145.77114 835.26399
1855.0000 -152.68986 -144.55104 8.13881 2.57721 -145.04531 877.38695
1860.0000 -151.95059 -144.68302 7.26757 2.57805 -145.03206 875.72466
1865.0000 -151.04938 -144.19954 6.84984 2.62029 -144.36330 886.76861
1870.0000 -151.56700 -143.29749 8.26950 2.65994 -143.73537 916.10324
1875.0000 -153.78706 -146.52464 7.26242 2.55293 -145.42971 886.45911
1880.0000 -152.55973 -145.77435 6.78537 2.54675 -145.52757 869.06815
1885.0000 -151.32134 -145.18694 6.13440 2.51095 -146.09444 820.59915
1890.0000 -151.13454 -144.75876 6.37578 2.57109 -145.14221 866.63659
1895.0000 -151.58095 -145.23124 6.34971 2.53435 -145.72394 819.81995
1900.0000 -152.63559 -145.75826 6.87733 2.56591 -145.22420 868.04385
1905.0000 -153.18905 -145.93632 7.25273 2.51935 -145.96132 805.05004
1910.0000 -151.73615 -143.90418 7.83196 2.63199 -144.17802 930.72343
1915.0000 -152.23317 -144.18757 8.04560 2.60868 -144.54706 925.07006
1920.0000 -152.27786 -144.40410 7.87376 2.64455 -143.97914 898.42741
1925.0000 -152.42927 -144.86355 7.56573 2.60598 -144.58977 892.31639
1930.0000 -151.99928 -144.48779 7.51149 2.58336 -144.94790 884.92508
1935.0000 -152.66036 -145.70454 6.95582 2.55924 -145.32990 856.61087
1940.0000 -152.82278 -145.80417 7.01861 2.54138 -145.61256 843.51772
1945.0000 -150.09825 -142.47445 7.62380 2.58911 -144.85697 879.52560
1950.0000 -150.54718 -143.78179 6.76539 2.70805 -142.97378 936.70277
1955.0000 -151.48544 -144.99381 6.49163 2.60980 -144.52935 916.85576
1960.0000 -150.27787 -143.75338 6.52449 2.57324 -145.10821 851.50581
1965.0000 -151.01507 -143.53007 7.48501 2.65547 -143.80619 897.07085
1970.0000 -149.84766 -144.45276 5.39491 2.64881 -143.91172 918.73940
1975.0000 -153.24897 -146.11338 7.13559 2.59575 -144.75179 832.68621
1980.0000 -152.65108 -146.22777 6.42331 2.52822 -145.82097 840.26011
1985.0000 -151.94031 -144.03094 7.90937 2.55506 -145.39601 855.93969
1990.0000 -151.04272 -144.23672 6.80600 2.68504 -143.33810 934.32455
1995.0000 -150.48107 -142.79185 7.68922 2.62817 -144.23839 914.13014
2000.0000 -151.47471 -144.65964 6.81507 2.61324 -144.47486 905.65834
FREEZING PROCESS: loop number 9 T-loop= 882.00000000000000
main_MD> interactions number 9 at Temperature= 882.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.90586 2.32873 2.78823
force_rgl> df(natom) -1.27333 -0.88287 1.48678
2005.0000 -151.54236 -144.53520 7.00717 2.58011 -144.99945 853.83618
2010.0000 -152.03932 -145.25705 6.78228 2.61434 -144.45746 883.45541
2015.0000 -153.84828 -146.57976 7.26852 2.54012 -145.63249 837.34299
2020.0000 -153.16570 -146.35428 6.81142 2.48673 -146.47792 814.04005
2025.0000 -152.45513 -145.24824 7.20689 2.55513 -145.39487 842.92292
2030.0000 -151.77587 -144.08156 7.69431 2.63331 -144.15708 908.96398
2035.0000 -151.86732 -143.12158 8.74575 2.65434 -143.82411 933.83957
2040.0000 -154.03544 -145.30702 8.72842 2.64178 -144.02297 918.23272
2045.0000 -152.54907 -144.91222 7.63686 2.57497 -145.08082 833.82362
2050.0000 -150.92249 -143.24471 7.67778 2.67338 -143.52267 924.43985
2055.0000 -150.74090 -144.50467 6.23622 2.62322 -144.31690 893.55572
2060.0000 -150.76219 -143.59807 7.16412 2.71887 -142.80238 955.40006
2065.0000 -152.21568 -144.61691 7.59877 2.66814 -143.60555 932.62843
2070.0000 -152.69400 -145.79416 6.89984 2.55298 -145.42900 855.41726
2075.0000 -152.91473 -145.42865 7.48608 2.55128 -145.45580 865.71637
2080.0000 -152.29881 -144.58697 7.71185 2.57740 -145.04225 831.77500
2085.0000 -151.71653 -144.50456 7.21197 2.55613 -145.37898 845.95020
2090.0000 -150.60552 -143.92102 6.68449 2.65280 -143.84855 957.54461
2095.0000 -151.44265 -144.92467 6.51798 2.62064 -144.35762 886.17753
2100.0000 -151.81040 -145.36771 6.44269 2.55565 -145.38671 888.15443
2105.0000 -153.96409 -147.31067 6.65342 2.49512 -146.34503 837.41245
2110.0000 -152.94468 -145.53482 7.40986 2.52978 -145.79618 830.07611
2115.0000 -152.61088 -146.08508 6.52579 2.51791 -145.98422 843.49241
2120.0000 -152.52804 -145.64066 6.88738 2.52769 -145.82932 830.29756
2125.0000 -152.33835 -145.84025 6.49810 2.53598 -145.69810 831.56061
2130.0000 -151.39391 -144.78430 6.60961 2.55635 -145.37560 841.64567
2135.0000 -152.98201 -146.49098 6.49103 2.54226 -145.59863 823.70030
2140.0000 -153.29689 -146.28719 7.00970 2.50958 -146.11609 828.76250
2145.0000 -153.91504 -147.12264 6.79240 2.48422 -146.51765 827.23789
2150.0000 -152.21141 -146.77502 5.43639 2.44590 -147.12431 770.28229
2155.0000 -152.95876 -146.69799 6.26077 2.50112 -146.24996 830.86722
2160.0000 -152.01189 -144.90113 7.11075 2.51917 -145.96423 823.85913
2165.0000 -150.13213 -142.06284 8.06929 2.65829 -143.76157 926.50545
2170.0000 -151.87778 -144.21689 7.66088 2.67488 -143.49897 947.43304
2175.0000 -151.83059 -144.59489 7.23570 2.64861 -143.91482 931.76004
2180.0000 -152.38958 -145.27787 7.11171 2.60796 -144.55839 920.88702
2185.0000 -151.87503 -145.21199 6.66304 2.55075 -145.46419 854.63421
2190.0000 -151.04820 -141.67754 9.37066 2.63560 -144.12082 919.36830
2195.0000 -151.81988 -144.43732 7.38256 2.71268 -142.90037 984.68388
2200.0000 -151.63340 -144.42588 7.20752 2.63245 -144.17066 927.86828
2205.0000 -152.28037 -144.10191 8.17846 2.63605 -144.11362 882.30458
2210.0000 -152.40051 -144.23945 8.16106 2.67401 -143.51273 950.93392
2215.0000 -152.63633 -146.47387 6.16245 2.54468 -145.56030 879.97188
2220.0000 -152.37585 -146.02668 6.34918 2.50026 -146.26362 817.79418
2225.0000 -153.22025 -146.25586 6.96438 2.51557 -146.02121 821.91990
2230.0000 -150.85085 -143.82059 7.03026 2.56335 -145.26468 838.16977
2235.0000 -151.28050 -145.14756 6.13294 2.57220 -145.12468 852.94008
2240.0000 -153.14657 -146.92421 6.22236 2.53322 -145.74174 821.05493
2245.0000 -152.19597 -145.29566 6.90031 2.50904 -146.12463 799.43065
2250.0000 -152.15786 -145.70652 6.45134 2.59191 -144.81250 878.99160
FREEZING PROCESS: loop number 10 T-loop= 857.00000000000000
main_MD> interactions number 10 at Temperature= 857.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.88085 -3.26039 0.94135
force_rgl> df(natom) 1.35104 2.91196 5.27035
2255.0000 -153.25493 -145.45851 7.79642 2.55677 -145.36897 858.22655
2260.0000 -151.88236 -145.82091 6.06145 2.53880 -145.65338 842.92022
2265.0000 -151.54169 -144.76848 6.77321 2.58673 -144.89462 839.85389
2270.0000 -152.51343 -147.00133 5.51209 2.55397 -145.41328 842.91782
2275.0000 -154.57485 -146.86950 7.70535 2.47428 -146.67495 783.35337
2280.0000 -151.08894 -143.81703 7.27192 2.55041 -145.46962 834.48189
2285.0000 -152.97980 -146.33782 6.64197 2.56896 -145.17589 890.17609
2290.0000 -152.63308 -145.90453 6.72855 2.49186 -146.39668 824.09256
2295.0000 -153.18187 -146.30338 6.87849 2.54245 -145.59564 860.30510
2300.0000 -151.80365 -144.54688 7.25677 2.55313 -145.42663 825.55074
2305.0000 -150.64897 -143.78605 6.86291 2.63348 -144.15445 908.29318
2310.0000 -151.93119 -144.75729 7.17389 2.62948 -144.21764 911.88376
2315.0000 -150.73567 -143.75569 6.97998 2.64553 -143.96365 924.33680
2320.0000 -151.71122 -144.75809 6.95313 2.62513 -144.28659 893.12901
2325.0000 -152.90147 -146.67025 6.23121 2.51288 -146.06376 800.49265
2330.0000 -152.88818 -146.81073 6.07745 2.48157 -146.55958 808.13613
2335.0000 -154.24673 -148.09399 6.15274 2.42006 -147.53350 744.32267
2340.0000 -153.60995 -149.20280 4.40715 2.34578 -148.70948 693.55922
2345.0000 -152.54481 -145.70886 6.83596 2.41420 -147.62623 733.42421
2350.0000 -152.07408 -143.71757 8.35651 2.61149 -144.50261 900.20098
2355.0000 -151.95253 -144.33907 7.61346 2.58190 -144.97107 876.87658
2360.0000 -152.30775 -145.47681 6.83094 2.58157 -144.97624 855.75354
2365.0000 -150.32274 -143.07224 7.25050 2.59093 -144.82807 896.68428
2370.0000 -151.80115 -144.98496 6.81619 2.61286 -144.48084 873.74959
2375.0000 -151.50960 -144.31006 7.19954 2.60255 -144.64411 862.75243
2380.0000 -153.50116 -146.34984 7.15132 2.58385 -144.94025 885.73517
2385.0000 -153.10859 -146.31196 6.79663 2.47348 -146.68764 827.20044
2390.0000 -153.46635 -146.04365 7.42270 2.43498 -147.29724 792.76606
2395.0000 -152.44514 -146.73890 5.70625 2.49253 -146.38608 811.10476
2400.0000 -153.11769 -147.44802 5.66967 2.40193 -147.82049 727.09471
2405.0000 -152.02849 -144.63378 7.39471 2.54881 -145.49497 865.21122
2410.0000 -150.97429 -144.17739 6.79690 2.66201 -143.70268 940.28701
2415.0000 -152.16404 -145.05428 7.10976 2.57393 -145.09729 821.93501
2420.0000 -150.55770 -144.82603 5.73167 2.58001 -145.00101 866.51065
2425.0000 -151.60358 -144.38999 7.21359 2.60737 -144.56776 864.71874
2430.0000 -152.30032 -145.70103 6.59929 2.54621 -145.53618 835.30966
2435.0000 -151.42080 -144.81780 6.60300 2.60729 -144.56906 875.80381
2440.0000 -153.40196 -146.71001 6.69195 2.56626 -145.21861 870.25283
2445.0000 -152.54154 -145.36800 7.17354 2.58667 -144.89556 893.61544
2450.0000 -152.90137 -146.04892 6.85245 2.50524 -146.18474 829.95013
2455.0000 -152.52024 -144.33147 8.18877 2.63960 -144.05744 927.14863
2460.0000 -153.77976 -147.53776 6.24199 2.52589 -145.85786 857.15238
2465.0000 -154.48483 -147.41188 7.07295 2.43120 -147.35702 775.23120
2470.0000 -153.13098 -146.68469 6.44629 2.43575 -147.28499 779.14939
2475.0000 -152.84399 -146.00943 6.83456 2.49654 -146.32262 817.92941
2480.0000 -151.98109 -145.37842 6.60268 2.51987 -145.95312 813.86413
2485.0000 -152.04749 -145.36541 6.68208 2.57257 -145.11870 866.04241
2490.0000 -151.49850 -144.08726 7.41124 2.56074 -145.30601 846.43626
2495.0000 -153.27094 -145.65069 7.62025 2.56535 -145.23315 858.96280
2500.0000 -150.98015 -143.62682 7.35333 2.59070 -144.83175 876.37982
FREEZING PROCESS: loop number 11 T-loop= 832.00000000000000
main_MD> interactions number 11 at Temperature= 832.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.38129 -1.41409 -2.95286
force_rgl> df(natom) -2.00400 -1.37230 -2.95165
2505.0000 -149.81927 -142.19526 7.62401 2.68144 -143.39506 934.38241
2510.0000 -151.09242 -145.44884 5.64359 2.62224 -144.33229 902.01848
2515.0000 -152.56006 -145.39814 7.16192 2.55441 -145.40624 830.36610
2520.0000 -154.15438 -148.41857 5.73581 2.50728 -146.15252 835.39371
2525.0000 -154.02219 -147.81780 6.20440 2.38097 -148.15231 741.58888
2530.0000 -154.57705 -147.30410 7.27295 2.42670 -147.42837 791.07503
2535.0000 -152.31516 -145.48237 6.83279 2.48655 -146.48070 816.96196
2540.0000 -153.17447 -148.04681 5.12765 2.47014 -146.74059 767.86035
2545.0000 -153.25396 -146.24433 7.00964 2.46724 -146.78644 803.82806
2550.0000 -153.88378 -146.58097 7.30281 2.50886 -146.12741 842.70055
2555.0000 -152.26259 -144.80177 7.46082 2.58370 -144.94251 871.03874
2560.0000 -153.02606 -146.64186 6.38420 2.50597 -146.17328 825.08681
2565.0000 -153.78371 -148.17887 5.60484 2.41407 -147.62834 781.14573
2570.0000 -152.76106 -146.53164 6.22942 2.40294 -147.80451 756.62941
2575.0000 -153.48096 -147.67781 5.80315 2.47160 -146.71749 801.78623
2580.0000 -153.65028 -148.19398 5.45630 2.47201 -146.71090 785.46932
2585.0000 -153.31966 -146.46453 6.85513 2.43789 -147.25106 774.22446
2590.0000 -153.00408 -146.42807 6.57601 2.51159 -146.08433 840.79937
2595.0000 -153.88803 -146.51940 7.36863 2.45076 -147.04733 769.14160
2600.0000 -153.86504 -146.08180 7.78324 2.51125 -146.08963 815.94247
2605.0000 -152.69173 -146.00710 6.68463 2.55151 -145.45216 851.46703
2610.0000 -151.96949 -144.98541 6.98409 2.59025 -144.83891 895.08785
2615.0000 -151.84567 -145.30624 6.53943 2.58561 -144.91237 854.08668
2620.0000 -153.49052 -146.03202 7.45850 2.52897 -145.80909 849.91349
2625.0000 -153.05464 -146.20272 6.85193 2.52531 -145.86705 839.18600
2630.0000 -153.11276 -147.37546 5.73730 2.43847 -147.24197 790.74076
2635.0000 -153.50182 -148.31270 5.18912 2.37645 -148.22387 725.17217
2640.0000 -152.75602 -146.54389 6.21213 2.44859 -147.08166 768.00724
2645.0000 -154.34908 -147.46512 6.88396 2.49845 -146.29228 828.44799
2650.0000 -153.53038 -147.94671 5.58368 2.43736 -147.25957 785.72642
2655.0000 -153.94474 -148.16935 5.77538 2.38391 -148.10575 739.08853
2660.0000 -153.50240 -146.91904 6.58336 2.41399 -147.62960 758.93649
2665.0000 -153.78238 -147.89200 5.89038 2.43620 -147.27782 767.95292
2670.0000 -152.44578 -145.26465 7.18112 2.46771 -146.77898 771.63204
2675.0000 -153.41925 -145.86691 7.55234 2.52913 -145.80650 827.58983
2680.0000 -152.76840 -145.68244 7.08595 2.53927 -145.64597 854.90934
2685.0000 -152.17068 -146.20707 5.96361 2.52250 -145.91145 818.65292
2690.0000 -149.58424 -144.06442 5.51982 2.53934 -145.64486 830.52849
2695.0000 -153.17239 -144.41272 8.75967 2.65229 -143.85659 895.15386
2700.0000 -152.09200 -144.38065 7.71135 2.62280 -144.32349 923.93422
2705.0000 -153.45324 -145.72667 7.72657 2.54591 -145.54090 840.56108
2710.0000 -152.40973 -145.57966 6.83007 2.52760 -145.83076 822.33618
2715.0000 -153.65229 -147.05850 6.59379 2.45472 -146.98462 757.89124
2720.0000 -151.65424 -144.39158 7.26266 2.53807 -145.66507 841.65781
2725.0000 -151.80420 -143.83052 7.97367 2.59887 -144.70232 886.54702
2730.0000 -152.47602 -144.89808 7.57794 2.58956 -144.84969 894.22858
2735.0000 -151.21883 -145.17001 6.04881 2.57200 -145.12778 854.00164
2740.0000 -151.83590 -143.96344 7.87246 2.57690 -145.05016 864.56366
2745.0000 -153.46996 -146.63516 6.83479 2.54635 -145.53395 843.46352
2750.0000 -153.03031 -145.20629 7.82403 2.51727 -145.99439 821.03633
FREEZING PROCESS: loop number 12 T-loop= 807.00000000000000
main_MD> interactions number 12 at Temperature= 807.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.63047 4.76326 1.54157
force_rgl> df(natom) 4.98369 2.44325 -3.79065
2755.0000 -154.10795 -147.08798 7.01997 2.45471 -146.98477 804.31112
2760.0000 -152.68810 -146.80569 5.88241 2.43573 -147.28530 786.22557
2765.0000 -153.22992 -145.96890 7.26102 2.49443 -146.35593 850.04624
2770.0000 -154.04971 -147.44512 6.60459 2.48515 -146.50293 800.36593
2775.0000 -154.05082 -147.89472 6.15610 2.40763 -147.73017 777.14473
2780.0000 -154.81716 -148.16209 6.65507 2.37077 -148.31381 729.71939
2785.0000 -152.20246 -145.52672 6.67574 2.51534 -146.02495 832.65598
2790.0000 -152.84716 -147.94156 4.90560 2.48217 -146.55006 783.79250
2795.0000 -153.98879 -147.51092 6.47786 2.41884 -147.55268 732.67030
2800.0000 -154.25916 -147.28741 6.97175 2.44277 -147.17389 763.23048
2805.0000 -153.79409 -148.30794 5.48615 2.37063 -148.31601 697.39297
2810.0000 -153.61351 -146.48001 7.13351 2.45323 -147.00834 760.41345
2815.0000 -151.20031 -144.55696 6.64335 2.50901 -146.12508 819.34126
2820.0000 -152.79004 -146.02412 6.76593 2.55698 -145.36565 858.31196
2825.0000 -153.57452 -146.73174 6.84277 2.47114 -146.72466 789.36981
2830.0000 -152.60553 -145.54675 7.05878 2.52505 -145.87108 839.20682
2835.0000 -153.19715 -145.80871 7.38844 2.53068 -145.78202 844.60733
2840.0000 -153.47573 -147.35601 6.11972 2.45756 -146.93968 804.43777
2845.0000 -152.63939 -146.66784 5.97155 2.45645 -146.95721 782.78135
2850.0000 -152.97464 -147.22270 5.75195 2.44932 -147.07011 773.09517
2855.0000 -154.07905 -147.40365 6.67540 2.43811 -147.24768 749.85474
2860.0000 -153.40654 -146.56341 6.84312 2.48249 -146.54499 808.28666
2865.0000 -154.18005 -146.53005 7.65000 2.47192 -146.71236 810.22118
2870.0000 -154.67788 -146.63928 8.03860 2.49057 -146.41707 833.40704
2875.0000 -152.91238 -146.23914 6.67325 2.49612 -146.32914 820.27013
2880.0000 -153.23896 -145.99999 7.23897 2.50113 -146.24992 808.81362
2885.0000 -152.25594 -145.35959 6.89635 2.55502 -145.39662 846.84922
2890.0000 -154.05467 -147.86119 6.19348 2.44509 -147.13708 783.91819
2895.0000 -153.98197 -147.32868 6.65330 2.39516 -147.92761 747.59259
2900.0000 -152.94515 -147.05295 5.89220 2.41716 -147.57936 751.83850
2905.0000 -155.26953 -149.04897 6.22055 2.41649 -147.58996 775.47154
2910.0000 -154.05410 -147.84036 6.21374 2.30134 -149.41311 695.88001
2915.0000 -154.12228 -146.67658 7.44571 2.39543 -147.92344 769.67650
2920.0000 -152.29255 -145.81494 6.47760 2.53068 -145.78201 832.87039
2925.0000 -152.35888 -145.99620 6.36268 2.49481 -146.34988 802.76161
2930.0000 -153.23435 -144.73678 8.49758 2.52490 -145.87348 817.72809
2935.0000 -153.16826 -144.88406 8.28419 2.61030 -144.52143 855.29958
2940.0000 -153.74043 -146.73223 7.00820 2.54862 -145.49796 822.65383
2945.0000 -154.58294 -148.65983 5.92311 2.39485 -147.93261 730.54178
2950.0000 -153.71907 -147.10590 6.61317 2.35146 -148.61965 743.80481
2955.0000 -153.33624 -146.76160 6.57464 2.50596 -146.17340 841.74425
2960.0000 -152.29613 -146.02359 6.27254 2.48209 -146.55132 801.45921
2965.0000 -152.80085 -146.24223 6.55863 2.48883 -146.44462 809.60673
2970.0000 -152.44979 -145.45851 6.99128 2.53199 -145.76120 834.22721
2975.0000 -153.28217 -146.02503 7.25714 2.55015 -145.47366 873.87902
2980.0000 -152.20985 -147.20146 5.00839 2.45905 -146.91616 804.97433
2985.0000 -153.22377 -146.64092 6.58284 2.45964 -146.90674 802.18288
2990.0000 -152.50323 -145.76146 6.74177 2.53174 -145.76525 863.82159
2995.0000 -153.34628 -147.00993 6.33635 2.49716 -146.31274 775.81691
3000.0000 -153.47673 -147.83562 5.64111 2.46635 -146.80052 773.27000
FREEZING PROCESS: loop number 13 T-loop= 782.00000000000000
main_MD> interactions number 13 at Temperature= 782.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.31557 0.63853 0.87874
force_rgl> df(natom) -3.07320 1.81389 -3.14634
3005.0000 -153.51436 -146.78356 6.73081 2.40046 -147.84371 730.43280
3010.0000 -151.18121 -144.00582 7.17539 2.56252 -145.27793 877.05323
3015.0000 -153.55992 -147.24113 6.31879 2.45671 -146.95316 802.16522
3020.0000 -153.38713 -148.12920 5.25794 2.42743 -147.41669 752.79528
3025.0000 -151.81620 -145.86056 5.95564 2.44344 -147.16327 770.62791
3030.0000 -151.86681 -146.19386 5.67295 2.50110 -146.25031 813.74052
3035.0000 -154.50400 -148.08791 6.41609 2.42387 -147.47317 760.89496
3040.0000 -151.57166 -146.13969 5.43197 2.42828 -147.40328 763.32910
3045.0000 -153.22595 -146.73624 6.48972 2.51116 -146.09108 826.02770
3050.0000 -153.31936 -147.26918 6.05018 2.45976 -146.90488 790.54376
3055.0000 -153.81839 -147.92700 5.89139 2.41075 -147.68078 779.46178
3060.0000 -153.94534 -146.88562 7.05972 2.45285 -147.01430 779.53605
3065.0000 -152.35854 -145.42985 6.92869 2.50669 -146.16176 798.78105
3070.0000 -154.30381 -148.29865 6.00516 2.45239 -147.02154 778.89211
3075.0000 -152.03409 -145.79321 6.24088 2.47220 -146.70797 772.79520
3080.0000 -152.76710 -147.02486 5.74224 2.52360 -145.89413 810.59781
3085.0000 -153.47845 -146.59085 6.88760 2.43822 -147.24592 755.09926
3090.0000 -152.42213 -145.99050 6.43163 2.48650 -146.48143 810.03625
3095.0000 -155.25470 -147.35396 7.90074 2.49084 -146.41272 829.89235
3100.0000 -152.02171 -145.53097 6.49074 2.48442 -146.51442 792.13342
3105.0000 -152.52151 -145.41755 7.10396 2.54273 -145.59129 845.20077
3110.0000 -153.31411 -146.26723 7.04688 2.51717 -145.99595 824.17915
3115.0000 -153.04102 -146.71011 6.33091 2.48755 -146.46480 829.70711
3120.0000 -153.04639 -146.59113 6.45526 2.45158 -147.03445 771.10635
3125.0000 -152.00509 -145.93624 6.06885 2.46429 -146.83322 782.82998
3130.0000 -154.62764 -148.14285 6.48479 2.39859 -147.87337 762.31992
3135.0000 -152.54117 -145.73722 6.80395 2.44484 -147.14115 760.03832
3140.0000 -152.01675 -145.07992 6.93683 2.55408 -145.41147 848.84009
3145.0000 -152.43304 -146.85276 5.58028 2.50469 -146.19358 805.01182
3150.0000 -152.47676 -145.16467 7.31209 2.52433 -145.88262 846.19019
3155.0000 -153.16006 -146.44380 6.71626 2.49008 -146.42488 828.28742
3160.0000 -154.46978 -147.76327 6.70652 2.47626 -146.64364 801.58733
3165.0000 -152.87831 -147.32702 5.55129 2.34989 -148.64441 747.00668
3170.0000 -152.03305 -145.91056 6.12250 2.46363 -146.84364 791.67888
3175.0000 -152.09203 -145.93020 6.16182 2.52463 -145.87787 818.90557
3180.0000 -153.07851 -146.71896 6.35956 2.49033 -146.42092 799.16283
3185.0000 -152.79659 -146.76922 6.02737 2.50194 -146.23708 800.44327
3190.0000 -152.80340 -146.54687 6.25652 2.42805 -147.40698 753.40411
3195.0000 -152.69683 -147.89876 4.79807 2.39750 -147.89067 695.65108
3200.0000 -154.01592 -147.68264 6.33328 2.44609 -147.12126 766.99937
3205.0000 -154.10043 -147.77806 6.32237 2.37300 -148.27861 728.98125
3210.0000 -153.96255 -146.33605 7.62651 2.46848 -146.76678 818.03722
3215.0000 -154.00458 -147.39432 6.61026 2.46416 -146.83523 798.83590
3220.0000 -152.44863 -146.71886 5.72977 2.46395 -146.83854 786.82477
3225.0000 -152.21844 -145.43807 6.78038 2.49995 -146.26854 816.08211
3230.0000 -152.83912 -146.00312 6.83600 2.53871 -145.65483 852.78902
3235.0000 -152.76879 -147.56322 5.20557 2.45970 -146.90585 799.55839
3240.0000 -153.59481 -147.77025 5.82456 2.41746 -147.57454 766.29677
3245.0000 -154.20024 -148.23244 5.96780 2.33960 -148.80733 701.27198
3250.0000 -153.49957 -147.94482 5.55475 2.34645 -148.69893 696.18562
FREEZING PROCESS: loop number 14 T-loop= 757.00000000000000
main_MD> interactions number 14 at Temperature= 757.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.94491 -1.15432 -0.66180
force_rgl> df(natom) -2.90808 -1.25010 0.99160
3255.0000 -153.49219 -147.68465 5.80754 2.40768 -147.72952 735.34104
3260.0000 -153.77509 -147.03631 6.73878 2.41292 -147.64655 754.18695
3265.0000 -153.81478 -147.65327 6.16151 2.41497 -147.61402 764.28479
3270.0000 -153.96954 -147.47769 6.49185 2.39454 -147.93747 768.66335
3275.0000 -153.53257 -147.62413 5.90844 2.41610 -147.59609 760.33333
3280.0000 -153.49263 -147.57216 5.92046 2.42306 -147.48600 759.69557
3285.0000 -153.35186 -146.58158 6.77028 2.43419 -147.30966 760.50691
3290.0000 -154.43622 -147.38745 7.04877 2.45638 -146.95831 790.39258
3295.0000 -153.15484 -146.94530 6.20954 2.44418 -147.15157 787.46569
3300.0000 -154.24361 -148.51433 5.72928 2.41177 -147.66473 794.97878
3305.0000 -154.20168 -147.33466 6.86702 2.40953 -147.70014 761.66772
3310.0000 -152.77685 -146.04807 6.72877 2.47014 -146.74046 797.30870
3315.0000 -153.54376 -146.50523 7.03852 2.49040 -146.41971 833.00820
3320.0000 -151.65754 -144.68936 6.96818 2.56217 -145.28339 880.42330
3325.0000 -151.78316 -144.97158 6.81157 2.59783 -144.71887 860.95796
3330.0000 -153.43376 -147.73277 5.70099 2.49024 -146.42223 801.98663
3335.0000 -154.15384 -148.35145 5.80239 2.35701 -148.53176 706.14386
3340.0000 -152.16915 -146.12291 6.04623 2.40658 -147.74693 761.70525
3345.0000 -153.30555 -146.56346 6.74209 2.48789 -146.45943 830.30276
3350.0000 -153.66840 -147.89198 5.77642 2.47578 -146.65129 796.73366
3355.0000 -153.58035 -147.76366 5.81670 2.38768 -148.04606 740.56701
3360.0000 -154.11115 -148.00764 6.10351 2.42490 -147.45686 789.84313
3365.0000 -154.16120 -148.23033 5.93088 2.40116 -147.83264 732.68438
3370.0000 -155.27928 -149.65783 5.62145 2.32417 -149.05163 719.52676
3375.0000 -153.67644 -148.34913 5.32731 2.34597 -148.70646 720.72391
3380.0000 -153.93467 -148.18337 5.75130 2.39666 -147.90394 753.94727
3385.0000 -153.42644 -147.67975 5.74669 2.42416 -147.46859 772.25959
3390.0000 -153.64411 -147.66965 5.97445 2.43896 -147.23421 753.93373
3395.0000 -153.73802 -147.84320 5.89482 2.38468 -148.09355 726.64501
3400.0000 -155.02269 -148.88703 6.13567 2.41651 -147.58962 765.96649
3405.0000 -154.93645 -149.98727 4.94918 2.35468 -148.56859 696.33705
3410.0000 -153.39490 -147.80372 5.59118 2.34255 -148.76065 722.50938
3415.0000 -153.74584 -148.60894 5.13690 2.38593 -148.07377 741.84612
3420.0000 -152.54229 -146.16001 6.38228 2.42571 -147.44393 733.01471
3425.0000 -153.17672 -146.23209 6.94463 2.48265 -146.54250 806.66618
3430.0000 -153.95978 -147.36108 6.59870 2.46986 -146.74490 803.51791
3435.0000 -153.83154 -148.44673 5.38480 2.35030 -148.63800 738.70988
3440.0000 -154.13203 -147.96200 6.17004 2.41520 -147.61040 753.68692
3445.0000 -154.90624 -148.79082 6.11542 2.32635 -149.01720 672.10257
3450.0000 -153.83872 -148.34550 5.49322 2.34170 -148.77418 706.27252
3455.0000 -153.57962 -147.76999 5.80963 2.39622 -147.91097 760.20498
3460.0000 -153.36368 -146.88694 6.47674 2.44528 -147.13407 782.05308
3465.0000 -154.02987 -148.52349 5.50638 2.40658 -147.74691 747.41039
3470.0000 -155.12958 -148.74911 6.38046 2.31761 -149.15548 711.19459
3475.0000 -154.40777 -149.00802 5.39975 2.33710 -148.84692 740.46083
3480.0000 -155.12369 -148.95945 6.16424 2.33410 -148.89442 725.30669
3485.0000 -153.54671 -147.94263 5.60408 2.36546 -148.39788 712.51839
3490.0000 -154.29510 -148.91594 5.37916 2.35906 -148.49925 710.86456
3495.0000 -153.62451 -148.26891 5.35560 2.36313 -148.43486 745.47382
3500.0000 -154.40536 -149.09538 5.30998 2.38455 -148.09574 721.21809
FREEZING PROCESS: loop number 15 T-loop= 732.00000000000000
main_MD> interactions number 15 at Temperature= 732.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.63199 -0.97106 3.46368
force_rgl> df(natom) 1.69497 2.72853 -1.21832
3505.0000 -153.95747 -147.09570 6.86177 2.38663 -148.06280 744.14726
3510.0000 -153.55698 -147.67184 5.88515 2.38690 -148.05851 733.87935
3515.0000 -153.43981 -147.56941 5.87040 2.39629 -147.90977 765.94347
3520.0000 -154.68196 -149.83022 4.85174 2.36336 -148.43120 709.23163
3525.0000 -154.69804 -149.52875 5.16929 2.30877 -149.29542 678.23271
3530.0000 -153.63849 -147.89124 5.74726 2.30305 -149.38605 682.95118
3535.0000 -152.28554 -145.92596 6.35957 2.44067 -147.20710 774.03105
3540.0000 -151.33672 -144.32036 7.01637 2.57233 -145.12263 855.44129
3545.0000 -153.17210 -146.04601 7.12609 2.58659 -144.89686 865.13864
3550.0000 -154.86733 -148.26277 6.60456 2.46356 -146.84474 797.40443
3555.0000 -155.55859 -150.21136 5.34723 2.33535 -148.87460 695.14812
3560.0000 -155.26263 -149.76742 5.49521 2.23016 -150.54011 632.45054
3565.0000 -155.34911 -149.97712 5.37198 2.28128 -149.73076 684.81779
3570.0000 -156.13140 -150.73204 5.39937 2.24652 -150.28105 654.29625
3575.0000 -153.02788 -147.32944 5.69844 2.28071 -149.73970 655.63927
3580.0000 -152.92466 -147.45050 5.47416 2.44770 -147.09586 773.26418
3585.0000 -154.66407 -148.30086 6.36320 2.37193 -148.29552 730.40968
3590.0000 -155.39057 -149.20554 6.18503 2.37484 -148.24933 731.85917
3595.0000 -155.33654 -149.11642 6.22012 2.32842 -148.98443 701.17514
3600.0000 -154.41974 -150.15432 4.26542 2.28709 -149.63876 664.08922
3605.0000 -154.54687 -149.74823 4.79864 2.25979 -150.07091 621.12799
3610.0000 -155.64937 -150.31575 5.33362 2.30101 -149.41829 686.95335
3615.0000 -155.70741 -149.79586 5.91154 2.27690 -149.80001 680.26367
3620.0000 -154.49677 -148.91935 5.57742 2.27992 -149.75224 686.49594
3625.0000 -155.17394 -148.71583 6.45811 2.29747 -149.47436 701.95305
3630.0000 -154.92222 -149.03252 5.88970 2.34794 -148.67534 700.47789
3635.0000 -154.07379 -148.43976 5.63404 2.35058 -148.63344 709.74743
3640.0000 -154.26536 -149.03156 5.23380 2.35699 -148.53202 704.88678
3645.0000 -154.61292 -147.67459 6.93833 2.35985 -148.48670 732.57353
3650.0000 -154.90667 -148.50113 6.40554 2.37253 -148.28601 750.51133
3655.0000 -155.29056 -149.60032 5.69024 2.31052 -149.26773 668.58337
3660.0000 -155.04910 -149.53635 5.51275 2.29421 -149.52603 675.58202
3665.0000 -153.58517 -148.46318 5.12199 2.33696 -148.84922 724.10071
3670.0000 -154.96995 -148.22945 6.74049 2.35601 -148.54748 738.82361
3675.0000 -156.07347 -150.36034 5.71313 2.33233 -148.92245 714.55903
3680.0000 -155.16703 -149.73343 5.43360 2.23921 -150.39687 663.26049
3685.0000 -155.13196 -150.26029 4.87167 2.26004 -150.06708 689.30705
3690.0000 -155.65984 -149.23872 6.42112 2.26401 -150.00421 670.23215
3695.0000 -153.17757 -147.52286 5.65471 2.34243 -148.76256 698.15841
3700.0000 -152.97493 -147.27694 5.69799 2.44548 -147.13091 766.71282
3705.0000 -153.42191 -146.69822 6.72369 2.44377 -147.15808 796.68143
3710.0000 -153.72559 -147.92703 5.79855 2.45020 -147.05616 767.99480
3715.0000 -154.61164 -148.91522 5.69642 2.36013 -148.48230 715.93378
3720.0000 -155.36467 -149.53144 5.83323 2.33334 -148.90646 705.69277
3725.0000 -154.56451 -148.66693 5.89758 2.30276 -149.39067 701.07173
3730.0000 -153.86237 -147.02601 6.83635 2.38303 -148.11980 741.73298
3735.0000 -153.28188 -148.12706 5.15482 2.41580 -147.60092 747.61698
3740.0000 -153.56594 -148.17615 5.38979 2.38448 -148.09684 735.01960
3745.0000 -153.67179 -146.91304 6.75875 2.40298 -147.80387 765.95714
3750.0000 -153.94166 -148.30403 5.63763 2.42859 -147.39842 732.83184
FREEZING PROCESS: loop number 16 T-loop= 707.00000000000000
main_MD> interactions number 16 at Temperature= 707.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.85922 1.21208 1.33801
force_rgl> df(natom) -1.13500 -1.63096 1.86960
3755.0000 -153.58777 -147.65728 5.93049 2.39641 -147.90793 719.08627
3760.0000 -154.39698 -148.18693 6.21005 2.38468 -148.09356 736.62910
3765.0000 -153.99316 -148.44677 5.54640 2.36879 -148.34521 753.86811
3770.0000 -154.77164 -149.12334 5.64830 2.34469 -148.72680 698.35587
3775.0000 -153.73317 -147.70038 6.03279 2.33279 -148.91511 692.04840
3780.0000 -154.80631 -149.11791 5.68839 2.35370 -148.58409 733.71559
3785.0000 -154.63488 -147.96479 6.67009 2.34662 -148.69623 741.43838
3790.0000 -153.80810 -147.24684 6.56127 2.40006 -147.85012 746.21731
3795.0000 -153.92281 -148.51897 5.40384 2.40974 -147.69679 718.85556
3800.0000 -155.03416 -150.24444 4.78972 2.34959 -148.64923 716.92436
3805.0000 -154.40836 -149.03618 5.37218 2.30012 -149.43243 679.29556
3810.0000 -154.49741 -147.22186 7.27555 2.39784 -147.88531 723.36576
3815.0000 -153.06751 -147.19530 5.87221 2.43347 -147.32117 753.98400
3820.0000 -154.57415 -148.42479 6.14937 2.44280 -147.17342 745.29342
3825.0000 -154.82991 -149.54139 5.28852 2.31307 -149.22735 679.04738
3830.0000 -155.59145 -150.23611 5.35535 2.27742 -149.79189 655.45830
3835.0000 -155.62990 -150.32316 5.30674 2.25812 -150.09750 647.74263
3840.0000 -153.81865 -148.54744 5.27121 2.28338 -149.69749 671.36493
3845.0000 -153.38959 -147.16917 6.22042 2.38989 -148.01112 725.76744
3850.0000 -153.42781 -148.21377 5.21404 2.41811 -147.56429 759.78758
3855.0000 -154.35429 -149.16232 5.19197 2.35852 -148.50785 713.76401
3860.0000 -154.59733 -149.63674 4.96058 2.27132 -149.88850 664.86106
3865.0000 -155.64779 -149.90869 5.73910 2.25700 -150.11517 670.12568
3870.0000 -155.41233 -149.92433 5.48800 2.29638 -149.49163 682.23188
3875.0000 -154.43965 -150.11246 4.32719 2.22608 -150.60469 621.71605
3880.0000 -154.11395 -148.56831 5.54565 2.28245 -149.71218 652.79177
3885.0000 -151.92796 -146.28622 5.64173 2.41166 -147.66642 735.54328
3890.0000 -154.96037 -149.21746 5.74291 2.36513 -148.40307 703.02489
3895.0000 -155.20885 -149.42855 5.78030 2.24852 -150.24946 638.33009
3900.0000 -156.06869 -149.82686 6.24184 2.30763 -149.31350 690.76882
3905.0000 -154.92009 -148.81616 6.10393 2.30433 -149.36580 706.05284
3910.0000 -154.69077 -148.83564 5.85513 2.34158 -148.77601 703.99435
3915.0000 -155.05133 -149.20865 5.84268 2.34166 -148.77474 705.59824
3920.0000 -154.96861 -148.64202 6.32658 2.34348 -148.74591 705.62187
3925.0000 -154.26258 -149.10842 5.15416 2.36752 -148.36535 726.37792
3930.0000 -154.84948 -148.46843 6.38105 2.34816 -148.67176 692.66636
3935.0000 -153.82044 -148.08129 5.73915 2.37448 -148.25515 725.64098
3940.0000 -154.46706 -148.17545 6.29160 2.33954 -148.80831 722.32018
3945.0000 -153.96428 -148.90825 5.05604 2.38804 -148.04046 697.66798
3950.0000 -153.92245 -147.38209 6.54036 2.37855 -148.19065 703.88431
3955.0000 -153.53419 -147.49845 6.03574 2.45089 -147.04529 771.49295
3960.0000 -155.08134 -149.80087 5.28047 2.32591 -149.02405 676.53606
3965.0000 -155.58172 -149.31980 6.26192 2.30240 -149.39641 714.63815
3970.0000 -155.84007 -150.49241 5.34766 2.24744 -150.26652 655.56760
3975.0000 -154.46442 -149.31560 5.14883 2.26425 -150.00036 636.80426
3980.0000 -154.23215 -149.75562 4.47653 2.27166 -149.88299 653.15312
3985.0000 -153.97442 -148.05457 5.91986 2.35082 -148.62976 720.28494
3990.0000 -155.62802 -149.62914 5.99887 2.37381 -148.26569 731.76294
3995.0000 -155.44597 -149.59183 5.85414 2.27804 -149.78202 633.38737
4000.0000 -154.28973 -148.56637 5.72336 2.30079 -149.42181 693.00290
FREEZING PROCESS: loop number 17 T-loop= 682.00000000000000
main_MD> interactions number 17 at Temperature= 682.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.82882 1.61961 3.15607
force_rgl> df(natom) -1.65854 -0.55608 6.52444
4005.0000 -155.76748 -150.03920 5.72827 2.33138 -148.93748 719.89512
4010.0000 -156.35695 -151.73563 4.62132 2.22829 -150.56972 657.82821
4015.0000 -155.40900 -150.03585 5.37315 2.17145 -151.46972 595.75098
4020.0000 -156.00078 -150.21579 5.78500 2.28107 -149.73412 665.57917
4025.0000 -156.55077 -152.22415 4.32662 2.18278 -151.29021 584.25266
4030.0000 -156.07728 -150.94470 5.13258 2.17541 -151.40703 593.55406
4035.0000 -154.89847 -150.63453 4.26395 2.19285 -151.13080 562.15725
4040.0000 -155.69648 -150.81879 4.87769 2.19585 -151.08330 608.14287
4045.0000 -155.84138 -150.49539 5.34599 2.21235 -150.82208 621.74439
4050.0000 -154.99516 -150.35152 4.64364 2.26436 -149.99858 660.55271
4055.0000 -156.40271 -151.22358 5.17912 2.20133 -150.99661 603.53244
4060.0000 -155.84940 -151.18893 4.66046 2.16397 -151.58808 586.62719
4065.0000 -155.76475 -150.39606 5.36869 2.18314 -151.28453 597.92646
4070.0000 -155.27288 -150.00045 5.27243 2.24004 -150.38375 650.74189
4075.0000 -155.54097 -149.48788 6.05309 2.28300 -149.70357 691.47991
4080.0000 -155.38631 -149.26951 6.11680 2.30664 -149.32914 683.72562
4085.0000 -153.34409 -147.80897 5.53512 2.38647 -148.06534 740.87705
4090.0000 -154.43846 -148.78260 5.65586 2.36727 -148.36933 725.10202
4095.0000 -153.66788 -147.87413 5.79375 2.35875 -148.50419 716.68158
4100.0000 -155.03530 -149.43645 5.59885 2.31708 -149.16386 694.16669
4105.0000 -154.01190 -147.93494 6.07696 2.35962 -148.49037 734.27540
4110.0000 -155.61716 -149.87720 5.73997 2.35875 -148.50422 733.45807
4115.0000 -155.44263 -149.56076 5.88187 2.30328 -149.38241 687.21634
4120.0000 -154.89431 -148.68995 6.20436 2.28477 -149.67552 691.23654
4125.0000 -154.39462 -149.43548 4.95914 2.31874 -149.13768 682.53827
4130.0000 -153.93433 -147.86411 6.07021 2.33617 -148.86171 726.70862
4135.0000 -154.24851 -147.74052 6.50799 2.44514 -147.13628 791.47908
4140.0000 -152.40090 -147.16956 5.23134 2.44192 -147.18741 755.66187
4145.0000 -155.78968 -149.75475 6.03494 2.36592 -148.39064 739.11506
4150.0000 -155.87114 -150.57161 5.29952 2.23773 -150.42030 641.77155
4155.0000 -155.11565 -150.85311 4.26254 2.21901 -150.71660 633.72126
4160.0000 -154.34776 -148.61572 5.73204 2.27387 -149.84806 632.98176
4165.0000 -156.12497 -150.36448 5.76049 2.32791 -148.99244 682.32563
4170.0000 -155.09710 -148.59197 6.50513 2.29445 -149.52219 671.28620
4175.0000 -154.00388 -147.19301 6.81087 2.38058 -148.15846 723.94843
4180.0000 -154.84649 -147.97083 6.87566 2.43727 -147.26093 792.00077
4185.0000 -154.71018 -149.64138 5.06881 2.34634 -148.70064 725.09737
4190.0000 -156.51565 -150.31827 6.19738 2.24195 -150.35337 652.79931
4195.0000 -153.95373 -148.28156 5.67217 2.32435 -149.04881 695.47595
4200.0000 -153.94382 -148.28168 5.66214 2.37574 -148.23522 730.58336
4205.0000 -154.10648 -148.96298 5.14350 2.37403 -148.26215 721.56087
4210.0000 -153.97212 -148.43355 5.53857 2.32633 -149.01749 705.93564
4215.0000 -154.27223 -147.53962 6.73262 2.39950 -147.85904 739.95354
4220.0000 -154.69855 -149.73542 4.96313 2.34765 -148.67995 706.53170
4225.0000 -154.90783 -149.84653 5.06130 2.28934 -149.60309 672.61779
4230.0000 -154.40846 -149.24368 5.16478 2.30187 -149.40468 708.56758
4235.0000 -153.10184 -147.26370 5.83814 2.34232 -148.76423 756.35653
4240.0000 -154.34401 -147.51721 6.82680 2.43689 -147.26703 783.57522
4245.0000 -154.64274 -148.27156 6.37117 2.39926 -147.86275 728.59775
4250.0000 -155.11691 -149.96023 5.15668 2.28750 -149.63231 682.93733
FREEZING PROCESS: loop number 18 T-loop= 657.00000000000000
main_MD> interactions number 18 at Temperature= 657.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.08092 -0.06281 -5.74022
force_rgl> df(natom) -0.17895 0.06152 -1.59060
4255.0000 -155.86878 -150.21627 5.65251 2.28410 -149.68611 663.84651
4260.0000 -154.97587 -149.83846 5.13741 2.23014 -150.54041 602.46989
4265.0000 -156.33402 -150.45129 5.88272 2.26992 -149.91057 665.79483
4270.0000 -154.81503 -148.74792 6.06710 2.30452 -149.36279 692.55164
4275.0000 -154.45973 -148.88524 5.57449 2.31772 -149.15385 699.34288
4280.0000 -156.08803 -150.64809 5.43993 2.28888 -149.61038 645.05567
4285.0000 -155.98298 -150.91526 5.06772 2.22876 -150.56224 611.41728
4290.0000 -154.37900 -150.11138 4.26762 2.20412 -150.95242 599.87331
4295.0000 -155.56140 -150.74614 4.81526 2.26406 -150.00337 662.47975
4300.0000 -155.07761 -150.37440 4.70321 2.22344 -150.64644 607.18755
4305.0000 -154.99085 -149.08899 5.90186 2.30001 -149.43411 708.84555
4310.0000 -154.80735 -149.46448 5.34287 2.31810 -149.14782 679.05618
4315.0000 -155.87736 -150.48151 5.39584 2.24933 -150.23655 646.36479
4320.0000 -155.63495 -150.54560 5.08935 2.22248 -150.66167 628.43102
4325.0000 -154.67740 -149.43092 5.24647 2.27187 -149.87967 649.97543
4330.0000 -155.11449 -148.59000 6.52449 2.33325 -148.90782 708.43786
4335.0000 -154.64156 -148.82173 5.81983 2.35770 -148.52071 749.91016
4340.0000 -155.33803 -149.15450 6.18353 2.34791 -148.67579 727.61835
4345.0000 -154.77320 -148.10864 6.66456 2.32664 -149.01261 663.03498
4350.0000 -153.01845 -147.18433 5.83412 2.40533 -147.76669 756.62317
4355.0000 -154.16168 -149.00120 5.16047 2.37735 -148.20962 720.30494
4360.0000 -155.32745 -149.22888 6.09857 2.33493 -148.88136 670.27092
4365.0000 -155.67831 -148.88479 6.79352 2.32430 -149.04958 678.37373
4370.0000 -156.00267 -151.85886 4.14382 2.20478 -150.94196 607.95050
4375.0000 -155.88571 -151.18608 4.69964 2.15285 -151.76412 583.17197
4380.0000 -155.75269 -150.13238 5.62031 2.20166 -150.99128 632.36367
4385.0000 -154.80121 -149.67229 5.12892 2.28872 -149.61291 692.94705
4390.0000 -154.60677 -148.99281 5.61396 2.33305 -148.91101 690.45899
4395.0000 -154.02173 -148.21082 5.81091 2.35664 -148.53756 711.13017
4400.0000 -155.29329 -149.50896 5.78432 2.35286 -148.59741 712.51932
4405.0000 -156.90643 -151.52591 5.38051 2.21213 -150.82550 628.09654
4410.0000 -156.71206 -152.00974 4.70232 2.15242 -151.77099 594.01784
4415.0000 -155.33142 -150.43324 4.89818 2.19363 -151.11846 607.81315
4420.0000 -155.68977 -150.25543 5.43434 2.24988 -150.22795 640.07724
4425.0000 -154.84685 -149.00129 5.84556 2.25951 -150.07541 657.26398
4430.0000 -155.67379 -150.36900 5.30479 2.30345 -149.37968 675.78561
4435.0000 -155.72824 -151.00091 4.72732 2.19220 -151.14105 623.07868
4440.0000 -156.11727 -150.96558 5.15169 2.18506 -151.25422 623.19762
4445.0000 -155.19756 -150.18568 5.01189 2.25103 -150.20963 653.62000
4450.0000 -155.26265 -149.05331 6.20935 2.25442 -150.15601 643.08176
4455.0000 -154.70371 -149.07224 5.63147 2.33671 -148.85311 687.84665
4460.0000 -154.16843 -148.56935 5.59908 2.34982 -148.64553 720.39877
4465.0000 -156.04284 -150.71718 5.32566 2.24384 -150.32357 628.74903
4470.0000 -155.72160 -149.93106 5.79054 2.24073 -150.37269 665.25824
4475.0000 -155.02519 -149.85203 5.17316 2.25916 -150.08090 629.65152
4480.0000 -155.55832 -150.08859 5.46973 2.29350 -149.53725 653.49952
4485.0000 -156.22257 -151.43754 4.78503 2.20879 -150.87852 605.36319
4490.0000 -155.61077 -151.55312 4.05765 2.16244 -151.61228 585.06808
4495.0000 -155.29059 -150.06303 5.22755 2.24755 -150.26471 644.32990
4500.0000 -156.62415 -151.24318 5.38097 2.25924 -150.07967 621.76143
FREEZING PROCESS: loop number 19 T-loop= 632.00000000000000
main_MD> interactions number 19 at Temperature= 632.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.08905 2.36826 2.09975
force_rgl> df(natom) -0.78538 1.54066 -1.44307
4505.0000 -156.29757 -151.30858 4.98899 2.18955 -151.18314 602.38836
4510.0000 -156.26220 -152.62662 3.63558 2.13666 -152.02047 559.87249
4515.0000 -155.91130 -149.54292 6.36838 2.16258 -151.61017 590.82027
4520.0000 -155.01775 -148.71405 6.30370 2.31086 -149.26242 698.17592
4525.0000 -154.10337 -148.16943 5.93394 2.34336 -148.74780 710.33334
4530.0000 -155.73684 -150.76129 4.97555 2.29908 -149.44892 691.67547
4535.0000 -156.33572 -151.36364 4.97209 2.17941 -151.34355 588.15250
4540.0000 -157.36004 -151.57394 5.78610 2.16372 -151.59200 558.61883
4545.0000 -156.51833 -151.71792 4.80041 2.17139 -151.47062 605.35210
4550.0000 -156.21345 -151.85572 4.35773 2.17183 -151.46370 590.89020
4555.0000 -156.62748 -151.80911 4.81837 2.16145 -151.62793 593.38759
4560.0000 -156.03552 -150.75015 5.28537 2.16210 -151.61762 600.91550
4565.0000 -155.60545 -150.62192 4.98354 2.20863 -150.88101 633.27322
4570.0000 -155.13625 -149.94213 5.19412 2.23662 -150.43788 623.86019
4575.0000 -154.11163 -149.72239 4.38924 2.28891 -149.60999 657.51405
4580.0000 -154.93318 -149.59584 5.33734 2.25724 -150.11133 650.94297
4585.0000 -155.00220 -149.97975 5.02245 2.31501 -149.19665 698.05624
4590.0000 -155.32342 -150.46250 4.86093 2.29799 -149.46617 636.49251
4595.0000 -155.03335 -149.89839 5.13496 2.22637 -150.60013 604.13331
4600.0000 -153.95703 -148.91195 5.04508 2.34345 -148.74640 708.93636
4605.0000 -155.89736 -150.09546 5.80189 2.27378 -149.84948 668.77837
4610.0000 -154.81604 -150.02800 4.78804 2.23265 -150.50061 624.69679
4615.0000 -154.06184 -148.67494 5.38690 2.31812 -149.14745 680.02263
4620.0000 -155.83613 -150.81586 5.02027 2.28744 -149.63317 679.34975
4625.0000 -155.02830 -148.73685 6.29146 2.29400 -149.52933 668.35088
4630.0000 -155.27618 -149.96532 5.31086 2.31181 -149.24740 667.93467
4635.0000 -155.41218 -150.57249 4.83969 2.24020 -150.38114 635.78254
4640.0000 -155.65176 -150.36364 5.28812 2.21462 -150.78622 596.71787
4645.0000 -155.75432 -150.54733 5.20699 2.24373 -150.32526 644.61224
4650.0000 -155.67522 -150.25213 5.42309 2.25056 -150.21707 629.61539
4655.0000 -155.15188 -150.20355 4.94833 2.22499 -150.62201 627.37882
4660.0000 -155.68546 -150.38596 5.29950 2.23395 -150.48014 613.69621
4665.0000 -155.46695 -150.20603 5.26092 2.25257 -150.18537 623.23414
4670.0000 -155.01078 -149.26781 5.74297 2.24994 -150.22694 626.30395
4675.0000 -155.47034 -150.54779 4.92255 2.24024 -150.38055 647.66459
4680.0000 -156.33036 -150.85600 5.47435 2.24318 -150.33391 665.45918
4685.0000 -157.00278 -150.61710 6.38568 2.26295 -150.02088 682.71050
4690.0000 -155.84886 -151.55534 4.29352 2.19405 -151.11186 628.47615
4695.0000 -156.74290 -150.98358 5.75932 2.15702 -151.69815 585.95868
4700.0000 -156.72229 -151.77328 4.94902 2.17078 -151.48032 596.53300
4705.0000 -155.58751 -150.84137 4.74613 2.19223 -151.14067 612.62862
4710.0000 -155.35517 -149.98305 5.37213 2.22912 -150.55650 644.08742
4715.0000 -154.88918 -149.00122 5.88796 2.28802 -149.62405 666.94350
4720.0000 -154.20852 -148.83663 5.37189 2.34921 -148.65518 710.73434
4725.0000 -155.08121 -149.41769 5.66353 2.33076 -148.94729 683.13398
4730.0000 -155.74290 -150.59046 5.15244 2.28370 -149.69239 662.47362
4735.0000 -154.87055 -149.56748 5.30307 2.27205 -149.87688 683.38927
4740.0000 -156.11493 -150.60115 5.51378 2.25363 -150.16853 657.83127
4745.0000 -155.63799 -150.09450 5.54349 2.25676 -150.11892 640.43421
4750.0000 -154.89259 -149.16835 5.72424 2.29285 -149.54748 656.21002
FREEZING PROCESS: loop number 20 T-loop= 607.00000000000000
main_MD> interactions number 20 at Temperature= 607.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.12842 0.37369 0.60951
force_rgl> df(natom) -0.98501 0.81173 -0.55145
4755.0000 -155.45712 -149.98636 5.47077 2.29295 -149.54594 667.51021
4760.0000 -156.23101 -150.69683 5.53418 2.26740 -149.95047 666.34287
4765.0000 -155.44749 -149.90350 5.54400 2.24500 -150.30509 647.36868
4770.0000 -156.14643 -150.48590 5.66053 2.22068 -150.69025 617.04720
4775.0000 -156.65600 -152.32277 4.33323 2.18767 -151.21291 595.42006
4780.0000 -155.78711 -150.71427 5.07284 2.19333 -151.12330 620.01023
4785.0000 -156.27560 -151.92108 4.35452 2.18509 -151.25364 594.44528
4790.0000 -155.78060 -151.02194 4.75867 2.17299 -151.44530 552.83433
4795.0000 -155.66127 -150.84229 4.81897 2.20067 -151.00710 589.34576
4800.0000 -155.79772 -150.82631 4.97140 2.21616 -150.76171 604.23187
4805.0000 -155.75424 -149.51791 6.23633 2.25117 -150.20746 634.06337
4810.0000 -155.59489 -151.00557 4.58932 2.24351 -150.32878 633.98891
4815.0000 -156.89815 -151.41474 5.48341 2.19906 -151.03246 603.82056
4820.0000 -156.81013 -152.32257 4.48756 2.13751 -152.00700 562.93950
4825.0000 -157.47463 -152.40751 5.06712 2.11604 -152.34700 581.86149
4830.0000 -156.64801 -151.92038 4.72763 2.10321 -152.55004 556.20198
4835.0000 -156.53562 -151.72733 4.80829 2.14561 -151.87877 589.37177
4840.0000 -156.05591 -150.53789 5.51802 2.19873 -151.03777 633.83981
4845.0000 -156.03080 -151.15039 4.88041 2.22035 -150.69550 637.13928
4850.0000 -155.42316 -149.92795 5.49521 2.20245 -150.97880 590.15894
4855.0000 -156.26589 -151.59264 4.67325 2.21495 -150.78087 622.81859
4860.0000 -156.54786 -151.88289 4.66496 2.13880 -151.98658 575.27754
4865.0000 -156.81008 -152.73347 4.07661 2.11844 -152.30889 540.77293
4870.0000 -156.55465 -152.37342 4.18123 2.09164 -152.73329 529.53055
4875.0000 -156.53433 -151.23562 5.29871 2.13014 -152.12365 563.87779
4880.0000 -155.45432 -150.27113 5.18319 2.22632 -150.60089 633.46090
4885.0000 -155.01200 -150.48957 4.52244 2.28706 -149.63928 661.96327
4890.0000 -156.68427 -151.86457 4.81970 2.17672 -151.38615 588.77344
4895.0000 -157.95934 -153.02956 4.92978 2.11043 -152.43578 566.39502
4900.0000 -157.06114 -152.24864 4.81251 2.15606 -151.71329 603.59481
4905.0000 -155.72985 -151.53658 4.19327 2.12966 -152.13131 582.06767
4910.0000 -156.62157 -152.69890 3.92266 2.11293 -152.39618 593.02369
4915.0000 -157.04635 -152.31427 4.73208 2.07337 -153.02262 565.60070
4920.0000 -156.57532 -151.38212 5.19320 2.09076 -152.74720 563.31366
4925.0000 -156.81244 -151.97489 4.83755 2.15276 -151.76559 579.35833
4930.0000 -155.52323 -151.41319 4.11004 2.17393 -151.43036 596.23462
4935.0000 -156.36482 -151.55216 4.81266 2.19532 -151.09166 627.24005
4940.0000 -156.88336 -151.84195 5.04141 2.19103 -151.15965 619.51805
4945.0000 -156.43577 -151.89083 4.54494 2.14271 -151.92464 569.08431
4950.0000 -155.87530 -150.78815 5.08715 2.19213 -151.14231 607.50494
4955.0000 -156.06561 -151.05138 5.01423 2.20046 -151.01027 612.54981
4960.0000 -155.67883 -150.86117 4.81765 2.21034 -150.85389 638.61522
4965.0000 -156.54464 -151.08119 5.46344 2.19971 -151.02215 622.11520
4970.0000 -155.01915 -150.08425 4.93490 2.21677 -150.75214 626.54108
4975.0000 -156.26311 -150.75027 5.51283 2.24754 -150.26486 657.86138
4980.0000 -155.46088 -149.54392 5.91696 2.23685 -150.43413 622.67563
4985.0000 -156.44373 -151.02166 5.42207 2.27214 -149.87538 651.26946
4990.0000 -155.27586 -151.13391 4.14195 2.19284 -151.13106 594.45807
4995.0000 -157.49956 -151.92970 5.56986 2.12387 -152.22299 563.80915
5000.0000 -157.02844 -152.08136 4.94708 2.12022 -152.28072 570.27338
FREEZING PROCESS: loop number 21 T-loop= 582.00000000000000
main_MD> interactions number 21 at Temperature= 582.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.43267 -1.35489 -2.93686
force_rgl> df(natom) 0.83559 -0.46018 0.70463
5005.0000 -157.10934 -152.01057 5.09877 2.14422 -151.90086 569.61127
5010.0000 -155.57401 -151.75096 3.82305 2.16479 -151.57517 589.29176
5015.0000 -156.68425 -151.08095 5.60330 2.17811 -151.36421 599.12559
5020.0000 -156.92720 -152.49828 4.42891 2.15559 -151.72076 577.95259
5025.0000 -156.84255 -151.58420 5.25835 2.11899 -152.30026 553.55925
5030.0000 -156.79853 -152.32650 4.47203 2.14094 -151.95275 566.90535
5035.0000 -156.86011 -152.67476 4.18535 2.09938 -152.61071 535.51983
5040.0000 -156.90841 -152.51018 4.39822 2.08353 -152.86164 538.79954
5045.0000 -156.51433 -151.01433 5.50000 2.15516 -151.72758 587.66180
5050.0000 -157.38578 -152.92422 4.46157 2.15812 -151.68074 603.39651
5055.0000 -157.51089 -153.39191 4.11898 2.06432 -153.16583 540.77702
5060.0000 -156.77814 -151.82488 4.95326 2.14571 -151.87723 603.70706
5065.0000 -156.90304 -151.71425 5.18879 2.16537 -151.56598 597.48955
5070.0000 -157.93199 -153.51393 4.41806 2.10694 -152.49106 570.21084
5075.0000 -158.03010 -153.41826 4.61184 2.02559 -153.77909 515.98460
5080.0000 -157.05181 -152.70956 4.34225 2.08221 -152.88262 566.26078
5085.0000 -157.06516 -152.14549 4.91967 2.12075 -152.27240 588.16848
5090.0000 -157.06855 -151.84422 5.22433 2.16394 -151.58855 596.91842
5095.0000 -157.09816 -151.79303 5.30513 2.17992 -151.33553 591.75556
5100.0000 -156.23140 -150.98059 5.25082 2.20304 -150.96952 611.31766
5105.0000 -156.21257 -151.72257 4.49000 2.19168 -151.14942 584.23847
5110.0000 -155.45690 -151.20909 4.24781 2.19113 -151.15812 608.47670
5115.0000 -156.84958 -151.83814 5.01144 2.16142 -151.62851 592.26631
5120.0000 -156.43961 -151.05170 5.38791 2.16769 -151.52912 587.34599
5125.0000 -156.64016 -151.31413 5.32603 2.17048 -151.48499 619.55126
5130.0000 -157.36466 -152.02185 5.34281 2.14353 -151.91177 612.33183
5135.0000 -158.82913 -153.91757 4.91156 2.06061 -153.22465 561.79778
5140.0000 -158.34132 -154.34149 3.99983 2.01085 -154.01243 513.54700
5145.0000 -157.88887 -153.47091 4.41796 1.98533 -154.41648 503.47818
5150.0000 -157.06130 -152.84424 4.21705 2.04007 -153.54980 538.82381
5155.0000 -157.37095 -153.13235 4.23861 2.06757 -153.11434 523.13827
5160.0000 -156.72420 -151.99103 4.73317 2.11436 -152.37356 563.55375
5165.0000 -156.49970 -152.05996 4.43974 2.14608 -151.87127 582.83948
5170.0000 -156.92030 -152.25312 4.66719 2.11813 -152.31393 553.75284
5175.0000 -156.71092 -151.73371 4.97721 2.09700 -152.64842 538.32756
5180.0000 -156.87081 -152.70559 4.16522 2.10639 -152.49977 555.55404
5185.0000 -157.38492 -152.57671 4.80821 2.09099 -152.74364 549.25855
5190.0000 -157.59069 -153.24488 4.34580 2.08468 -152.84350 539.74991
5195.0000 -157.74383 -152.85241 4.89142 2.04855 -153.41549 524.14909
5200.0000 -158.35250 -152.48911 5.86340 2.13261 -152.08462 615.81643
5205.0000 -156.84172 -152.26458 4.57714 2.09467 -152.68530 562.71994
5210.0000 -156.98655 -152.41101 4.57555 2.12410 -152.21938 588.88594
5215.0000 -156.22417 -151.52448 4.69969 2.14868 -151.83019 616.27591
5220.0000 -157.15022 -152.40536 4.74486 2.11896 -152.30072 573.73606
5225.0000 -157.19185 -152.84386 4.34799 2.09566 -152.66971 562.74488
5230.0000 -156.70459 -151.51489 5.18970 2.13115 -152.10767 593.14195
5235.0000 -157.17228 -152.40871 4.76357 2.13035 -152.12045 586.34106
5240.0000 -156.79108 -151.84931 4.94177 2.14167 -151.94123 595.54761
5245.0000 -157.34861 -152.93155 4.41706 2.13280 -152.08160 552.66125
5250.0000 -157.72625 -153.31933 4.40692 2.07978 -152.92103 541.68247
FREEZING PROCESS: loop number 22 T-loop= 557.00000000000000
main_MD> interactions number 22 at Temperature= 557.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.45164 0.39056 0.28311
force_rgl> df(natom) 1.14840 -0.77943 0.72208
5255.0000 -156.41722 -152.09591 4.32131 2.12548 -152.19755 583.35244
5260.0000 -156.53125 -152.02019 4.51106 2.13261 -152.08459 562.70170
5265.0000 -155.64866 -150.57081 5.07785 2.17844 -151.35893 610.59351
5270.0000 -156.60770 -150.55435 6.05335 2.20346 -150.96283 632.26369
5275.0000 -157.18427 -152.33433 4.84994 2.15712 -151.69646 596.13030
5280.0000 -157.25191 -153.42254 3.82937 2.07336 -153.02265 528.17408
5285.0000 -156.98906 -152.88233 4.10673 2.06978 -153.07933 514.01714
5290.0000 -156.79519 -152.66799 4.12720 2.07915 -152.93104 525.98302
5295.0000 -156.09950 -152.39309 3.70642 2.11414 -152.37710 558.42239
5300.0000 -157.51328 -152.59114 4.92214 2.12771 -152.16223 603.16632
5305.0000 -158.26552 -153.96943 4.29609 2.07188 -153.04609 533.44777
5310.0000 -157.15895 -152.12188 5.03707 2.09838 -152.62654 563.87132
5315.0000 -156.37553 -151.94040 4.43512 2.17893 -151.35121 609.09825
5320.0000 -156.58651 -152.07148 4.51502 2.14048 -151.95993 577.95750
5325.0000 -156.74979 -152.06856 4.68123 2.14239 -151.92982 567.10940
5330.0000 -156.31062 -151.55015 4.76047 2.15918 -151.66394 579.95893
5335.0000 -157.16680 -152.10862 5.05818 2.15108 -151.79224 580.83045
5340.0000 -158.04637 -153.28967 4.75670 2.08696 -152.80738 556.31442
5345.0000 -157.32784 -153.07355 4.25429 2.07306 -153.02744 528.71232
5350.0000 -157.29911 -153.42098 3.87813 2.05151 -153.36862 503.42705
5355.0000 -157.36577 -153.09662 4.26915 2.03325 -153.65774 507.11593
5360.0000 -157.49719 -153.12702 4.37017 2.08826 -152.78682 567.01055
5365.0000 -157.34121 -153.29413 4.04708 2.04225 -153.51525 531.80051
5370.0000 -158.77789 -154.85107 3.92682 2.00464 -154.11066 519.28926
5375.0000 -158.99027 -154.89949 4.09077 1.96873 -154.67938 486.40865
5380.0000 -158.54889 -154.76598 3.78291 1.95897 -154.83385 476.23760
5385.0000 -157.86814 -153.17281 4.69533 2.03229 -153.67291 527.91565
5390.0000 -159.04023 -154.64399 4.39624 2.01348 -153.97074 512.67611
5395.0000 -159.06784 -155.16131 3.90653 1.95879 -154.83660 476.49900
5400.0000 -158.18493 -153.65477 4.53016 2.01959 -153.87399 515.56014
5405.0000 -158.58262 -154.58993 3.99269 2.02519 -153.78542 514.60058
5410.0000 -158.82445 -155.01619 3.80826 1.95026 -154.97175 462.15697
5415.0000 -157.54374 -153.02277 4.52097 2.01118 -154.00725 515.90043
5420.0000 -158.35948 -153.74698 4.61250 2.06567 -153.14450 568.30334
5425.0000 -158.17620 -154.02715 4.14905 2.02053 -153.85917 517.97628
5430.0000 -157.59402 -153.81506 3.77896 2.02066 -153.85711 499.05598
5435.0000 -157.10869 -153.15632 3.95237 2.03383 -153.64860 515.04770
5440.0000 -157.95693 -153.39428 4.56265 2.05249 -153.35309 533.27869
5445.0000 -157.11840 -153.64142 3.47698 2.06596 -153.13985 554.88100
5450.0000 -157.80244 -153.82742 3.97502 2.01596 -153.93151 526.46537
5455.0000 -158.54255 -153.77827 4.76428 2.01749 -153.90734 520.97317
5460.0000 -157.93689 -153.07994 4.85695 2.04881 -153.41144 539.45676
5465.0000 -157.44012 -153.14784 4.29228 2.08196 -152.88650 546.44465
5470.0000 -157.05464 -151.97546 5.07918 2.10840 -152.46791 578.82659
5475.0000 -156.50323 -151.33084 5.17239 2.20186 -150.98822 637.36164
5480.0000 -157.05089 -151.70951 5.34138 2.16740 -151.53382 579.84975
5485.0000 -156.91172 -152.45649 4.45523 2.14141 -151.94533 580.76819
5490.0000 -156.40253 -152.23670 4.16583 2.12487 -152.20722 583.54789
5495.0000 -156.19922 -152.84005 3.35917 2.09777 -152.63616 569.87739
5500.0000 -156.72794 -151.90386 4.82408 2.08490 -152.83992 536.35044
FREEZING PROCESS: loop number 23 T-loop= 532.00000000000000
main_MD> interactions number 23 at Temperature= 532.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.53513 0.48427 -1.87985
force_rgl> df(natom) 4.32908 0.61707 2.68109
5505.0000 -157.47206 -153.01283 4.45923 2.07176 -153.04808 531.15159
5510.0000 -157.03446 -152.82257 4.21189 2.05543 -153.30655 520.90393
5515.0000 -157.23162 -152.43263 4.79899 2.09944 -152.60986 533.73103
5520.0000 -157.55411 -152.95524 4.59887 2.10431 -152.53271 550.55002
5525.0000 -157.54982 -153.19191 4.35790 2.07154 -153.05151 555.02852
5530.0000 -156.91014 -152.61248 4.29766 2.06840 -153.10125 520.67508
5535.0000 -156.96490 -152.02916 4.93575 2.11156 -152.41794 538.70341
5540.0000 -157.06631 -153.17471 3.89160 2.09380 -152.69916 526.41951
5545.0000 -157.69771 -153.76408 3.93363 2.02009 -153.86608 465.40099
5550.0000 -157.38680 -153.66409 3.72270 2.02996 -153.70984 515.29302
5555.0000 -157.70532 -153.09909 4.60623 2.04599 -153.45603 510.99005
5560.0000 -157.62243 -153.39015 4.23227 2.06286 -153.18888 536.56888
5565.0000 -156.92879 -152.52124 4.40755 2.09166 -152.73297 533.63133
5570.0000 -157.13427 -153.46560 3.66867 2.04980 -153.39579 495.23581
5575.0000 -157.50022 -153.76092 3.73930 2.06221 -153.19924 495.58899
5580.0000 -157.11456 -152.19196 4.92259 2.09811 -152.63088 527.18109
5585.0000 -156.83275 -152.71582 4.11693 2.11235 -152.40542 526.34625
5590.0000 -156.95928 -152.83435 4.12493 2.09211 -152.72591 534.06640
5595.0000 -157.23486 -152.36696 4.86790 2.07492 -152.99803 500.17554
5600.0000 -156.22463 -151.92720 4.29743 2.12434 -152.21559 552.89818
5605.0000 -157.26382 -152.70120 4.56262 2.12903 -152.14125 540.79554
5610.0000 -157.46199 -152.96672 4.49527 2.09034 -152.75381 531.61331
5615.0000 -158.05557 -153.11526 4.94031 2.07297 -153.02882 536.34202
5620.0000 -157.78437 -153.67139 4.11298 2.04651 -153.44790 513.53760
5625.0000 -156.98436 -152.07379 4.91057 2.09092 -152.74475 561.48458
5630.0000 -158.34185 -153.61629 4.72556 2.08534 -152.83298 539.72341
5635.0000 -157.52564 -153.07783 4.44781 2.05364 -153.33486 528.64374
5640.0000 -157.08564 -152.99318 4.09246 2.06458 -153.16168 527.83415
5645.0000 -157.45500 -153.74799 3.70700 2.06446 -153.16356 519.06842
5650.0000 -157.78284 -153.65905 4.12379 2.03091 -153.69487 511.70793
5655.0000 -157.11816 -152.83917 4.27899 2.05431 -153.32438 501.04362
5660.0000 -158.63677 -153.81229 4.82448 2.06721 -153.12007 544.73896
5665.0000 -158.11986 -154.11134 4.00852 1.99891 -154.20143 486.94837
5670.0000 -158.02500 -152.85576 5.16925 2.04846 -153.41688 515.31934
5675.0000 -157.78349 -153.61929 4.16420 2.03725 -153.59436 506.38770
5680.0000 -157.91366 -153.37179 4.54187 2.02687 -153.75873 498.40405
5685.0000 -156.87782 -152.56217 4.31565 2.06283 -153.18942 515.78196
5690.0000 -157.12253 -151.52260 5.59993 2.14485 -151.89074 587.91134
5695.0000 -157.77696 -154.02284 3.75413 2.10691 -152.49149 539.51809
5700.0000 -157.53392 -154.00932 3.52460 2.02365 -153.80982 498.99691
5705.0000 -158.74820 -153.90520 4.84300 2.03427 -153.64168 515.48837
5710.0000 -158.05968 -153.64088 4.41880 2.04016 -153.54843 526.61130
5715.0000 -158.42099 -154.36581 4.05518 2.00296 -154.13729 519.09611
5720.0000 -157.53425 -153.15330 4.38095 2.02138 -153.84570 529.67373
5725.0000 -157.22606 -152.43970 4.78635 2.07134 -153.05465 533.98812
5730.0000 -157.33728 -152.85614 4.48115 2.09428 -152.69152 545.34962
5735.0000 -156.72358 -152.48762 4.23597 2.07482 -152.99966 505.90876
5740.0000 -157.82416 -152.30703 5.51713 2.11467 -152.36863 545.29697
5745.0000 -157.28718 -151.81367 5.47351 2.14368 -151.90936 586.94838
5750.0000 -157.01093 -152.70251 4.30842 2.09855 -152.62389 554.21852
FREEZING PROCESS: loop number 24 T-loop= 507.00000000000000
main_MD> interactions number 24 at Temperature= 507.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.23989 -1.29072 3.43416
force_rgl> df(natom) -0.07981 -3.23241 0.62996
5755.0000 -156.75565 -153.28039 3.47526 2.09129 -152.73884 550.20711
5760.0000 -158.03674 -153.63132 4.40542 2.04099 -153.53530 502.36715
5765.0000 -157.89918 -153.93108 3.96809 2.02309 -153.81868 490.27186
5770.0000 -157.99042 -154.39109 3.59933 1.97823 -154.52895 444.01022
5775.0000 -157.79326 -154.08126 3.71199 1.97738 -154.54233 453.32041
5780.0000 -158.03223 -154.09826 3.93397 1.99849 -154.20809 477.73239
5785.0000 -157.84508 -152.91266 4.93242 2.00860 -154.04797 483.41540
5790.0000 -157.00351 -152.90720 4.09631 2.05194 -153.36187 523.39013
5795.0000 -158.16647 -154.75038 3.41610 2.02693 -153.75790 491.96575
5800.0000 -158.00238 -154.07629 3.92608 1.97424 -154.59207 445.65839
5805.0000 -157.48805 -153.37847 4.10958 2.03169 -153.68243 499.45375
5810.0000 -157.14443 -152.65280 4.49163 2.08112 -152.89986 522.82417
5815.0000 -156.22463 -152.00221 4.22242 2.08490 -152.84005 526.56155
5820.0000 -157.54004 -153.25486 4.28518 2.09880 -152.61996 527.26139
5825.0000 -156.68003 -152.39226 4.28776 2.07201 -153.04414 511.08756
5830.0000 -158.08083 -153.32361 4.75723 2.05681 -153.28471 498.15132
5835.0000 -156.58259 -152.55416 4.02843 2.05941 -153.24353 506.41678
5840.0000 -156.25672 -152.66444 3.59228 2.10962 -152.44859 536.12195
5845.0000 -157.17715 -153.26007 3.91708 2.09282 -152.71456 543.61733
5850.0000 -157.33962 -153.51129 3.82834 2.02201 -153.83575 462.71004
5855.0000 -157.73321 -153.32675 4.40647 2.06072 -153.22284 493.95771
5860.0000 -157.03075 -153.10336 3.92739 2.05833 -153.26065 513.78690
5865.0000 -156.80298 -152.88668 3.91630 2.08288 -152.87203 517.54415
5870.0000 -157.16889 -152.85117 4.31772 2.05431 -153.32438 516.26980
5875.0000 -157.05770 -153.46833 3.58937 2.04989 -153.39434 513.07226
5880.0000 -157.31610 -153.44535 3.87074 2.06246 -153.19535 490.47793
5885.0000 -157.58264 -153.91699 3.66565 2.01938 -153.87732 482.92501
5890.0000 -158.06096 -153.82471 4.23624 2.02249 -153.82807 492.25541
5895.0000 -158.24063 -153.77381 4.46683 2.04847 -153.41679 517.14226
5900.0000 -157.75193 -153.95753 3.79440 1.99931 -154.19518 462.53111
5905.0000 -157.64965 -154.10496 3.54469 2.02475 -153.79242 508.81173
5910.0000 -157.86384 -153.34794 4.51589 2.04565 -153.46143 515.83582
5915.0000 -157.93188 -153.62021 4.31167 2.04982 -153.39540 520.08267
5920.0000 -157.40683 -153.04096 4.36587 2.04570 -153.46063 491.02865
5925.0000 -156.98838 -152.63522 4.35316 2.07292 -153.02968 505.66403
5930.0000 -157.38145 -153.57371 3.80774 2.07273 -153.03265 512.57516
5935.0000 -158.79704 -154.80922 3.98782 2.00265 -154.14226 482.27046
5940.0000 -158.58422 -155.20074 3.38348 1.96809 -154.68948 479.16571
5945.0000 -159.20359 -155.30880 3.89479 1.96439 -154.74805 476.88612
5950.0000 -159.41801 -155.53615 3.88186 1.90702 -155.65630 418.22837
5955.0000 -158.41374 -154.27357 4.14016 1.98373 -154.44181 497.55234
5960.0000 -158.03732 -154.46183 3.57549 1.98560 -154.41227 501.42030
5965.0000 -157.29330 -154.07512 3.21817 1.99353 -154.28666 486.83221
5970.0000 -158.10531 -153.07870 5.02661 2.03185 -153.68000 532.14266
5975.0000 -157.95983 -153.32568 4.63415 2.06524 -153.15122 578.70286
5980.0000 -158.35670 -153.96776 4.38893 1.99917 -154.19743 510.39975
5985.0000 -158.85873 -154.72974 4.12899 1.97653 -154.55583 507.83901
5990.0000 -159.40736 -155.15010 4.25726 1.95502 -154.89636 472.96625
5995.0000 -159.14889 -154.55774 4.59116 1.94043 -155.12741 460.51765
6000.0000 -158.88549 -153.98777 4.89772 2.00808 -154.05624 522.35332
FREEZING PROCESS: loop number 25 T-loop= 482.00000000000000
main_MD> interactions number 25 at Temperature= 482.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.00989 -1.76342 -1.20431
force_rgl> df(natom) -0.24824 -0.47147 1.38254
6005.0000 -158.03730 -153.68295 4.35435 1.99454 -154.27059 512.52418
6010.0000 -157.91347 -154.03214 3.88133 1.99550 -154.25543 503.09779
6015.0000 -158.17546 -153.88872 4.28674 2.03583 -153.61685 536.93697
6020.0000 -158.84071 -154.43397 4.40673 1.98483 -154.42446 489.09482
6025.0000 -158.78211 -155.18050 3.60161 1.96534 -154.73297 466.27010
6030.0000 -158.75255 -154.81201 3.94054 1.93981 -155.13720 451.48185
6035.0000 -158.13904 -154.80894 3.33009 1.97094 -154.64432 487.69919
6040.0000 -159.32515 -155.69761 3.62754 1.91515 -155.52767 447.82693
6045.0000 -158.34232 -154.97946 3.36286 1.89393 -155.86360 433.37617
6050.0000 -158.59036 -154.85567 3.73469 1.93085 -155.27908 456.93501
6055.0000 -157.80091 -154.19916 3.60174 1.98643 -154.39903 485.84822
6060.0000 -157.65995 -154.28801 3.37194 1.96501 -154.73821 476.69245
6065.0000 -157.57070 -152.78275 4.78795 2.03186 -153.67984 518.98774
6070.0000 -157.78177 -153.55939 4.22238 2.02233 -153.83070 500.42930
6075.0000 -158.18909 -154.36971 3.81937 2.02181 -153.83889 523.18898
6080.0000 -158.85327 -154.71078 4.14249 1.99103 -154.32621 485.37348
6085.0000 -158.94643 -155.44779 3.49863 1.93706 -155.18081 449.63420
6090.0000 -157.76876 -154.28551 3.48326 1.97569 -154.56911 468.36405
6095.0000 -157.67914 -153.35003 4.32910 2.04422 -153.48410 540.87614
6100.0000 -158.43187 -154.10265 4.32922 2.01600 -153.93082 494.80868
6105.0000 -158.37023 -154.93719 3.43304 1.97041 -154.65273 448.52050
6110.0000 -157.85540 -153.88579 3.96961 1.99885 -154.20237 462.74446
6115.0000 -157.16089 -153.39948 3.76141 1.99401 -154.27903 480.25291
6120.0000 -158.09129 -154.14875 3.94254 2.02636 -153.76685 496.83110
6125.0000 -157.68743 -153.07802 4.60942 2.05755 -153.27300 524.11753
6130.0000 -158.45152 -154.42158 4.02995 2.03487 -153.63208 516.78341
6135.0000 -159.00323 -154.99596 4.00727 2.00392 -154.12212 508.76439
6140.0000 -158.75570 -154.83146 3.92424 1.95749 -154.85730 468.15830
6145.0000 -159.15192 -154.95597 4.19595 1.95235 -154.93866 464.06573
6150.0000 -158.28164 -153.88591 4.39574 1.98777 -154.37778 486.09821
6155.0000 -157.98292 -153.32296 4.65996 2.02612 -153.77067 513.07086
6160.0000 -158.66239 -155.01058 3.65180 1.98298 -154.45362 480.15443
6165.0000 -158.69472 -154.91332 3.78140 1.97971 -154.50550 479.84759
6170.0000 -158.40027 -154.35134 4.04894 1.97134 -154.63796 457.28791
6175.0000 -158.17716 -153.79270 4.38446 2.00313 -154.13467 492.18246
6180.0000 -158.84524 -154.32899 4.51624 1.99971 -154.18876 490.52269
6185.0000 -157.92196 -154.45423 3.46773 2.01119 -154.00697 499.29799
6190.0000 -157.64787 -153.77625 3.87162 2.03800 -153.58251 507.20459
6195.0000 -156.87283 -153.36354 3.50929 2.04172 -153.52373 518.52819
6200.0000 -158.13516 -154.43851 3.69666 2.03578 -153.61763 539.02688
6205.0000 -157.83901 -154.23520 3.60381 2.01510 -153.94510 515.24336
6210.0000 -157.93731 -153.77157 4.16574 1.99012 -154.34068 504.67933
6215.0000 -157.35875 -154.20189 3.15686 2.01475 -153.95063 505.27303
6220.0000 -158.20021 -154.56390 3.63631 1.99037 -154.33666 489.51712
6225.0000 -159.13825 -154.92937 4.20888 1.96613 -154.72049 483.62767
6230.0000 -158.80938 -155.31256 3.49682 1.94466 -155.06041 465.16754
6235.0000 -158.53871 -154.62918 3.90953 1.97702 -154.54803 498.44971
6240.0000 -159.09260 -155.48248 3.61012 1.95284 -154.93090 470.46023
6245.0000 -157.69422 -153.86402 3.83020 1.96214 -154.78361 473.78404
6250.0000 -159.27948 -155.01232 4.26716 1.95562 -154.88694 466.63918
FREEZING PROCESS: loop number 26 T-loop= 457.00000000000000
main_MD> interactions number 26 at Temperature= 457.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.31564 0.84753 2.30816
force_rgl> df(natom) -2.74372 0.81455 -2.15777
6255.0000 -159.06806 -155.25508 3.81298 1.96012 -154.81569 477.36187
6260.0000 -158.85489 -154.80247 4.05241 1.94339 -155.08058 464.21359
6265.0000 -159.34820 -155.68753 3.66067 1.93042 -155.28580 446.51955
6270.0000 -158.57262 -154.93964 3.63298 1.93678 -155.18520 453.75584
6275.0000 -159.12378 -155.48908 3.63470 1.92547 -155.36426 449.19038
6280.0000 -159.88573 -155.91595 3.96977 1.91345 -155.55459 442.76911
6285.0000 -159.43372 -155.71325 3.72047 1.91842 -155.47585 441.59443
6290.0000 -159.56943 -156.11524 3.45419 1.89643 -155.82403 430.33789
6295.0000 -159.09773 -155.31125 3.78648 1.91917 -155.46403 450.98198
6300.0000 -158.81246 -154.88981 3.92265 1.93537 -155.20747 464.91188
6305.0000 -158.64777 -154.97434 3.67343 1.96262 -154.77604 491.88155
6310.0000 -159.05835 -155.52368 3.53466 1.91952 -155.45843 451.93833
6315.0000 -159.15425 -155.09335 4.06089 1.94334 -155.08128 471.02475
6320.0000 -159.19694 -155.42071 3.77624 1.93187 -155.26283 470.35172
6325.0000 -159.23690 -155.21099 4.02591 1.92685 -155.34233 475.86104
6330.0000 -159.04757 -154.57388 4.47369 1.94003 -155.13375 466.55578
6335.0000 -158.61924 -155.11358 3.50566 1.95915 -154.83090 474.91704
6340.0000 -158.93326 -155.94700 2.98626 1.93977 -155.13781 460.35476
6345.0000 -158.82235 -155.41313 3.40922 1.90371 -155.70876 434.01602
6350.0000 -159.47081 -155.69843 3.77238 1.92637 -155.35003 456.60415
6355.0000 -159.12614 -155.10337 4.02277 1.92916 -155.30581 474.02968
6360.0000 -159.09610 -155.46969 3.62642 1.93188 -155.26281 471.53810
6365.0000 -159.28196 -155.83347 3.44849 1.92155 -155.42635 454.95638
6370.0000 -158.66585 -154.42933 4.23652 1.92673 -155.34426 454.83093
6375.0000 -157.96174 -154.04837 3.91337 1.97455 -154.58713 498.59751
6380.0000 -158.27681 -154.77954 3.49727 1.99120 -154.32357 514.53095
6385.0000 -159.34032 -155.26112 4.07920 1.95535 -154.89108 483.87252
6390.0000 -159.44712 -155.92584 3.52128 1.89689 -155.81675 430.88030
6395.0000 -159.56760 -155.79552 3.77209 1.89872 -155.78769 442.13721
6400.0000 -159.50870 -156.00651 3.50219 1.89515 -155.84432 442.12209
6405.0000 -159.29033 -156.03585 3.25448 1.89723 -155.81138 442.00362
6410.0000 -158.85163 -154.80927 4.04236 1.92276 -155.40714 465.52598
6415.0000 -159.47288 -155.09330 4.37958 1.95679 -154.86830 496.17812
6420.0000 -158.98613 -155.28182 3.70431 1.93950 -155.14208 478.18127
6425.0000 -158.77014 -154.89922 3.87092 1.93188 -155.26277 449.26113
6430.0000 -158.74709 -155.14223 3.60485 1.93948 -155.14237 477.80725
6435.0000 -159.09499 -154.91311 4.18189 1.97117 -154.64072 501.98437
6440.0000 -158.17114 -154.51706 3.65408 1.96908 -154.67377 490.77650
6445.0000 -158.83635 -155.11127 3.72508 1.98122 -154.48154 508.22682
6450.0000 -157.95939 -154.11406 3.84534 1.97392 -154.59721 482.31737
6455.0000 -158.82121 -155.21725 3.60395 1.96657 -154.71357 471.93323
6460.0000 -158.97829 -155.54325 3.43503 1.92825 -155.32025 446.28872
6465.0000 -159.81742 -156.66823 3.14919 1.84935 -156.56951 382.70197
6470.0000 -159.24170 -155.56193 3.67977 1.88109 -156.06691 411.26501
6475.0000 -159.34619 -156.26138 3.08481 1.87223 -156.20719 405.74409
6480.0000 -158.96766 -155.23159 3.73608 1.90918 -155.62208 433.44912
6485.0000 -158.82778 -154.91058 3.91720 1.93593 -155.19855 467.22281
6490.0000 -159.29195 -155.67569 3.61626 1.93946 -155.14274 464.22928
6495.0000 -160.04435 -155.73833 4.30602 1.91462 -155.53594 438.59097
6500.0000 -159.32734 -156.04338 3.28396 1.88010 -156.08253 430.10985
FREEZING PROCESS: loop number 27 T-loop= 432.00000000000000
main_MD> interactions number 27 at Temperature= 432.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.63334 -1.91698 -3.01592
force_rgl> df(natom) 0.86939 0.35158 0.74849
6505.0000 -159.49883 -156.21137 3.28746 1.86087 -156.38711 414.22569
6510.0000 -158.73601 -155.59229 3.14372 1.89684 -155.81745 440.05475
6515.0000 -159.17397 -155.12287 4.05110 1.90848 -155.63323 448.44462
6520.0000 -158.93124 -155.22513 3.70611 1.94942 -154.98503 475.42868
6525.0000 -159.27977 -156.01341 3.26636 1.89782 -155.80206 441.61887
6530.0000 -159.45014 -155.80995 3.64019 1.91636 -155.50841 457.70983
6535.0000 -159.45578 -155.98874 3.46704 1.88742 -155.96672 427.78500
6540.0000 -159.57773 -156.48092 3.09681 1.89283 -155.88096 424.87450
6545.0000 -159.48073 -156.28080 3.19993 1.87531 -156.15843 421.23912
6550.0000 -159.92527 -156.54250 3.38277 1.86121 -156.38159 406.79918
6555.0000 -159.83720 -156.51514 3.32205 1.85910 -156.41504 411.11136
6560.0000 -159.28484 -155.75428 3.53055 1.87674 -156.13583 426.91592
6565.0000 -158.79761 -155.55841 3.23920 1.92710 -155.33846 468.20979
6570.0000 -159.88167 -155.80241 4.07926 1.89895 -155.78417 441.43624
6575.0000 -159.25873 -156.21920 3.03953 1.89469 -155.85158 443.81572
6580.0000 -160.13834 -156.62301 3.51533 1.84659 -156.61316 404.57118
6585.0000 -160.19417 -157.12610 3.06807 1.84696 -156.60731 403.25024
6590.0000 -159.87071 -156.44557 3.42513 1.84080 -156.70480 392.93805
6595.0000 -159.79658 -156.24380 3.55278 1.87658 -156.13831 428.35995
6600.0000 -159.57061 -156.37239 3.19822 1.85677 -156.45191 391.00380
6605.0000 -159.68107 -156.88752 2.79355 1.85907 -156.41559 403.96660
6610.0000 -159.35346 -155.52936 3.82410 1.88611 -155.98749 431.95467
6615.0000 -159.51210 -156.01598 3.49612 1.91504 -155.52940 452.51953
6620.0000 -159.88601 -156.73490 3.15110 1.85709 -156.44687 409.98055
6625.0000 -160.02793 -156.80775 3.22018 1.83840 -156.74275 390.27099
6630.0000 -159.78374 -156.52109 3.26264 1.84905 -156.57415 393.26487
6635.0000 -159.91278 -156.56714 3.34564 1.86817 -156.27149 421.40680
6640.0000 -159.86922 -156.11034 3.75888 1.86126 -156.38092 410.63652
6645.0000 -159.99636 -156.50681 3.48955 1.89668 -155.82000 444.98168
6650.0000 -160.31675 -155.99787 4.31888 1.85758 -156.43920 401.08300
6655.0000 -159.45714 -155.67819 3.77895 1.90452 -155.69595 452.03440
6660.0000 -159.48279 -156.56897 2.91382 1.84723 -156.60297 403.13962
6665.0000 -159.04331 -156.33194 2.71137 1.84802 -156.59056 403.16923
6670.0000 -159.30246 -156.05321 3.24925 1.85824 -156.42863 403.83188
6675.0000 -159.56685 -155.59835 3.96850 1.90919 -155.62196 446.61981
6680.0000 -159.22902 -155.97360 3.25542 1.91559 -155.52060 454.39323
6685.0000 -159.84384 -156.84047 3.00337 1.87955 -156.09129 415.25011
6690.0000 -159.29821 -156.29028 3.00793 1.86803 -156.27367 381.84377
6695.0000 -159.55278 -155.80602 3.74677 1.89460 -155.85302 408.78145
6700.0000 -159.63421 -155.96351 3.67070 1.89125 -155.90603 419.04733
6705.0000 -159.56104 -156.19856 3.36248 1.84859 -156.58153 378.79352
6710.0000 -158.34418 -155.20791 3.13627 1.88661 -155.97947 416.77118
6715.0000 -159.13006 -155.63413 3.49593 1.90070 -155.75649 426.52477
6720.0000 -159.37086 -155.71085 3.66001 1.91412 -155.54395 424.41671
6725.0000 -158.38142 -154.98826 3.39316 1.92116 -155.43247 433.23821
6730.0000 -159.24076 -156.26994 2.97082 1.89152 -155.90173 408.86898
6735.0000 -159.47583 -155.45131 4.02452 1.90025 -155.76358 437.25134
6740.0000 -158.80073 -155.09957 3.70115 1.92063 -155.44088 464.34844
6745.0000 -159.77913 -156.83432 2.94481 1.86283 -156.35599 416.52795
6750.0000 -159.62239 -155.76922 3.85316 1.90485 -155.69077 450.01301
FREEZING PROCESS: loop number 28 T-loop= 407.00000000000000
main_MD> interactions number 28 at Temperature= 407.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.34313 0.37833 -0.62617
force_rgl> df(natom) -1.60858 1.21724 -1.07149
6755.0000 -160.36513 -157.45155 2.91358 1.85906 -156.41577 416.97370
6760.0000 -160.06854 -156.96074 3.10781 1.79492 -157.43129 359.07005
6765.0000 -159.19614 -156.05685 3.13928 1.86837 -156.26825 413.44920
6770.0000 -159.71342 -156.31640 3.39702 1.86866 -156.26366 411.52085
6775.0000 -159.24265 -155.99539 3.24726 1.87321 -156.19161 423.89054
6780.0000 -160.12374 -156.49985 3.62388 1.86446 -156.33024 420.34366
6785.0000 -159.71071 -156.41306 3.29764 1.88585 -155.99151 429.35518
6790.0000 -159.92046 -156.95299 2.96747 1.82523 -156.95126 386.46531
6795.0000 -159.68550 -156.12427 3.56123 1.81895 -157.05075 381.00063
6800.0000 -159.56171 -156.68689 2.87482 1.86141 -156.37845 414.19958
6805.0000 -159.95157 -156.25862 3.69295 1.86190 -156.37072 406.47981
6810.0000 -159.99672 -156.55248 3.44423 1.85934 -156.41129 420.15286
6815.0000 -160.25921 -156.75873 3.50048 1.83485 -156.79905 396.83988
6820.0000 -159.81599 -156.01454 3.80145 1.86508 -156.32046 414.97677
6825.0000 -159.87659 -155.84912 4.02748 1.87776 -156.11959 425.86755
6830.0000 -159.42371 -156.34797 3.07574 1.89416 -155.85999 436.30805
6835.0000 -158.45672 -155.69503 2.76169 1.87284 -156.19747 406.54371
6840.0000 -159.75857 -156.08725 3.67132 1.89245 -155.88707 419.42704
6845.0000 -159.29482 -156.04339 3.25143 1.90743 -155.64988 449.29444
6850.0000 -159.82692 -156.43381 3.39312 1.84868 -156.58000 415.39627
6855.0000 -159.51420 -155.98373 3.53047 1.85954 -156.40802 416.91796
6860.0000 -160.21736 -157.06780 3.14955 1.86061 -156.39111 392.20817
6865.0000 -159.69585 -156.78851 2.90734 1.82538 -156.94899 368.93671
6870.0000 -159.74509 -156.65947 3.08562 1.82648 -156.93158 374.81676
6875.0000 -159.05735 -155.54671 3.51063 1.87459 -156.16977 418.57691
6880.0000 -159.24528 -156.03873 3.20656 1.92809 -155.32279 468.75493
6885.0000 -159.91583 -156.64751 3.26832 1.87717 -156.12893 428.31863
6890.0000 -160.20131 -157.19792 3.00339 1.81535 -157.10772 380.50569
6895.0000 -159.32622 -155.51168 3.81454 1.86239 -156.36290 412.34095
6900.0000 -159.38989 -155.62093 3.76895 1.90706 -155.65568 460.28329
6905.0000 -159.28523 -156.13223 3.15300 1.88055 -156.07551 420.01479
6910.0000 -159.74299 -156.89212 2.85087 1.84148 -156.69400 392.43771
6915.0000 -159.66249 -156.37282 3.28967 1.85206 -156.52650 410.83223
6920.0000 -159.93785 -156.34699 3.59086 1.85542 -156.47339 397.15306
6925.0000 -159.43100 -156.02438 3.40662 1.87404 -156.17858 420.19518
6930.0000 -159.47110 -155.80537 3.66573 1.89033 -155.92053 441.72197
6935.0000 -159.29133 -155.84259 3.44874 1.88170 -156.05721 432.02513
6940.0000 -159.35714 -155.68484 3.67229 1.89579 -155.83420 431.50942
6945.0000 -159.41670 -156.49369 2.92302 1.86628 -156.30135 412.50702
6950.0000 -160.10585 -156.58894 3.51692 1.84274 -156.67417 394.03626
6955.0000 -159.24876 -156.20979 3.03897 1.84469 -156.64314 391.74730
6960.0000 -159.99440 -156.44681 3.54760 1.87359 -156.18566 414.57047
6965.0000 -159.58876 -156.33657 3.25219 1.85639 -156.45798 399.16770
6970.0000 -159.90725 -157.00414 2.90311 1.85507 -156.47885 389.24113
6975.0000 -160.35405 -157.15088 3.20318 1.82940 -156.88530 371.82747
6980.0000 -159.64858 -156.41122 3.23737 1.84526 -156.63413 387.92594
6985.0000 -160.01643 -156.97993 3.03650 1.82729 -156.91864 368.12274
6990.0000 -160.11184 -157.09940 3.01244 1.81003 -157.19203 361.01443
6995.0000 -160.12059 -156.94098 3.17961 1.81355 -157.13628 365.43412
7000.0000 -160.20753 -157.11455 3.09298 1.83308 -156.82707 395.35778
FREEZING PROCESS: loop number 29 T-loop= 382.00000000000000
main_MD> interactions number 29 at Temperature= 382.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.77088 -1.60281 0.22579
force_rgl> df(natom) 0.50879 1.58893 0.55159
7005.0000 -160.40889 -156.62385 3.78505 1.82831 -156.90258 385.34039
7010.0000 -159.68835 -157.09262 2.59573 1.81781 -157.06878 379.80898
7015.0000 -160.01890 -157.01805 3.00085 1.81196 -157.16142 372.83919
7020.0000 -159.48551 -156.32326 3.16225 1.85142 -156.53667 404.34103
7025.0000 -160.08933 -156.64618 3.44315 1.85432 -156.49081 409.45166
7030.0000 -159.38072 -156.43626 2.94445 1.85267 -156.51693 406.85566
7035.0000 -160.01650 -157.02016 2.99634 1.83517 -156.79395 396.29421
7040.0000 -160.39208 -157.20758 3.18450 1.82283 -156.98939 382.80974
7045.0000 -160.40666 -157.14721 3.25945 1.82493 -156.95606 384.11993
7050.0000 -161.12601 -157.62065 3.50537 1.80277 -157.30690 365.69872
7055.0000 -159.89845 -156.54740 3.35105 1.80322 -157.29980 365.24953
7060.0000 -160.72852 -157.34479 3.38373 1.80594 -157.25672 363.01091
7065.0000 -159.93133 -156.71573 3.21561 1.81625 -157.09355 373.73654
7070.0000 -159.89502 -156.44077 3.45425 1.84356 -156.66111 396.22414
7075.0000 -160.36566 -157.58033 2.78533 1.81469 -157.11817 380.47424
7080.0000 -159.99383 -156.77517 3.21866 1.78556 -157.57936 352.31136
7085.0000 -160.24798 -156.97873 3.26924 1.81028 -157.18795 373.71196
7090.0000 -160.65174 -157.47312 3.17862 1.82112 -157.01646 379.85291
7095.0000 -159.97458 -156.71898 3.25559 1.83247 -156.83664 391.15637
7100.0000 -160.24096 -156.87855 3.36240 1.83175 -156.84806 395.95509
7105.0000 -160.30546 -157.14467 3.16080 1.82388 -156.97277 396.28933
7110.0000 -160.15952 -157.27778 2.88174 1.81109 -157.17519 377.62585
7115.0000 -161.07735 -158.19844 2.87891 1.77486 -157.74883 342.61775
7120.0000 -160.52660 -157.29193 3.23467 1.77186 -157.79629 339.95322
7125.0000 -160.56607 -156.96355 3.60252 1.83407 -156.81130 384.46297
7130.0000 -159.71613 -156.45637 3.25976 1.84300 -156.66992 400.19867
7135.0000 -160.60699 -157.83912 2.76787 1.80822 -157.22068 371.43507
7140.0000 -160.65907 -157.14260 3.51647 1.78991 -157.51051 357.30837
7145.0000 -160.48196 -157.57659 2.90537 1.78609 -157.57108 350.96419
7150.0000 -160.32094 -156.86488 3.45605 1.80517 -157.26901 362.27161
7155.0000 -160.28752 -156.93252 3.35499 1.83911 -156.73150 397.21303
7160.0000 -160.27056 -156.78490 3.48567 1.85307 -156.51048 402.87713
7165.0000 -160.09353 -157.13544 2.95809 1.82291 -156.98807 373.97993
7170.0000 -160.34550 -157.20269 3.14281 1.82204 -157.00186 383.98707
7175.0000 -160.24433 -157.62361 2.62072 1.80613 -157.25381 375.12258
7180.0000 -159.98728 -156.93032 3.05696 1.80183 -157.32180 369.94349
7185.0000 -160.19540 -157.77874 2.41666 1.79809 -157.38099 364.44731
7190.0000 -160.30150 -157.60291 2.69859 1.77577 -157.73438 339.73740
7195.0000 -160.19212 -157.17911 3.01301 1.80093 -157.33600 367.61127
7200.0000 -160.54188 -157.78685 2.75502 1.80171 -157.32367 366.46675
7205.0000 -160.10596 -157.12569 2.98027 1.79625 -157.41021 361.80716
7210.0000 -160.46957 -157.68564 2.78393 1.79994 -157.35169 363.33829
7215.0000 -160.72739 -158.20444 2.52295 1.76261 -157.94283 330.89685
7220.0000 -159.99547 -157.27768 2.71779 1.77453 -157.75407 340.67728
7225.0000 -159.82812 -156.92285 2.90527 1.82461 -156.96119 384.25715
7230.0000 -160.69125 -157.79573 2.89552 1.81358 -157.13585 376.28297
7235.0000 -160.24960 -157.22874 3.02086 1.79397 -157.44622 361.41892
7240.0000 -160.10989 -156.88254 3.22735 1.81262 -157.15104 379.98061
7245.0000 -159.86685 -156.73208 3.13478 1.83692 -156.76626 396.18181
7250.0000 -160.19878 -156.94902 3.24975 1.83633 -156.77559 395.46837
FREEZING PROCESS: loop number 30 T-loop= 357.00000000000000
main_MD> interactions number 30 at Temperature= 357.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.39127 -0.98945 -0.65516
force_rgl> df(natom) -0.91119 0.80629 -1.71023
7255.0000 -160.33524 -157.50203 2.83321 1.79726 -157.39415 361.72430
7260.0000 -160.48823 -157.32853 3.15971 1.79478 -157.43338 360.60436
7265.0000 -160.54463 -158.21008 2.33455 1.78629 -157.56787 354.35343
7270.0000 -160.51310 -157.81442 2.69869 1.76072 -157.97264 331.78054
7275.0000 -160.71895 -157.49706 3.22189 1.77927 -157.67903 349.93954
7280.0000 -160.80786 -158.08491 2.72295 1.77077 -157.81360 336.57587
7285.0000 -160.08077 -156.97737 3.10340 1.79707 -157.39722 364.47860
7290.0000 -160.31822 -157.05089 3.26733 1.83580 -156.78394 392.31088
7295.0000 -160.24759 -157.65633 2.59126 1.77970 -157.67216 344.51008
7300.0000 -160.71845 -158.16525 2.55321 1.76353 -157.92817 331.84641
7305.0000 -160.50670 -157.62662 2.88008 1.76373 -157.92511 333.55225
7310.0000 -159.96215 -157.04874 2.91342 1.79292 -157.46283 352.68255
7315.0000 -160.11647 -156.74189 3.37458 1.81935 -157.04449 379.17826
7320.0000 -160.52631 -157.49241 3.03390 1.79353 -157.45320 366.51780
7325.0000 -159.76157 -156.85967 2.90191 1.82897 -156.89212 387.16088
7330.0000 -160.52517 -157.24158 3.28360 1.81660 -157.08801 374.98794
7335.0000 -160.05288 -156.52002 3.53286 1.80006 -157.34977 366.47196
7340.0000 -160.63931 -157.25864 3.38067 1.82447 -156.96329 386.47101
7345.0000 -160.40599 -157.80050 2.60550 1.79833 -157.37726 362.67498
7350.0000 -160.35231 -157.35361 2.99870 1.78049 -157.65966 348.45336
7355.0000 -160.55264 -157.36210 3.19054 1.81161 -157.16693 372.23343
7360.0000 -160.55494 -158.08558 2.46936 1.77401 -157.76231 342.16283
7365.0000 -160.37531 -157.32401 3.05131 1.76031 -157.97919 327.05810
7370.0000 -160.26979 -156.99252 3.27727 1.80863 -157.21409 369.47387
7375.0000 -159.59231 -156.58744 3.00488 1.82127 -157.01406 380.66971
7380.0000 -160.61432 -157.35196 3.26237 1.82692 -156.92459 384.94982
7385.0000 -160.67069 -158.10040 2.57029 1.78277 -157.62364 346.79236
7390.0000 -160.27275 -157.94527 2.32747 1.77521 -157.74336 329.90992
7395.0000 -159.90173 -156.78880 3.11294 1.80436 -157.28177 352.47792
7400.0000 -159.88537 -156.74337 3.14200 1.82194 -157.00342 360.17906
7405.0000 -160.38952 -156.88007 3.50945 1.85217 -156.52485 393.99394
7410.0000 -160.52769 -157.63107 2.89662 1.84155 -156.69290 390.37698
7415.0000 -159.85999 -157.19618 2.66381 1.78273 -157.62424 350.70019
7420.0000 -160.21339 -157.18258 3.03081 1.79756 -157.38936 363.37311
7425.0000 -160.36096 -157.16668 3.19428 1.81096 -157.17727 361.74280
7430.0000 -160.61140 -157.88047 2.73093 1.81283 -157.14760 375.82209
7435.0000 -160.55916 -157.47234 3.08683 1.76803 -157.85692 334.50716
7440.0000 -160.89208 -158.12081 2.77127 1.76982 -157.82865 337.09130
7445.0000 -160.39928 -157.56264 2.83663 1.78184 -157.63827 349.36528
7450.0000 -159.82246 -156.82427 2.99819 1.80323 -157.29972 359.38696
7455.0000 -160.48357 -157.42340 3.06017 1.80746 -157.23272 361.39331
7460.0000 -160.64696 -157.59594 3.05102 1.79662 -157.40436 363.01201
7465.0000 -160.22030 -157.54661 2.67369 1.78665 -157.56222 347.88644
7470.0000 -160.58055 -157.59485 2.98571 1.76890 -157.84321 339.34246
7475.0000 -160.42892 -157.69530 2.73362 1.79386 -157.44806 365.93900
7480.0000 -160.63603 -157.43379 3.20224 1.78006 -157.66657 346.69860
7485.0000 -160.30584 -157.53422 2.77161 1.80784 -157.22662 374.16937
7490.0000 -160.44389 -157.33759 3.10630 1.81194 -157.16167 372.86366
7495.0000 -160.98720 -157.67286 3.31434 1.80146 -157.32763 369.53645
7500.0000 -160.29967 -157.10392 3.19575 1.80662 -157.24590 372.24341
FREEZING PROCESS: loop number 31 T-loop= 332.00000000000000
main_MD> interactions number 31 at Temperature= 332.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.70052 -0.01157 -1.53243
force_rgl> df(natom) 1.02676 -2.20145 0.73440
7505.0000 -160.48925 -157.42638 3.06287 1.80765 -157.22959 373.15724
7510.0000 -160.62978 -157.49227 3.13751 1.79423 -157.44221 354.43446
7515.0000 -160.14389 -157.37130 2.77259 1.77067 -157.81518 324.17609
7520.0000 -159.91699 -157.39313 2.52386 1.80795 -157.22486 361.29284
7525.0000 -160.16099 -157.57334 2.58765 1.77839 -157.69295 328.16946
7530.0000 -160.57070 -157.86829 2.70240 1.77417 -157.75977 320.95531
7535.0000 -160.32119 -157.46864 2.85254 1.78139 -157.64543 331.17216
7540.0000 -160.13177 -157.61699 2.51478 1.79124 -157.48947 339.28805
7545.0000 -159.87163 -156.45927 3.41237 1.82817 -156.90478 385.30457
7550.0000 -160.30303 -157.62678 2.67625 1.82510 -156.95335 385.59130
7555.0000 -160.33660 -156.67163 3.66498 1.79836 -157.37679 354.29854
7560.0000 -160.38809 -157.44829 2.93980 1.81473 -157.11758 378.64458
7565.0000 -160.93406 -157.90797 3.02610 1.77521 -157.74330 341.98318
7570.0000 -160.94000 -158.31629 2.62371 1.74800 -158.17416 322.69014
7575.0000 -160.39999 -157.75798 2.64202 1.75725 -158.02770 326.24413
7580.0000 -160.44165 -158.23608 2.20557 1.75809 -158.01427 325.84920
7585.0000 -160.40797 -157.90913 2.49884 1.73979 -158.30413 307.99999
7590.0000 -160.87882 -158.21317 2.66566 1.75654 -158.03884 326.08809
7595.0000 -160.99063 -158.14950 2.84113 1.75199 -158.11100 323.88865
7600.0000 -160.55735 -157.80382 2.75352 1.75328 -158.09057 317.55087
7605.0000 -160.22423 -158.05621 2.16802 1.76347 -157.92912 315.54437
7610.0000 -160.54798 -158.54163 2.00636 1.73762 -158.33850 293.42439
7615.0000 -160.83976 -158.57857 2.26119 1.73662 -158.35422 291.14607
7620.0000 -161.07133 -158.38597 2.68537 1.72561 -158.52853 284.43807
7625.0000 -160.83956 -158.21663 2.62293 1.75886 -158.00223 312.45973
7630.0000 -160.39117 -157.23125 3.15992 1.79078 -157.49677 344.28535
7635.0000 -160.29512 -157.30400 2.99111 1.79801 -157.38231 348.55477
7640.0000 -160.48287 -157.90885 2.57402 1.76516 -157.90233 329.07887
7645.0000 -160.20242 -157.59688 2.60554 1.76153 -157.95981 330.09657
7650.0000 -160.83404 -157.68598 3.14805 1.77493 -157.74777 344.58338
7655.0000 -160.40932 -157.57910 2.83022 1.80956 -157.19949 373.15126
7660.0000 -160.72615 -158.27583 2.45032 1.76326 -157.93246 338.58382
7665.0000 -160.90522 -157.87618 3.02903 1.73809 -158.33108 309.36424
7670.0000 -160.71560 -158.27445 2.44115 1.73935 -158.31099 307.60980
7675.0000 -160.87563 -158.06794 2.80769 1.74281 -158.25629 309.75207
7680.0000 -160.65356 -157.84453 2.80903 1.76423 -157.91715 332.76460
7685.0000 -160.76105 -158.14819 2.61286 1.76089 -157.96994 329.49998
7690.0000 -161.06694 -158.62842 2.43852 1.73024 -158.45534 300.39178
7695.0000 -160.73054 -157.92901 2.80153 1.74129 -158.28028 312.13907
7700.0000 -160.50708 -157.96278 2.54430 1.73816 -158.32997 308.87566
7705.0000 -160.30468 -157.65507 2.64960 1.77340 -157.77198 337.31654
7710.0000 -160.75717 -157.68300 3.07417 1.78074 -157.65580 345.34919
7715.0000 -160.46235 -157.80065 2.66169 1.78872 -157.52944 355.87681
7720.0000 -161.03963 -158.75466 2.28497 1.75305 -158.09413 320.97146
7725.0000 -160.89327 -158.13037 2.76290 1.72762 -158.49674 296.78511
7730.0000 -160.96291 -158.04316 2.91975 1.75310 -158.09329 324.54620
7735.0000 -161.26336 -158.71597 2.54740 1.74334 -158.24781 315.52925
7740.0000 -160.83748 -158.21353 2.62395 1.73254 -158.41883 304.24881
7745.0000 -161.25114 -158.26082 2.99033 1.74149 -158.27716 310.16083
7750.0000 -160.74400 -157.80171 2.94229 1.76479 -157.90827 334.20672
FREEZING PROCESS: loop number 32 T-loop= 307.00000000000000
main_MD> interactions number 32 at Temperature= 307.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.38742 -0.40701 0.66828
force_rgl> df(natom) 1.03151 0.26971 -0.26661
7755.0000 -160.42311 -157.94440 2.47871 1.78488 -157.59011 345.04154
7760.0000 -160.39555 -157.63426 2.76129 1.77502 -157.74636 334.68181
7765.0000 -160.69834 -158.46359 2.23475 1.74505 -158.22076 313.11022
7770.0000 -161.15648 -158.52479 2.63169 1.73899 -158.31672 310.95151
7775.0000 -161.07724 -158.55545 2.52179 1.70800 -158.80736 282.69752
7780.0000 -160.50116 -158.38074 2.12041 1.72053 -158.60903 292.41709
7785.0000 -161.05356 -158.55021 2.50335 1.73653 -158.35578 306.84007
7790.0000 -160.59129 -157.87556 2.71573 1.73127 -158.43896 305.41073
7795.0000 -161.30636 -158.72127 2.58509 1.75869 -158.00492 328.39645
7800.0000 -160.99083 -158.52485 2.46598 1.72411 -158.55235 296.21886
7805.0000 -160.75818 -158.56150 2.19668 1.73428 -158.39129 304.20390
7810.0000 -160.67992 -158.19526 2.48466 1.73006 -158.45807 302.95999
7815.0000 -161.18861 -158.51410 2.67452 1.73356 -158.40275 303.94872
7820.0000 -160.97361 -158.27631 2.69730 1.72495 -158.53897 296.68502
7825.0000 -161.25818 -158.41431 2.84387 1.74896 -158.15886 320.60329
7830.0000 -161.05160 -159.03959 2.01202 1.71041 -158.76922 285.40311
7835.0000 -160.67681 -158.26655 2.41027 1.72884 -158.47752 303.25792
7840.0000 -161.07711 -158.39723 2.67988 1.73015 -158.45678 295.92777
7845.0000 -161.04579 -158.60881 2.43698 1.73691 -158.34974 309.06541
7850.0000 -160.91784 -158.61123 2.30661 1.72317 -158.56720 298.17096
7855.0000 -160.91500 -158.25260 2.66239 1.75825 -158.01186 324.86762
7860.0000 -160.86609 -158.65407 2.21202 1.73607 -158.36306 307.16581
7865.0000 -160.95899 -158.99129 1.96770 1.69943 -158.94305 273.21523
7870.0000 -160.52959 -158.21271 2.31688 1.71641 -158.67424 292.52282
7875.0000 -161.01922 -158.73175 2.28747 1.73510 -158.37832 305.44557
7880.0000 -160.69317 -158.26593 2.42724 1.72840 -158.48449 300.11675
7885.0000 -160.89661 -158.91113 1.98548 1.74564 -158.21146 316.24158
7890.0000 -160.91226 -158.62823 2.28403 1.73089 -158.44500 296.78818
7895.0000 -160.65011 -158.01493 2.63517 1.73153 -158.43491 302.11873
7900.0000 -160.79431 -158.18995 2.60436 1.75760 -158.02209 325.97205
7905.0000 -161.09431 -158.83159 2.26273 1.72632 -158.51729 296.58267
7910.0000 -161.18383 -158.92223 2.26160 1.69314 -159.04270 269.32403
7915.0000 -160.75387 -158.40587 2.34800 1.72087 -158.60357 299.04318
7920.0000 -160.62963 -158.12779 2.50184 1.74683 -158.19258 315.69254
7925.0000 -160.86857 -158.28734 2.58123 1.74985 -158.14477 319.09014
7930.0000 -160.92617 -158.74366 2.18251 1.72177 -158.58934 293.95839
7935.0000 -160.96694 -158.61597 2.35097 1.71019 -158.77270 283.04709
7940.0000 -160.91963 -158.03243 2.88720 1.73200 -158.42740 304.51245
7945.0000 -160.80682 -157.94554 2.86128 1.76869 -157.84644 336.82264
7950.0000 -160.33893 -157.82316 2.51577 1.75238 -158.10471 323.09311
7955.0000 -160.71012 -157.64236 3.06776 1.78184 -157.63832 346.27699
7960.0000 -160.81601 -158.05419 2.76182 1.76882 -157.84448 328.24234
7965.0000 -161.03485 -158.42929 2.60556 1.73742 -158.34168 305.07334
7970.0000 -161.30788 -158.60602 2.70187 1.73652 -158.35580 309.27594
7975.0000 -161.19484 -159.01465 2.18019 1.70726 -158.81918 278.47967
7980.0000 -161.00740 -158.59885 2.40855 1.71358 -158.71913 289.13757
7985.0000 -160.39736 -157.76730 2.63005 1.75271 -158.09946 322.67273
7990.0000 -160.34807 -157.42006 2.92801 1.77216 -157.79152 328.88632
7995.0000 -160.94541 -158.46800 2.47741 1.76705 -157.87247 321.07197
8000.0000 -160.98475 -158.70806 2.27670 1.72416 -158.55154 282.77681
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 12 [min], 32.0509189 [s].
main_MD> Deallocating global variables
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