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nanoparticlesims/growth_Melting_Silver_ICO_3269/freezeSims/run_59/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_59.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 = 59 ntipo2 = 0
read_input> Finish reading input
main_MD> Allocating global variables
main_MD> Number of outputs that will be created: 1950
main_MD> Size of nv and nvoiz: 59 5900
main_MD> Size of nv and nvoiz: 59 5900
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 = 59
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> 3.7406737883572933E-002 -1.7246280168352401E-002 9.2668717848409642E-003 initial drift of cluster / NP1 for coalescence
init> 0.29451070037227306 0.29514313564284467 0.29091336888703928 scaling for velocity /for coalescence NP1
init.f90 > facguy = 3.8636475073610616E-003
preparo> IN BIGVOI : LIMIT 1.2247448652052084 1.2247448652052084 1.2247448652052084
preparo> END t=0 TIME STEP
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.70848 -2.69630 -10.75793
force_rgl> df(natom) -2.99273 -1.08030 -0.14754
preparo> THERMALIZATION PROCESS AT 1288.8217505255852
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -129.83194949146827 6.4612400682464184 -136.29318955971468 6.2555731072456132E-004
preparo> END THERMALISATION ON NPAST DEFINE IN PARACLUSTER MODULE
main_MD> Time-loop is starting for freezing
main_MD> Now the computation of EXECUTION TIME starts
main_MD> Running from loop 1 to 39
FREEZING PROCESS: loop number 1 T-loop= 1270.0000000000000
main_MD> interactions number 1 at Temperature= 1270.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.72932 -0.94420 -1.63953
force_rgl> df(natom) 0.19933 -1.15174 0.52750
5.0000 -135.18731 -126.69802 8.48929 3.03988 -127.97938 1183.98275
10.0000 -136.46273 -126.35746 10.10527 3.14266 -126.42166 1280.06097
15.0000 -135.51078 -125.56013 9.95064 3.19727 -125.59396 1352.44626
20.0000 -135.80422 -127.33234 8.47188 3.09358 -127.16543 1234.87962
25.0000 -135.90855 -125.75153 10.15702 3.13803 -126.49179 1295.35865
30.0000 -135.59930 -125.43454 10.16476 3.12884 -126.63110 1282.75184
35.0000 -134.76643 -123.88233 10.88410 3.24927 -124.80597 1386.60457
40.0000 -136.15808 -126.39113 9.76695 3.20200 -125.52242 1342.95685
45.0000 -135.67467 -126.80730 8.86737 3.13450 -126.54528 1284.59329
50.0000 -136.41754 -127.35009 9.06745 3.12984 -126.61598 1320.56622
55.0000 -136.02208 -127.27802 8.74406 3.03298 -128.08385 1202.54321
60.0000 -136.55053 -125.45555 11.09498 3.11933 -126.77521 1258.91731
65.0000 -134.75237 -125.80309 8.94928 3.23164 -125.07314 1368.42059
70.0000 -135.11592 -126.52112 8.59480 3.18307 -125.80928 1292.65534
75.0000 -135.86035 -125.48000 10.38036 3.24167 -124.92111 1366.23093
80.0000 -136.65883 -127.49919 9.15964 3.14076 -126.45045 1272.15001
85.0000 -138.73556 -129.21512 9.52044 3.05506 -127.74923 1265.56155
90.0000 -138.23025 -127.90693 10.32331 3.02327 -128.23107 1177.91146
95.0000 -136.63739 -127.47154 9.16585 3.13623 -126.51910 1273.41064
100.0000 -137.05366 -127.75160 9.30206 3.04799 -127.85642 1224.62334
105.0000 -136.89100 -127.68179 9.20921 3.08751 -127.25744 1263.77440
110.0000 -135.02156 -125.93544 9.08611 3.15564 -126.22500 1305.73766
115.0000 -135.63173 -123.83491 11.79681 3.21008 -125.39987 1346.02912
120.0000 -136.75416 -125.53510 11.21906 3.22366 -125.19412 1390.83182
125.0000 -136.29417 -125.48350 10.81067 3.22297 -125.20447 1335.36136
130.0000 -137.26547 -126.32510 10.94036 3.13597 -126.52303 1318.52216
135.0000 -135.81724 -127.10875 8.70849 3.15714 -126.20214 1269.99310
140.0000 -138.32035 -127.43910 10.88125 3.12271 -126.72397 1298.84042
145.0000 -136.70100 -127.30550 9.39550 3.10388 -127.00936 1275.84672
150.0000 -135.31298 -125.64703 9.66595 3.11069 -126.90616 1283.98190
155.0000 -134.49217 -125.23812 9.25405 3.21138 -125.38016 1359.08683
160.0000 -136.17481 -126.77278 9.40203 3.10101 -127.05283 1259.54945
165.0000 -137.16102 -126.85933 10.30168 3.10896 -126.93246 1297.07692
170.0000 -136.80650 -126.28577 10.52073 3.11886 -126.78239 1323.34966
175.0000 -136.82036 -127.11276 9.70760 3.08687 -127.26712 1288.23518
180.0000 -136.75988 -126.98114 9.77874 3.20636 -125.45622 1280.08472
185.0000 -137.33244 -126.36419 10.96826 3.11362 -126.86173 1262.48682
190.0000 -138.78231 -127.87407 10.90824 3.10254 -127.02969 1286.81271
195.0000 -136.07186 -128.29212 7.77975 2.99215 -128.70275 1217.43190
200.0000 -136.88548 -127.82112 9.06436 3.11065 -126.90676 1290.65683
205.0000 -136.09868 -126.85712 9.24156 3.02131 -128.26070 1182.81201
210.0000 -135.33508 -126.89508 8.44000 3.08245 -127.33422 1274.62423
215.0000 -136.56448 -128.12880 8.43568 3.10423 -127.00405 1274.29950
220.0000 -138.85845 -129.40065 9.45780 2.95436 -129.27550 1168.96037
225.0000 -138.03370 -127.51614 10.51756 3.03287 -128.08553 1185.59329
230.0000 -135.47479 -125.44852 10.02628 3.09437 -127.15356 1277.50697
235.0000 -135.06519 -125.46759 9.59760 3.14148 -126.43955 1257.93921
240.0000 -133.49044 -124.10474 9.38570 3.18102 -125.84030 1281.41190
245.0000 -135.20786 -125.70211 9.50575 3.16470 -126.08757 1275.64449
250.0000 -137.99296 -125.91439 12.07857 3.14743 -126.34935 1316.77142
FREEZING PROCESS: loop number 2 T-loop= 1245.0000000000000
main_MD> interactions number 2 at Temperature= 1245.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.17452 -1.52692 -1.34821
force_rgl> df(natom) 2.32557 -0.56680 -1.71394
255.0000 -137.51724 -128.65600 8.86124 3.04509 -127.90040 1220.10215
260.0000 -138.20098 -128.90607 9.29491 2.99307 -128.68875 1202.25871
265.0000 -134.81692 -125.72113 9.09579 3.04113 -127.96037 1215.97115
270.0000 -135.89491 -125.33086 10.56405 3.19558 -125.61963 1291.31941
275.0000 -140.15402 -130.31266 9.84136 3.01706 -128.32525 1227.81847
280.0000 -136.90935 -128.53765 8.37170 2.92014 -129.79402 1117.03166
285.0000 -135.67748 -124.89897 10.77851 3.07238 -127.48675 1258.70389
290.0000 -137.58757 -129.54721 8.04036 3.00990 -128.43373 1187.31599
295.0000 -138.47041 -128.84696 9.62345 2.92290 -129.75217 1117.31716
300.0000 -134.90871 -125.69026 9.21845 3.05185 -127.79798 1224.08852
305.0000 -135.37561 -126.32684 9.04877 3.09945 -127.07652 1279.45586
310.0000 -134.27284 -126.38257 7.89027 3.21361 -125.34641 1305.61172
315.0000 -136.14719 -127.30738 8.83981 3.12742 -126.65261 1271.34586
320.0000 -135.66341 -126.79270 8.87071 3.08825 -127.24635 1247.33365
325.0000 -136.31971 -126.64966 9.67005 3.08259 -127.33210 1262.18755
330.0000 -137.97951 -128.97632 9.00319 2.95692 -129.23657 1127.31677
335.0000 -139.09253 -127.88992 11.20260 2.94059 -129.48416 1135.96060
340.0000 -137.55540 -129.17608 8.37933 3.03412 -128.06657 1222.36480
345.0000 -137.69671 -127.49337 10.20335 3.03604 -128.03760 1200.79817
350.0000 -137.28035 -126.75877 10.52159 3.09175 -127.19320 1257.22195
355.0000 -137.89064 -127.87021 10.02043 3.09188 -127.19127 1205.17616
360.0000 -135.22608 -124.65643 10.56965 3.13036 -126.60811 1312.53039
365.0000 -135.09932 -125.52283 9.57649 3.26886 -124.50906 1370.38150
370.0000 -134.94763 -127.52598 7.42165 3.06400 -127.61384 1201.57987
375.0000 -138.49902 -130.75565 7.74337 2.95703 -129.23504 1160.96450
380.0000 -137.50811 -128.91003 8.59807 2.88604 -130.31077 1122.04069
385.0000 -137.44457 -128.43016 9.01440 2.96943 -129.04704 1186.38099
390.0000 -138.58869 -130.46242 8.12627 2.95373 -129.28496 1173.13926
395.0000 -139.35857 -129.26008 10.09849 2.95192 -129.31239 1185.11234
400.0000 -136.06885 -127.56549 8.50336 2.93449 -129.57655 1131.66198
405.0000 -135.65535 -125.87486 9.78049 3.11506 -126.83993 1284.79657
410.0000 -134.95439 -126.38127 8.57312 3.09913 -127.08131 1243.83072
415.0000 -138.49128 -128.16629 10.32499 3.13746 -126.50052 1264.23450
420.0000 -138.52132 -128.68691 9.83441 2.96280 -129.14745 1168.93436
425.0000 -137.04062 -127.47652 9.56410 3.04788 -127.85809 1238.19921
430.0000 -136.86462 -128.99025 7.87437 3.03008 -128.12783 1211.54982
435.0000 -138.57444 -129.72463 8.84981 2.96076 -129.17850 1132.12476
440.0000 -137.55784 -125.92160 11.63624 3.08420 -127.30772 1258.32182
445.0000 -134.75381 -127.31799 7.43582 3.12454 -126.69631 1258.49123
450.0000 -137.53168 -128.47852 9.05316 3.01562 -128.34694 1172.56446
455.0000 -136.54749 -127.03591 9.51158 3.05913 -127.68755 1244.63097
460.0000 -134.34634 -126.69985 7.64649 3.10742 -126.95567 1229.22338
465.0000 -137.52524 -127.74207 9.78317 3.09559 -127.13506 1208.91766
470.0000 -136.64389 -126.30734 10.33655 3.10365 -127.01292 1259.86646
475.0000 -136.47515 -126.27196 10.20318 3.13893 -126.47821 1311.06643
480.0000 -137.27984 -126.97724 10.30260 3.11887 -126.78220 1330.37109
485.0000 -137.13409 -128.79664 8.33745 3.05721 -127.71673 1213.77957
490.0000 -137.93331 -127.14933 10.78397 3.05680 -127.72290 1233.54459
495.0000 -136.42582 -126.53905 9.88678 3.07428 -127.45801 1235.50838
500.0000 -139.16917 -130.34925 8.81992 3.03246 -128.09186 1221.88147
FREEZING PROCESS: loop number 3 T-loop= 1220.0000000000000
main_MD> interactions number 3 at Temperature= 1220.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.60600 -2.08822 -1.51106
force_rgl> df(natom) 1.16923 1.07221 -0.04419
505.0000 -137.67280 -128.72539 8.94741 2.94695 -129.38779 1141.63557
510.0000 -136.41617 -126.64987 9.76630 3.03252 -128.09095 1227.21300
515.0000 -136.81796 -128.43087 8.38709 3.04092 -127.96358 1228.55831
520.0000 -139.20326 -129.05223 10.15103 2.98112 -128.86988 1192.33879
525.0000 -136.88643 -128.72009 8.16634 3.04263 -127.93767 1218.95360
530.0000 -137.37491 -127.80780 9.56712 3.04519 -127.89892 1222.33065
535.0000 -134.73979 -124.27460 10.46520 3.17047 -126.00016 1316.07052
540.0000 -135.69177 -126.79392 8.89785 3.29613 -124.09576 1440.81097
545.0000 -134.09307 -125.50925 8.58382 3.15032 -126.30551 1292.66621
550.0000 -138.18051 -128.78182 9.39869 3.12089 -126.75161 1263.62307
555.0000 -136.31091 -127.12799 9.18292 2.98861 -128.75636 1186.63331
560.0000 -139.12230 -130.19729 8.92500 3.02811 -128.15768 1201.40642
565.0000 -137.81300 -128.24963 9.56337 2.94583 -129.40464 1167.43939
570.0000 -138.02682 -128.59484 9.43198 3.00574 -128.49679 1181.69512
575.0000 -136.55884 -127.84121 8.71763 3.02959 -128.13535 1191.68786
580.0000 -135.88274 -127.39113 8.49161 3.02791 -128.16071 1207.89894
585.0000 -136.01556 -127.39883 8.61673 3.10615 -126.97503 1276.25787
590.0000 -138.63859 -130.31319 8.32540 3.00464 -128.51342 1186.47064
595.0000 -137.37559 -128.50992 8.86567 3.00008 -128.58257 1172.54199
600.0000 -139.34249 -131.01456 8.32793 2.96294 -129.14547 1157.29316
605.0000 -135.70036 -127.78858 7.91178 2.95594 -129.25149 1166.92858
610.0000 -137.33672 -127.12411 10.21261 3.13901 -126.47699 1262.98102
615.0000 -135.49077 -124.18451 11.30626 3.23833 -124.97180 1348.15431
620.0000 -136.43188 -125.74295 10.68892 3.16907 -126.02141 1271.12510
625.0000 -136.73528 -126.59272 10.14256 3.11660 -126.81659 1300.22202
630.0000 -137.44058 -129.25834 8.18224 3.09390 -127.16064 1296.29326
635.0000 -137.68977 -128.07773 9.61204 2.96374 -129.13325 1183.81067
640.0000 -138.41200 -130.90988 7.50211 2.95971 -129.19429 1178.95624
645.0000 -137.39320 -128.25960 9.13360 2.91868 -129.81625 1124.56667
650.0000 -138.17387 -129.51135 8.66252 3.02499 -128.20496 1189.43731
655.0000 -138.92303 -129.95469 8.96834 3.00953 -128.43923 1192.23308
660.0000 -137.17605 -127.33544 9.84061 3.04321 -127.92884 1194.74008
665.0000 -138.35024 -130.37525 7.97498 2.89783 -130.13219 1122.18778
670.0000 -138.41208 -130.34790 8.06417 2.86602 -130.61432 1124.00179
675.0000 -139.28045 -130.99370 8.28675 2.84268 -130.96801 1017.53645
680.0000 -139.34921 -129.11997 10.22923 2.93254 -129.60612 1156.87995
685.0000 -136.96647 -128.19341 8.77306 3.01313 -128.38473 1200.52081
690.0000 -137.72989 -129.18802 8.54186 3.09542 -127.13762 1223.02549
695.0000 -138.38800 -129.59531 8.79269 3.02607 -128.18857 1203.47244
700.0000 -138.19177 -128.46761 9.72416 2.95126 -129.32247 1118.31064
705.0000 -135.98136 -126.10353 9.87783 3.11669 -126.81527 1249.53541
710.0000 -136.93065 -126.70117 10.22949 3.14837 -126.33508 1278.77038
715.0000 -137.16985 -127.56201 9.60784 3.13841 -126.48607 1280.15566
720.0000 -135.63498 -124.74428 10.89070 3.16220 -126.12552 1328.03362
725.0000 -135.79554 -124.27512 11.52042 3.25771 -124.67807 1365.14519
730.0000 -136.89742 -125.08582 11.81160 3.28874 -124.20773 1407.89598
735.0000 -137.03848 -126.03295 11.00553 3.13568 -126.52744 1272.68654
740.0000 -137.93466 -128.34109 9.59357 3.07576 -127.43562 1271.17757
745.0000 -136.21943 -126.48412 9.73531 3.11545 -126.83411 1287.70548
750.0000 -134.05919 -126.69994 7.35925 3.12944 -126.62196 1288.87049
FREEZING PROCESS: loop number 4 T-loop= 1195.0000000000000
main_MD> interactions number 4 at Temperature= 1195.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.82089 -1.14149 0.41908
force_rgl> df(natom) -3.69199 -2.27988 2.45840
755.0000 -136.71892 -127.16801 9.55091 3.04096 -127.96300 1215.21188
760.0000 -136.09088 -124.20271 11.88817 3.16036 -126.15345 1294.98719
765.0000 -136.08778 -127.19921 8.88858 3.21756 -125.28659 1339.92312
770.0000 -136.13561 -125.90928 10.22633 3.13458 -126.54418 1275.57860
775.0000 -136.54880 -125.74814 10.80066 3.19462 -125.63412 1345.75740
780.0000 -136.18096 -127.57510 8.60586 3.08785 -127.25237 1239.58410
785.0000 -137.08741 -128.45397 8.63344 3.07118 -127.50493 1252.02178
790.0000 -136.10848 -127.33765 8.77083 3.00134 -128.56340 1197.30082
795.0000 -137.14081 -127.81551 9.32530 3.08031 -127.36667 1205.95971
800.0000 -139.45855 -130.78139 8.67717 2.96891 -129.05485 1151.86823
805.0000 -138.51792 -130.07019 8.44773 2.90255 -130.06058 1104.06773
810.0000 -139.57418 -129.67596 9.89823 2.87278 -130.51183 1109.73893
815.0000 -137.01711 -128.05303 8.96408 3.01673 -128.33017 1193.26100
820.0000 -136.55343 -127.63466 8.91878 3.08357 -127.31713 1249.88269
825.0000 -135.24220 -125.78441 9.45779 3.05796 -127.70533 1257.22873
830.0000 -136.52360 -126.77729 9.74631 3.08353 -127.31776 1227.68722
835.0000 -135.68067 -126.52944 9.15123 3.15223 -126.27665 1300.89236
840.0000 -134.92641 -123.45398 11.47243 3.24770 -124.82967 1344.76932
845.0000 -137.37728 -126.27376 11.10351 3.25459 -124.72528 1374.83813
850.0000 -138.49215 -129.94944 8.54270 3.02503 -128.20442 1242.92790
855.0000 -137.61466 -130.15873 7.45593 2.89572 -130.16420 1124.33038
860.0000 -137.59862 -127.68616 9.91246 2.97217 -129.00548 1171.67351
865.0000 -136.09035 -127.76426 8.32609 3.11578 -126.82907 1271.93836
870.0000 -137.44247 -129.14571 8.29676 3.06572 -127.58776 1232.66369
875.0000 -136.46759 -128.04626 8.42133 3.05002 -127.82560 1238.48146
880.0000 -137.57461 -128.12693 9.44768 3.08872 -127.23913 1255.72807
885.0000 -135.77747 -127.38082 8.39665 3.01801 -128.31083 1199.85560
890.0000 -138.14469 -127.66459 10.48010 3.07126 -127.50375 1236.05675
895.0000 -136.35781 -128.46097 7.89685 3.04866 -127.84630 1229.53810
900.0000 -134.97742 -126.31965 8.65778 3.12752 -126.65117 1231.34802
905.0000 -138.07360 -129.60236 8.47124 3.09677 -127.11718 1283.60881
910.0000 -138.23781 -131.19807 7.03974 2.89004 -130.25019 1096.34550
915.0000 -137.02788 -129.13958 7.88830 2.88223 -130.36852 1127.27280
920.0000 -137.52958 -128.17639 9.35319 3.03733 -128.01799 1208.50435
925.0000 -136.82406 -127.14094 9.68312 3.05627 -127.73088 1225.96703
930.0000 -135.64158 -127.05808 8.58350 3.13119 -126.59550 1302.91244
935.0000 -135.86034 -126.27920 9.58115 3.08221 -127.33788 1235.76822
940.0000 -137.24156 -126.71894 10.52261 3.14986 -126.31250 1259.64787
945.0000 -137.96752 -129.89418 8.07333 3.04409 -127.91550 1252.49765
950.0000 -136.87118 -128.06475 8.80643 2.96947 -129.04638 1185.35319
955.0000 -136.40113 -128.39551 8.00562 3.03941 -127.98645 1236.40836
960.0000 -136.59106 -127.59470 8.99636 2.96766 -129.07384 1185.57046
965.0000 -136.28944 -127.34225 8.94719 3.05455 -127.75695 1240.97448
970.0000 -134.75888 -126.99446 7.76441 3.10455 -126.99931 1217.64035
975.0000 -136.83752 -125.42264 11.41488 3.13625 -126.51883 1272.60691
980.0000 -136.74140 -126.46820 10.27320 3.10370 -127.01216 1258.94005
985.0000 -136.42052 -128.13761 8.28291 3.10839 -126.94102 1244.73991
990.0000 -138.37367 -129.80476 8.56891 2.94875 -129.36042 1126.23906
995.0000 -137.92767 -129.37089 8.55678 3.00255 -128.54513 1192.94051
1000.0000 -137.60885 -128.89987 8.70898 2.98410 -128.82464 1179.13176
FREEZING PROCESS: loop number 5 T-loop= 1170.0000000000000
main_MD> interactions number 5 at Temperature= 1170.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.31716 2.81811 -3.27154
force_rgl> df(natom) 1.55588 5.00446 1.30300
1005.0000 -139.49315 -130.41447 9.07868 2.90190 -130.07046 1089.94118
1010.0000 -139.62349 -129.33413 10.28936 2.86240 -130.66906 1110.45903
1015.0000 -138.30617 -127.83467 10.47150 2.98100 -128.87170 1181.66246
1020.0000 -139.85369 -130.85244 9.00125 2.95365 -129.28626 1154.36888
1025.0000 -138.20013 -130.66137 7.53876 2.86308 -130.65888 1104.38728
1030.0000 -136.53810 -126.77866 9.75945 2.93279 -129.60230 1102.03037
1035.0000 -137.70553 -128.42965 9.27588 3.08744 -127.25860 1277.43513
1040.0000 -138.49282 -128.99642 9.49640 2.91722 -129.83830 1140.71796
1045.0000 -138.10645 -129.91761 8.18885 2.92225 -129.76203 1141.06677
1050.0000 -139.60604 -131.00271 8.60334 2.87255 -130.51534 1089.46527
1055.0000 -138.24594 -129.80439 8.44155 2.89200 -130.22047 1107.80884
1060.0000 -138.24034 -129.04930 9.19104 2.82439 -131.24521 1056.72708
1065.0000 -138.00590 -126.91779 11.08811 3.05399 -127.76551 1265.93011
1070.0000 -135.24080 -126.14473 9.09607 3.08722 -127.26186 1252.41450
1075.0000 -133.50447 -122.52718 10.97729 3.32307 -123.68741 1429.89935
1080.0000 -136.81834 -125.90677 10.91157 3.28651 -124.24160 1410.71273
1085.0000 -135.25869 -126.42281 8.83588 3.11512 -126.83911 1277.01114
1090.0000 -138.52680 -129.13493 9.39187 3.11627 -126.82166 1294.40805
1095.0000 -138.21196 -128.94253 9.26943 3.00530 -128.50337 1186.65120
1100.0000 -137.79410 -127.99356 9.80055 3.02084 -128.26793 1219.02648
1105.0000 -140.16837 -131.73065 8.43773 2.85888 -130.72248 1077.94891
1110.0000 -138.84335 -130.80636 8.03700 2.77846 -131.94127 1019.42329
1115.0000 -136.09735 -128.33929 7.75806 3.01815 -128.30859 1216.15485
1120.0000 -138.32822 -126.28662 12.04160 3.08193 -127.34206 1271.36411
1125.0000 -135.66857 -127.67348 7.99509 3.06302 -127.62862 1243.84073
1130.0000 -138.35989 -126.93245 11.42744 3.12478 -126.69261 1268.39519
1135.0000 -136.96142 -126.55512 10.40631 3.09810 -127.09698 1255.05821
1140.0000 -137.15615 -127.17475 9.98140 3.13301 -126.56795 1288.16373
1145.0000 -135.31299 -127.03648 8.27651 3.09832 -127.09366 1272.28541
1150.0000 -138.06041 -130.02826 8.03215 2.99674 -128.63317 1195.25685
1155.0000 -139.88845 -130.25733 9.63112 2.94171 -129.46717 1136.30406
1160.0000 -138.32131 -130.50073 7.82059 2.88146 -130.38024 1106.90951
1165.0000 -138.17623 -130.15987 8.01636 2.92870 -129.66433 1173.99472
1170.0000 -138.29016 -129.44992 8.84024 2.91536 -129.86649 1133.02707
1175.0000 -137.53848 -125.94350 11.59498 2.99556 -128.65099 1182.52222
1180.0000 -135.83675 -127.75469 8.08206 3.18158 -125.83177 1283.12685
1185.0000 -136.39744 -127.18847 9.20897 3.07738 -127.41107 1231.76784
1190.0000 -137.33903 -128.10602 9.23301 3.04535 -127.89648 1264.52583
1195.0000 -138.36701 -128.50539 9.86162 3.04451 -127.90913 1218.60585
1200.0000 -137.51752 -129.25033 8.26719 2.92379 -129.73878 1149.12112
1205.0000 -135.81863 -126.58743 9.23120 3.04053 -127.96949 1226.36398
1210.0000 -135.65419 -126.03719 9.61701 3.09003 -127.21925 1282.10836
1215.0000 -136.08905 -127.13416 8.95489 3.17766 -125.89119 1350.62759
1220.0000 -136.93924 -128.97183 7.96741 3.02279 -128.23830 1197.72453
1225.0000 -138.52676 -130.06213 8.46464 2.91207 -129.91629 1152.28969
1230.0000 -137.75577 -129.40070 8.35507 2.97471 -128.96707 1190.69491
1235.0000 -139.70253 -130.23688 9.46564 2.84559 -130.92381 1098.57444
1240.0000 -137.16951 -127.38057 9.78894 2.97394 -128.97870 1155.01185
1245.0000 -136.47110 -127.86572 8.60538 3.00456 -128.51465 1229.90257
1250.0000 -137.96507 -129.42931 8.53576 3.00115 -128.56625 1179.48451
FREEZING PROCESS: loop number 6 T-loop= 1145.0000000000000
main_MD> interactions number 6 at Temperature= 1145.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.54171 -0.83217 -1.31864
force_rgl> df(natom) -1.08770 2.91952 2.14195
1255.0000 -138.79750 -130.52318 8.27432 2.94348 -129.44027 1154.17567
1260.0000 -139.09412 -129.16080 9.93332 2.90335 -130.04844 1148.94902
1265.0000 -136.57910 -128.95992 7.61918 2.87657 -130.45435 1106.42478
1270.0000 -137.96219 -129.85340 8.10878 3.00092 -128.56979 1196.14868
1275.0000 -138.70850 -130.44047 8.26803 2.91149 -129.92517 1101.04783
1280.0000 -137.69302 -129.07726 8.61576 2.98293 -128.84248 1180.40157
1285.0000 -138.14759 -129.50030 8.64729 2.98965 -128.74053 1185.28642
1290.0000 -139.17263 -131.00562 8.16702 2.92260 -129.75682 1120.17517
1295.0000 -138.85002 -131.71206 7.13796 2.80506 -131.53815 1048.49018
1300.0000 -139.26887 -131.28486 7.98401 2.77269 -132.02866 1040.96649
1305.0000 -140.72416 -132.38868 8.33548 2.72040 -132.82119 1020.77497
1310.0000 -137.94530 -130.28682 7.65848 2.83628 -131.06504 1096.11113
1315.0000 -138.33395 -130.76823 7.56571 2.87972 -130.40665 1130.62637
1320.0000 -140.17395 -131.27331 8.90063 2.81760 -131.34808 1035.46568
1325.0000 -140.84866 -132.71659 8.13207 2.73503 -132.59950 997.20499
1330.0000 -139.35315 -132.09353 7.25961 2.71857 -132.84894 976.89425
1335.0000 -139.74743 -131.79449 7.95295 2.77566 -131.98367 1017.69385
1340.0000 -138.86964 -129.97128 8.89836 2.83029 -131.15578 1056.73933
1345.0000 -137.33233 -128.40427 8.92807 2.95320 -129.29305 1163.29770
1350.0000 -137.99706 -128.59975 9.39731 2.93765 -129.52864 1145.50455
1355.0000 -138.15330 -127.61845 10.53485 3.01838 -128.30521 1228.11199
1360.0000 -136.50455 -127.60784 8.89672 3.02643 -128.18320 1183.75354
1365.0000 -138.37987 -130.20094 8.17893 3.00835 -128.45718 1180.20862
1370.0000 -139.93184 -130.55370 9.37814 2.83954 -131.01553 1072.18036
1375.0000 -137.79320 -129.74861 8.04459 2.92948 -129.65254 1131.92458
1380.0000 -140.79246 -133.00674 7.78572 2.84349 -130.95578 1073.72923
1385.0000 -139.00661 -132.24172 6.76489 2.71815 -132.85531 993.53027
1390.0000 -139.98066 -132.98285 6.99781 2.74245 -132.48703 986.27467
1395.0000 -138.96217 -130.84443 8.11774 2.77938 -131.92736 1012.24792
1400.0000 -137.66197 -130.35566 7.30632 2.85943 -130.71419 1097.90343
1405.0000 -139.02906 -131.07738 7.95168 2.85196 -130.82729 1068.19006
1410.0000 -138.22614 -130.01187 8.21427 2.89386 -130.19233 1110.56898
1415.0000 -136.96853 -128.15613 8.81240 2.98225 -128.85280 1155.38239
1420.0000 -141.66098 -132.61060 9.05038 2.85483 -130.78379 1066.84002
1425.0000 -140.88515 -133.47321 7.41194 2.76928 -132.08033 998.53798
1430.0000 -138.32293 -130.34379 7.97914 2.73080 -132.66354 1011.95427
1435.0000 -138.46817 -129.05404 9.41413 2.93305 -129.59838 1142.38400
1440.0000 -137.25310 -128.60684 8.64626 2.93970 -129.49764 1139.35077
1445.0000 -137.50191 -127.66669 9.83522 3.04139 -127.95638 1216.15989
1450.0000 -134.53642 -125.90891 8.62751 3.06523 -127.59517 1237.31410
1455.0000 -139.38700 -128.74860 10.63840 3.04624 -127.88301 1185.19141
1460.0000 -134.32646 -125.39204 8.93442 3.06119 -127.65639 1214.67084
1465.0000 -137.91421 -128.48394 9.43027 3.09542 -127.13753 1252.57714
1470.0000 -136.71911 -126.69163 10.02749 3.01141 -128.41088 1190.53273
1475.0000 -139.24663 -130.16150 9.08513 3.11473 -126.84490 1276.92307
1480.0000 -137.83610 -128.23747 9.59864 2.82851 -131.18270 1042.34503
1485.0000 -138.01934 -129.70430 8.31504 2.95576 -129.25420 1165.67371
1490.0000 -137.79365 -130.13032 7.66333 2.94137 -129.47234 1122.77024
1495.0000 -139.63188 -130.54553 9.08635 2.89397 -130.19072 1130.00964
1500.0000 -138.46745 -129.69191 8.77555 2.90952 -129.95505 1140.79689
FREEZING PROCESS: loop number 7 T-loop= 1120.0000000000000
main_MD> interactions number 7 at Temperature= 1120.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.77093 -2.97413 -1.97248
force_rgl> df(natom) -2.29189 0.69292 -0.20739
1505.0000 -138.65445 -129.76876 8.88568 2.93351 -129.59145 1143.80656
1510.0000 -138.63698 -130.16730 8.46969 2.91911 -129.80966 1153.34095
1515.0000 -138.98390 -131.27030 7.71360 2.82343 -131.25977 1074.63751
1520.0000 -139.53527 -129.88485 9.65042 2.86140 -130.68425 1096.12284
1525.0000 -139.03453 -131.16090 7.87364 2.85637 -130.76044 1106.46170
1530.0000 -137.69910 -128.53327 9.16583 2.89242 -130.21413 1113.90517
1535.0000 -138.92287 -129.26312 9.65976 2.97687 -128.93429 1177.16091
1540.0000 -138.08922 -129.58392 8.50529 2.95813 -129.21831 1169.10414
1545.0000 -138.92424 -130.56629 8.35795 2.86028 -130.70131 1093.74531
1550.0000 -139.02190 -130.66183 8.36007 2.83996 -131.00920 1067.97927
1555.0000 -139.55893 -130.96789 8.59105 2.85661 -130.75690 1136.59529
1560.0000 -139.18686 -129.85402 9.33285 2.84992 -130.85831 1087.20512
1565.0000 -137.92472 -129.14942 8.77530 2.99634 -128.63916 1169.16161
1570.0000 -137.30597 -129.36033 7.94565 2.93439 -129.57816 1121.26962
1575.0000 -136.40675 -127.37103 9.03572 3.03831 -128.00307 1208.67817
1580.0000 -138.28423 -130.21385 8.07038 3.02925 -128.14051 1208.36570
1585.0000 -137.58565 -128.86731 8.71835 2.99479 -128.66267 1192.39882
1590.0000 -137.27768 -128.66536 8.61233 2.96959 -129.04463 1162.67298
1595.0000 -138.10151 -130.04596 8.05554 2.95311 -129.29432 1152.01938
1600.0000 -137.69150 -130.53553 7.15597 2.90275 -130.05757 1115.22072
1605.0000 -141.29701 -132.11588 9.18113 2.85401 -130.79633 1052.96213
1610.0000 -140.16598 -133.04394 7.12204 2.72465 -132.75685 1008.05271
1615.0000 -140.01940 -132.24664 7.77276 2.81513 -131.38553 1033.64925
1620.0000 -140.40456 -131.53557 8.86899 2.74668 -132.42297 1015.10968
1625.0000 -140.59518 -130.68624 9.90894 2.81832 -131.33723 1077.72648
1630.0000 -140.27334 -130.77226 9.50108 2.82925 -131.17146 1059.88420
1635.0000 -137.87929 -128.50013 9.37915 2.89551 -130.16731 1139.14193
1640.0000 -138.43736 -129.67730 8.76006 2.96749 -129.07649 1139.18454
1645.0000 -135.98878 -128.70662 7.28215 3.00096 -128.56912 1197.61139
1650.0000 -137.62622 -128.24514 9.38108 3.09850 -127.09085 1233.39019
1655.0000 -138.46443 -131.20704 7.25738 2.89751 -130.13708 1103.23359
1660.0000 -138.62669 -130.27055 8.35614 2.80155 -131.59136 1009.83082
1665.0000 -138.42148 -130.35936 8.06212 2.88500 -130.32665 1105.88280
1670.0000 -138.97176 -129.92905 9.04271 2.88283 -130.35957 1104.65389
1675.0000 -137.93771 -131.08135 6.85636 2.86580 -130.61752 1080.23273
1680.0000 -137.98149 -128.99670 8.98479 2.95490 -129.26718 1176.50773
1685.0000 -137.15128 -129.54031 7.61097 2.94590 -129.40361 1128.09794
1690.0000 -138.20969 -129.04318 9.16651 2.92420 -129.73252 1152.59798
1695.0000 -138.94872 -132.06050 6.88823 2.88416 -130.33941 1085.79049
1700.0000 -140.93887 -133.10239 7.83648 2.73631 -132.58004 1008.13444
1705.0000 -141.27481 -132.34132 8.93349 2.71289 -132.93508 945.87147
1710.0000 -138.68038 -130.48888 8.19150 2.78412 -131.85554 1036.90959
1715.0000 -135.51595 -126.66711 8.84884 3.01431 -128.36694 1184.91796
1720.0000 -138.88825 -131.11668 7.77157 2.94590 -129.40357 1139.34622
1725.0000 -138.96929 -130.28102 8.68827 2.85575 -130.76998 1074.81138
1730.0000 -136.83279 -127.97107 8.86172 2.97070 -129.02774 1155.29405
1735.0000 -138.64024 -129.50252 9.13772 2.95270 -129.30064 1138.39385
1740.0000 -140.03836 -132.31576 7.72260 2.84315 -130.96092 1114.74915
1745.0000 -139.28252 -131.85369 7.42883 2.77251 -132.03148 998.49564
1750.0000 -137.96869 -130.19087 7.77781 2.86975 -130.55766 1088.03245
FREEZING PROCESS: loop number 8 T-loop= 1095.0000000000000
main_MD> interactions number 8 at Temperature= 1095.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -4.13885 -0.48060 0.17722
force_rgl> df(natom) -1.59695 -0.88650 0.64030
1755.0000 -140.80996 -131.82722 8.98274 2.85699 -130.75107 1109.25481
1760.0000 -137.39810 -130.38107 7.01703 2.79244 -131.72941 1024.79047
1765.0000 -139.00411 -131.47300 7.53112 2.86137 -130.68467 1101.35704
1770.0000 -139.38087 -131.50729 7.87359 2.79945 -131.62313 1084.34041
1775.0000 -137.79621 -128.62028 9.17593 2.87069 -130.54344 1060.20474
1780.0000 -138.01021 -130.17420 7.83600 2.90709 -129.99189 1109.79348
1785.0000 -140.12333 -133.40828 6.71504 2.77076 -132.05795 1040.80618
1790.0000 -141.85820 -132.80819 9.05001 2.73641 -132.57854 999.78914
1795.0000 -141.30903 -134.04753 7.26150 2.72363 -132.77228 1005.48387
1800.0000 -141.45286 -133.72240 7.73047 2.76131 -132.20116 1026.16390
1805.0000 -140.58771 -131.41055 9.17716 2.72183 -132.79947 1015.19360
1810.0000 -138.95738 -130.66069 8.29669 2.82931 -131.17063 1023.85577
1815.0000 -139.75866 -131.94821 7.81045 2.84338 -130.95743 1075.57936
1820.0000 -138.54398 -131.20712 7.33686 2.78321 -131.86932 981.98453
1825.0000 -141.53809 -132.67773 8.86036 2.79663 -131.66593 1069.80064
1830.0000 -141.79169 -134.20301 7.58867 2.66353 -133.68308 952.31800
1835.0000 -141.23993 -132.75576 8.48417 2.69913 -133.14357 970.45143
1840.0000 -139.85242 -132.18917 7.66325 2.77193 -132.04030 1012.82098
1845.0000 -137.60546 -128.67658 8.92888 2.84829 -130.88291 1095.44363
1850.0000 -137.79590 -129.71842 8.07748 2.93677 -129.54199 1119.48908
1855.0000 -140.48466 -131.56240 8.92226 2.86019 -130.70266 1090.64465
1860.0000 -138.99635 -130.05792 8.93843 2.78644 -131.82034 1053.21598
1865.0000 -138.70290 -128.63506 10.06783 2.96698 -129.08412 1172.59244
1870.0000 -138.53768 -129.91260 8.62508 2.95162 -129.31703 1162.91026
1875.0000 -140.50968 -130.12595 10.38372 2.91741 -129.83544 1147.34168
1880.0000 -138.20004 -128.92944 9.27061 2.89785 -130.13184 1130.27027
1885.0000 -139.59303 -131.77083 7.82221 2.86823 -130.58076 1098.93610
1890.0000 -138.45706 -131.04894 7.40812 2.87137 -130.53324 1089.76923
1895.0000 -139.19025 -131.62409 7.56616 2.86863 -130.57464 1093.88213
1900.0000 -139.57861 -130.96845 8.61016 2.82958 -131.16653 1041.45118
1905.0000 -138.75536 -130.96714 7.78822 2.82939 -131.16946 1070.16535
1910.0000 -139.21690 -129.45628 9.76062 2.90970 -129.95232 1124.51444
1915.0000 -139.13558 -130.13249 9.00309 2.92318 -129.74796 1142.72557
1920.0000 -137.89261 -128.92857 8.96404 2.85845 -130.72903 1070.12503
1925.0000 -138.22091 -129.72792 8.49299 2.90823 -129.97456 1143.47179
1930.0000 -138.91297 -130.22021 8.69276 2.94003 -129.49255 1166.15970
1935.0000 -139.02517 -130.71221 8.31297 2.85075 -130.84566 1094.32553
1940.0000 -139.94392 -129.70510 10.23882 2.86592 -130.61576 1062.04877
1945.0000 -136.50117 -126.88285 9.61832 3.01178 -128.40521 1152.27475
1950.0000 -136.15943 -127.31711 8.84232 3.12663 -126.66455 1324.41295
1955.0000 -138.18893 -129.30572 8.88321 3.06139 -127.65331 1254.99808
1960.0000 -138.00517 -129.30996 8.69521 2.97168 -129.01300 1198.58751
1965.0000 -139.26175 -131.81773 7.44402 2.94420 -129.42934 1165.29287
1970.0000 -138.37419 -130.10089 8.27330 2.88934 -130.26089 1102.74000
1975.0000 -138.54666 -130.52890 8.01776 2.88252 -130.36413 1096.36039
1980.0000 -138.37575 -130.26274 8.11300 2.92318 -129.74792 1141.55452
1985.0000 -139.18322 -131.05815 8.12507 2.84842 -130.88096 1102.43378
1990.0000 -138.35021 -129.32120 9.02902 2.87433 -130.48834 1105.61666
1995.0000 -138.60861 -130.02870 8.57991 2.93695 -129.53924 1138.24719
2000.0000 -140.98300 -131.23129 9.75171 2.89129 -130.23133 1104.17132
FREEZING PROCESS: loop number 9 T-loop= 1070.0000000000000
main_MD> interactions number 9 at Temperature= 1070.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.28994 -0.98392 -0.04432
force_rgl> df(natom) 0.37054 -1.76032 -4.74647
2005.0000 -140.76247 -132.10417 8.65829 2.74614 -132.43110 1011.26567
2010.0000 -139.66845 -131.61055 8.05791 2.77993 -131.91900 1025.77404
2015.0000 -139.81852 -131.30078 8.51775 2.80326 -131.56540 1081.00177
2020.0000 -139.24880 -130.45681 8.79199 2.75575 -132.28546 1013.40440
2025.0000 -140.50409 -131.66967 8.83442 2.82180 -131.28447 1064.56203
2030.0000 -139.27248 -130.69740 8.57508 2.78398 -131.85762 1040.38572
2035.0000 -135.72841 -127.03194 8.69647 3.01141 -128.41085 1184.72391
2040.0000 -138.40140 -128.68219 9.71921 2.99656 -128.63591 1166.79688
2045.0000 -138.41580 -129.79602 8.61978 3.02968 -128.13386 1180.28808
2050.0000 -138.03851 -130.28268 7.75582 2.91666 -129.84681 1112.97235
2055.0000 -139.25606 -129.24021 10.01586 2.92992 -129.64577 1116.81042
2060.0000 -140.93391 -133.10041 7.83350 2.85062 -130.84758 1081.06665
2065.0000 -139.93766 -132.26158 7.67608 2.73441 -132.60885 978.76881
2070.0000 -140.06814 -131.99379 8.07435 2.75308 -132.32589 1003.75451
2075.0000 -139.39521 -131.10639 8.28882 2.81290 -131.41931 1056.56564
2080.0000 -140.42710 -133.76540 6.66170 2.75270 -132.33170 996.98048
2085.0000 -141.39445 -133.08737 8.30707 2.67365 -133.52971 990.74019
2090.0000 -138.17999 -129.67972 8.50027 2.79908 -131.62870 1025.54590
2095.0000 -138.08289 -128.55495 9.52794 2.93111 -129.62774 1151.02482
2100.0000 -140.18399 -130.62793 9.55606 2.97335 -128.98768 1170.02752
2105.0000 -139.17352 -130.27689 8.89662 2.80526 -131.53517 1061.54173
2110.0000 -141.24810 -132.69756 8.55054 2.82751 -131.19787 1060.92969
2115.0000 -139.33125 -130.12239 9.20886 2.86491 -130.63113 1121.27018
2120.0000 -141.37142 -132.40090 8.97051 2.84186 -130.98044 1068.53833
2125.0000 -136.04579 -129.41202 6.63377 2.81726 -131.35317 1036.36264
2130.0000 -138.06905 -130.35866 7.71039 2.94906 -129.35579 1118.89871
2135.0000 -140.92010 -130.79015 10.12995 2.89011 -130.24915 1107.91432
2140.0000 -139.71339 -132.02148 7.69191 2.77467 -131.99873 1061.52356
2145.0000 -138.93198 -132.60947 6.32250 2.76432 -132.15549 1046.28324
2150.0000 -137.81363 -130.07992 7.73371 2.81771 -131.34646 1052.00198
2155.0000 -138.20768 -130.20558 8.00210 2.91289 -129.90397 1104.11436
2160.0000 -138.88450 -131.27250 7.61200 2.81832 -131.33722 1057.29788
2165.0000 -139.50901 -131.39784 8.11117 2.83589 -131.07088 1058.23976
2170.0000 -139.27930 -131.63753 7.64177 2.76657 -132.12151 1035.87570
2175.0000 -138.56725 -130.09552 8.47173 2.84683 -130.90504 1092.44768
2180.0000 -139.18966 -132.05508 7.13458 2.84755 -130.89424 1119.81803
2185.0000 -136.94387 -128.35863 8.58523 2.86842 -130.57796 1067.04653
2190.0000 -139.53201 -130.54251 8.98950 2.91962 -129.80187 1155.35967
2195.0000 -139.37336 -131.60058 7.77278 2.82644 -131.21405 1082.97077
2200.0000 -138.88091 -129.93710 8.94382 2.88114 -130.38511 1078.54199
2205.0000 -139.51485 -130.21548 9.29936 2.91887 -129.81336 1092.90147
2210.0000 -139.62016 -130.76921 8.85095 2.90050 -130.09173 1133.46730
2215.0000 -139.12436 -131.02075 8.10361 2.84020 -131.00559 1097.45175
2220.0000 -137.73123 -130.16381 7.56742 2.89820 -130.12661 1148.90365
2225.0000 -140.14993 -131.91200 8.23793 2.80769 -131.49823 1039.10637
2230.0000 -137.93622 -130.71934 7.21688 2.86442 -130.63857 1072.98466
2235.0000 -138.30228 -128.36841 9.93388 2.88332 -130.35212 1140.12831
2240.0000 -137.08976 -129.63450 7.45525 2.96631 -129.09438 1189.73217
2245.0000 -137.98424 -128.41058 9.57366 2.97680 -128.93532 1183.48468
2250.0000 -139.14447 -131.16876 7.97571 2.94997 -129.34202 1154.83773
FREEZING PROCESS: loop number 10 T-loop= 1045.0000000000000
main_MD> interactions number 10 at Temperature= 1045.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.36990 -0.00258 -0.70069
force_rgl> df(natom) 1.22551 0.31537 -2.32247
2255.0000 -139.11547 -130.94991 8.16555 2.84427 -130.94393 1096.69557
2260.0000 -139.45199 -131.18073 8.27125 2.83091 -131.14635 1046.13771
2265.0000 -138.29964 -131.16443 7.13522 2.85693 -130.75204 1057.19804
2270.0000 -138.83616 -130.35927 8.47689 2.92349 -129.74322 1137.56822
2275.0000 -139.85783 -130.50038 9.35745 2.94016 -129.49061 1154.66051
2280.0000 -138.34416 -131.37846 6.96570 2.83375 -131.10337 1054.75015
2285.0000 -138.88729 -130.59017 8.29712 2.85545 -130.77438 1099.41595
2290.0000 -139.04582 -130.89811 8.14771 2.81406 -131.40174 1054.91937
2295.0000 -140.63604 -133.07449 7.56155 2.76340 -132.16955 985.61133
2300.0000 -139.77242 -132.44092 7.33150 2.70673 -133.02844 998.84232
2305.0000 -138.26622 -130.93529 7.33093 2.81481 -131.39034 1062.86322
2310.0000 -137.65519 -130.23547 7.41972 2.86310 -130.65849 1056.25607
2315.0000 -139.66847 -129.97832 9.69015 2.90479 -130.02661 1126.58650
2320.0000 -138.52018 -130.92994 7.59024 2.85410 -130.79485 1097.28942
2325.0000 -140.35367 -130.74058 9.61309 2.84724 -130.89891 1039.22502
2330.0000 -139.87903 -131.97494 7.90409 2.73171 -132.64984 980.44997
2335.0000 -140.34867 -132.76542 7.58325 2.77547 -131.98654 1051.80701
2340.0000 -140.22759 -133.98830 6.23929 2.63872 -134.05909 933.92083
2345.0000 -141.26181 -135.23668 6.02513 2.60130 -134.62615 902.57080
2350.0000 -141.40921 -134.39701 7.01221 2.62604 -134.25122 929.75710
2355.0000 -138.87698 -132.11329 6.76369 2.71707 -132.87161 997.35944
2360.0000 -138.68710 -132.58286 6.10424 2.74937 -132.38220 999.14613
2365.0000 -141.43748 -133.91453 7.52295 2.71116 -132.96130 979.83934
2370.0000 -139.67634 -131.61553 8.06080 2.74568 -132.43813 1012.42906
2375.0000 -140.72710 -132.45435 8.27274 2.78714 -131.80980 1056.72465
2380.0000 -138.81719 -130.71676 8.10043 2.80046 -131.60786 1008.23319
2385.0000 -139.44556 -131.09344 8.35211 2.80724 -131.50509 1049.93179
2390.0000 -142.29019 -133.99218 8.29801 2.72851 -132.69824 998.86884
2395.0000 -140.18264 -132.30046 7.88218 2.69463 -133.21179 948.51960
2400.0000 -139.29454 -131.19049 8.10405 2.79938 -131.62420 1039.39091
2405.0000 -139.45152 -129.83730 9.61421 2.88895 -130.26672 1094.72529
2410.0000 -138.90920 -131.60993 7.29928 2.79683 -131.66284 1037.84980
2415.0000 -139.95714 -131.41367 8.54346 2.81395 -131.40345 1015.90183
2420.0000 -139.86821 -131.96098 7.90722 2.72729 -132.71681 995.27295
2425.0000 -140.79625 -132.23042 8.56583 2.76317 -132.17302 1015.35957
2430.0000 -140.33416 -131.65612 8.67803 2.78014 -131.91579 1024.67617
2435.0000 -139.91671 -132.41043 7.50628 2.82908 -131.17411 1073.34115
2440.0000 -140.44615 -133.70712 6.73903 2.67143 -133.56339 979.50150
2445.0000 -140.12782 -133.10157 7.02625 2.64088 -134.02640 945.13964
2450.0000 -139.11010 -130.57243 8.53767 2.69899 -133.14568 976.60928
2455.0000 -140.16716 -132.55422 7.61294 2.80820 -131.49049 1045.06318
2460.0000 -137.66303 -129.15886 8.50416 2.81353 -131.40970 1021.42693
2465.0000 -139.05739 -130.07264 8.98475 2.97015 -129.03616 1161.73409
2470.0000 -138.16231 -128.96132 9.20098 2.92892 -129.66102 1111.02728
2475.0000 -138.60039 -129.09684 9.50355 2.93171 -129.61875 1156.81110
2480.0000 -139.53110 -131.06308 8.46802 2.84579 -130.92084 1062.99616
2485.0000 -139.34973 -130.43436 8.91537 2.84000 -131.00856 1071.10432
2490.0000 -140.25648 -131.20052 9.05596 2.86095 -130.69114 1119.47616
2495.0000 -140.94768 -132.87127 8.07641 2.79565 -131.68082 1063.07611
2500.0000 -140.35488 -132.55436 7.80053 2.74610 -132.43167 1026.78030
FREEZING PROCESS: loop number 11 T-loop= 1020.0000000000000
main_MD> interactions number 11 at Temperature= 1020.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.21416 -0.20577 -1.63193
force_rgl> df(natom) -2.43048 -0.10971 -1.52849
2505.0000 -140.10995 -132.36852 7.74143 2.78181 -131.89055 1072.36750
2510.0000 -139.34607 -131.89609 7.44998 2.79386 -131.70786 1071.35439
2515.0000 -138.79804 -131.36326 7.43478 2.77449 -132.00150 996.64302
2520.0000 -138.65261 -129.88334 8.76927 2.88710 -130.29471 1115.54196
2525.0000 -139.63922 -131.67558 7.96364 2.85601 -130.76593 1047.11778
2530.0000 -140.92394 -133.11738 7.80656 2.85828 -130.73162 1066.29836
2535.0000 -141.88196 -135.53063 6.35133 2.63530 -134.11095 914.26428
2540.0000 -140.77906 -133.58836 7.19071 2.61440 -134.42760 945.18604
2545.0000 -140.15944 -133.44923 6.71021 2.65646 -133.79019 942.59398
2550.0000 -140.75668 -131.81415 8.94253 2.68875 -133.30087 998.21489
2555.0000 -139.09803 -131.46743 7.63061 2.79050 -131.75876 1024.35115
2560.0000 -141.36687 -133.29242 8.07445 2.75748 -132.25922 1006.43727
2565.0000 -139.86094 -131.49257 8.36837 2.80156 -131.59114 1051.20724
2570.0000 -141.95954 -132.81806 9.14148 2.82174 -131.28541 1088.72653
2575.0000 -140.93090 -133.62088 7.31003 2.70905 -132.99317 998.42075
2580.0000 -141.21400 -132.85448 8.35952 2.67712 -133.47716 953.75205
2585.0000 -140.50790 -132.39354 8.11435 2.74890 -132.38920 991.58349
2590.0000 -139.69170 -132.23491 7.45678 2.78544 -131.83550 1034.79175
2595.0000 -141.01104 -133.12902 7.88202 2.77862 -131.93888 1045.69594
2600.0000 -139.62583 -130.79484 8.83099 2.73200 -132.64541 1010.86405
2605.0000 -140.77016 -132.96710 7.80306 2.79694 -131.66125 1042.29783
2610.0000 -139.45893 -132.17976 7.27916 2.70835 -133.00376 1005.08059
2615.0000 -140.78057 -133.13973 7.64084 2.78469 -131.84688 1074.97917
2620.0000 -139.65061 -132.74996 6.90066 2.71677 -132.87614 991.97481
2625.0000 -139.28115 -132.36297 6.91818 2.71785 -132.85980 1023.40913
2630.0000 -139.75925 -133.46612 6.29313 2.76816 -132.09732 1037.17627
2635.0000 -140.77861 -133.59725 7.18136 2.67582 -133.49685 947.92627
2640.0000 -140.94473 -132.83644 8.10830 2.69549 -133.19876 1042.20526
2645.0000 -140.20872 -131.38166 8.82705 2.83675 -131.05785 1085.93369
2650.0000 -140.77644 -130.55543 10.22100 2.87795 -130.43338 1121.46605
2655.0000 -140.05070 -132.01344 8.03726 2.82257 -131.27270 1098.57013
2660.0000 -139.14220 -131.63471 7.50750 2.75131 -132.35270 1035.47163
2665.0000 -139.90010 -132.57964 7.32046 2.76910 -132.08305 1059.90135
2670.0000 -141.37315 -133.94747 7.42568 2.71536 -132.89757 1001.31756
2675.0000 -138.59712 -131.18907 7.40805 2.73904 -132.53866 1025.01622
2680.0000 -139.30501 -130.84627 8.45874 2.88797 -130.28161 1081.74901
2685.0000 -138.47917 -131.44182 7.03736 2.78889 -131.78318 1036.71284
2690.0000 -140.72227 -132.60531 8.11695 2.81255 -131.42457 1068.45213
2695.0000 -140.15784 -131.94594 8.21190 2.80498 -131.53939 1060.03117
2700.0000 -141.29753 -133.90756 7.38997 2.64910 -133.90183 958.80526
2705.0000 -139.93289 -132.37650 7.55639 2.67713 -133.47702 935.25444
2710.0000 -140.23756 -133.27646 6.96111 2.65659 -133.78827 931.32870
2715.0000 -139.58972 -132.63245 6.95728 2.71529 -132.89865 978.48293
2720.0000 -142.90749 -135.58141 7.32607 2.65466 -133.81756 926.10035
2725.0000 -139.08128 -131.68078 7.40050 2.70108 -133.11394 966.98106
2730.0000 -139.91247 -131.84449 8.06797 2.82987 -131.16208 1044.37973
2735.0000 -141.05237 -133.55252 7.49985 2.75738 -132.26068 1039.91206
2740.0000 -140.68737 -132.01252 8.67485 2.71165 -132.95380 981.91010
2745.0000 -140.75012 -133.08263 7.66750 2.75056 -132.36410 1021.44860
2750.0000 -142.05191 -133.98514 8.06677 2.68324 -133.38439 974.06958
FREEZING PROCESS: loop number 12 T-loop= 995.00000000000000
main_MD> interactions number 12 at Temperature= 995.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.80291 -1.78265 -0.55468
force_rgl> df(natom) -4.96054 1.67206 -0.13022
2755.0000 -139.08349 -131.88318 7.20031 2.72052 -132.81941 956.28590
2760.0000 -140.43054 -132.44154 7.98900 2.75895 -132.23698 1030.50736
2765.0000 -139.78793 -132.63400 7.15393 2.73363 -132.62073 995.08302
2770.0000 -140.36755 -132.67506 7.69249 2.72820 -132.70303 971.63429
2775.0000 -139.02809 -132.39171 6.63638 2.69667 -133.18082 951.26609
2780.0000 -141.57221 -134.23653 7.33568 2.67683 -133.48151 956.63894
2785.0000 -138.96577 -130.49694 8.46883 2.68915 -133.29486 949.45418
2790.0000 -138.49344 -131.24753 7.24591 2.85806 -130.73484 1080.11648
2795.0000 -139.25863 -131.50584 7.75279 2.83607 -131.06813 1053.15773
2800.0000 -138.67176 -131.98958 6.68218 2.76166 -132.19590 1011.75744
2805.0000 -139.69712 -131.32085 8.37627 2.82880 -131.17832 1069.55099
2810.0000 -139.76398 -131.77671 7.98727 2.76782 -132.10247 1071.96373
2815.0000 -140.03685 -133.31820 6.71864 2.70420 -133.06666 990.23868
2820.0000 -140.02861 -132.76808 7.26053 2.73842 -132.54814 996.11045
2825.0000 -141.54379 -132.79009 8.75370 2.73102 -132.66017 991.53754
2830.0000 -140.08301 -131.36366 8.71934 2.75408 -132.31081 990.16956
2835.0000 -139.61705 -131.78059 7.83646 2.80471 -131.54341 1061.47514
2840.0000 -139.50353 -131.65271 7.85082 2.80913 -131.47643 1063.13612
2845.0000 -139.45101 -131.20736 8.24365 2.82770 -131.19495 1082.34058
2850.0000 -141.18864 -133.93857 7.25007 2.72726 -132.71729 975.94723
2855.0000 -140.57597 -133.13867 7.43730 2.70955 -132.98565 1002.04474
2860.0000 -139.38544 -131.60901 7.77643 2.73032 -132.67085 979.60383
2865.0000 -139.13698 -130.17524 8.96174 2.84311 -130.96146 1072.36653
2870.0000 -138.87778 -131.86162 7.01616 2.77251 -132.03138 1022.52119
2875.0000 -140.14579 -132.59837 7.54742 2.70589 -133.04108 961.33158
2880.0000 -141.48882 -134.01642 7.47240 2.74187 -132.49585 995.42505
2885.0000 -140.20356 -132.01177 8.19179 2.70025 -133.12652 960.00380
2890.0000 -139.17758 -130.77788 8.39970 2.81183 -131.43551 1058.92058
2895.0000 -140.17939 -131.85054 8.32884 2.81425 -131.39881 1066.47386
2900.0000 -141.60869 -134.05854 7.55015 2.65062 -133.87874 974.48981
2905.0000 -141.05599 -135.42617 5.62982 2.61937 -134.35233 908.96919
2910.0000 -140.35879 -132.26142 8.09738 2.65360 -133.83363 982.74944
2915.0000 -142.07010 -134.77394 7.29615 2.66211 -133.70467 925.80317
2920.0000 -140.13268 -132.69677 7.43591 2.65787 -133.76888 962.04373
2925.0000 -140.50826 -132.78533 7.72293 2.70303 -133.08451 966.95254
2930.0000 -140.24531 -133.70662 6.53869 2.69304 -133.23585 960.29168
2935.0000 -140.16727 -131.71462 8.45265 2.71129 -132.95923 1002.58809
2940.0000 -137.77737 -131.71590 6.06148 2.85544 -130.77455 1086.70590
2945.0000 -139.34554 -131.18941 8.15613 2.79201 -131.73593 1028.51896
2950.0000 -138.76585 -131.49199 7.27386 2.82374 -131.25501 1029.89554
2955.0000 -139.69123 -133.11923 6.57201 2.72680 -132.72424 1012.19390
2960.0000 -138.26731 -130.46968 7.79763 2.74379 -132.46668 1006.57770
2965.0000 -137.55733 -127.98838 9.56895 2.91417 -129.88452 1138.50587
2970.0000 -138.67268 -128.82839 9.84429 3.00332 -128.53341 1199.44354
2975.0000 -138.95676 -130.53389 8.42286 2.86733 -130.59446 1104.69120
2980.0000 -140.54952 -134.13933 6.41019 2.67529 -133.50481 947.40546
2985.0000 -141.16112 -133.69986 7.46126 2.68204 -133.40253 979.50446
2990.0000 -140.89967 -133.60585 7.29382 2.61748 -134.38095 911.59455
2995.0000 -139.90158 -132.00403 7.89754 2.76522 -132.14200 1014.49451
3000.0000 -139.85541 -132.44447 7.41094 2.77327 -132.01989 1034.32707
FREEZING PROCESS: loop number 13 T-loop= 970.00000000000000
main_MD> interactions number 13 at Temperature= 970.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.16900 -0.25185 -0.17947
force_rgl> df(natom) -1.35187 1.92570 -2.16420
3005.0000 -140.31762 -132.83222 7.48539 2.68355 -133.37969 969.78915
3010.0000 -141.44089 -134.57014 6.87075 2.63361 -134.13652 929.58673
3015.0000 -141.13428 -133.62622 7.50806 2.67517 -133.50662 954.65209
3020.0000 -143.15453 -134.84990 8.30463 2.59963 -134.65150 902.83860
3025.0000 -140.43601 -131.41109 9.02491 2.73631 -132.58008 1010.31018
3030.0000 -140.92532 -132.11275 8.81257 2.79965 -131.62007 1070.73939
3035.0000 -140.24701 -133.06163 7.18537 2.72545 -132.74469 967.44685
3040.0000 -141.18925 -133.07479 8.11447 2.69249 -133.24417 960.06664
3045.0000 -140.27530 -131.79132 8.48398 2.67458 -133.51563 958.80550
3050.0000 -141.41204 -133.46879 7.94325 2.74982 -132.37529 1034.31392
3055.0000 -140.01545 -132.81593 7.19952 2.73360 -132.62120 981.43992
3060.0000 -141.81055 -135.41277 6.39777 2.63515 -134.11326 967.39247
3065.0000 -139.00038 -132.28162 6.71876 2.61805 -134.37228 879.33192
3070.0000 -138.97996 -131.09378 7.88619 2.82923 -131.17182 1069.33893
3075.0000 -139.54772 -132.32802 7.21970 2.81161 -131.43892 1054.31761
3080.0000 -140.14639 -131.90822 8.23817 2.79552 -131.68269 1018.00871
3085.0000 -138.99086 -132.25384 6.73701 2.76532 -132.14041 1025.22827
3090.0000 -139.77601 -132.75466 7.02135 2.79941 -131.62381 1003.85318
3095.0000 -141.50795 -133.86169 7.64626 2.67489 -133.51096 973.41595
3100.0000 -139.05002 -132.05777 6.99225 2.75980 -132.22405 987.20656
3105.0000 -140.79931 -132.81272 7.98659 2.70384 -133.07219 962.35898
3110.0000 -141.17329 -134.27777 6.89552 2.66193 -133.70733 936.56656
3115.0000 -141.55681 -134.45273 7.10408 2.62509 -134.26569 917.88282
3120.0000 -141.87820 -134.20890 7.66930 2.64199 -134.00951 942.66154
3125.0000 -142.32932 -133.77786 8.55146 2.66985 -133.58725 961.22178
3130.0000 -139.91146 -133.87167 6.03979 2.64973 -133.89220 963.34119
3135.0000 -140.64216 -133.49663 7.14553 2.65725 -133.77830 936.56303
3140.0000 -141.17684 -134.55981 6.61704 2.64815 -133.91618 924.67079
3145.0000 -141.20748 -134.57462 6.63286 2.64794 -133.91943 970.23749
3150.0000 -140.34319 -133.34528 6.99791 2.65915 -133.74948 951.78105
3155.0000 -140.94075 -134.15975 6.78100 2.60499 -134.57029 926.57886
3160.0000 -142.07768 -134.19669 7.88100 2.62126 -134.32367 916.95584
3165.0000 -141.12019 -134.95282 6.16737 2.58688 -134.84469 885.24494
3170.0000 -140.95655 -133.49173 7.46482 2.60970 -134.49892 905.61122
3175.0000 -139.64288 -131.70436 7.93852 2.75874 -132.24006 1000.86710
3180.0000 -141.10843 -133.81836 7.29007 2.69410 -133.21981 959.87104
3185.0000 -140.19116 -133.24146 6.94971 2.61479 -134.42171 930.49155
3190.0000 -139.71436 -132.85517 6.85918 2.68448 -133.36562 971.60911
3195.0000 -141.71813 -135.40467 6.31346 2.62076 -134.33135 950.43618
3200.0000 -140.38783 -134.33474 6.05309 2.61743 -134.38177 927.58481
3205.0000 -139.81006 -133.81368 5.99639 2.65649 -133.78973 953.27196
3210.0000 -141.55416 -133.99480 7.55936 2.65100 -133.87304 956.25060
3215.0000 -141.64067 -136.01511 5.62555 2.59685 -134.69369 873.34406
3220.0000 -139.65822 -132.38817 7.27005 2.63631 -134.09565 922.41481
3225.0000 -139.53955 -131.09682 8.44272 2.81209 -131.43153 1066.31419
3230.0000 -141.28715 -133.07095 8.21620 2.72460 -132.75747 962.06833
3235.0000 -142.79360 -134.75178 8.04182 2.66486 -133.66291 964.29341
3240.0000 -141.22585 -134.52736 6.69850 2.61296 -134.44943 906.34035
3245.0000 -139.89893 -131.62394 8.27499 2.65916 -133.74934 944.91840
3250.0000 -139.37379 -132.62565 6.74815 2.77173 -132.04321 997.97932
FREEZING PROCESS: loop number 14 T-loop= 945.00000000000000
main_MD> interactions number 14 at Temperature= 945.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.31237 1.67079 0.19622
force_rgl> df(natom) -2.03680 3.74918 0.01632
3255.0000 -140.84283 -133.42714 7.41569 2.69280 -133.23945 962.99349
3260.0000 -139.94550 -132.71150 7.23400 2.65534 -133.80715 950.32381
3265.0000 -140.30097 -131.98662 8.31435 2.75477 -132.30035 1019.22524
3270.0000 -141.06802 -133.44154 7.62648 2.77882 -131.93582 989.12681
3275.0000 -141.70339 -133.50847 8.19492 2.66779 -133.61855 906.90793
3280.0000 -140.77918 -133.78264 6.99654 2.68396 -133.37339 938.66555
3285.0000 -140.58167 -134.80747 5.77420 2.61660 -134.39440 905.25367
3290.0000 -139.53786 -133.25406 6.28380 2.69755 -133.16750 957.00164
3295.0000 -141.21250 -134.74139 6.47111 2.64127 -134.02041 935.76692
3300.0000 -141.11804 -134.04436 7.07369 2.71299 -132.93356 988.72555
3305.0000 -141.18112 -135.47980 5.70131 2.60089 -134.63240 898.30900
3310.0000 -143.15707 -136.25966 6.89741 2.52383 -135.80037 865.70596
3315.0000 -139.24049 -131.85285 7.38763 2.60021 -134.64266 921.61137
3320.0000 -141.03702 -131.48029 9.55673 2.81175 -131.43681 1060.86416
3325.0000 -142.61297 -134.06508 8.54789 2.67982 -133.43627 956.09243
3330.0000 -141.36587 -134.48565 6.88022 2.64964 -133.89363 918.38642
3335.0000 -141.45590 -134.23059 7.22531 2.62830 -134.21702 897.73316
3340.0000 -141.50574 -134.02369 7.48205 2.68962 -133.28768 962.00445
3345.0000 -139.27849 -133.39650 5.88199 2.65950 -133.74412 967.94114
3350.0000 -140.12556 -133.02726 7.09830 2.70833 -133.00418 1016.08213
3355.0000 -140.84453 -132.98631 7.85822 2.71144 -132.95701 983.70754
3360.0000 -141.35169 -133.32570 8.02599 2.68029 -133.42906 959.24177
3365.0000 -141.05959 -133.99567 7.06392 2.66223 -133.70284 941.17613
3370.0000 -143.08636 -135.12123 7.96513 2.65704 -133.78137 902.89714
3375.0000 -141.61626 -135.11233 6.50392 2.55686 -135.29969 875.15792
3380.0000 -141.51539 -135.67374 5.84165 2.63302 -134.14549 907.25949
3385.0000 -140.83065 -133.35806 7.47259 2.59429 -134.73249 894.82088
3390.0000 -140.25395 -133.25018 7.00377 2.70270 -133.08944 983.60220
3395.0000 -142.17831 -134.87657 7.30174 2.63386 -134.13275 914.94776
3400.0000 -142.96426 -136.28549 6.67877 2.54680 -135.45224 857.28720
3405.0000 -142.63959 -135.52278 7.11681 2.55793 -135.28346 867.48568
3410.0000 -142.00985 -134.95442 7.05543 2.51743 -135.89723 863.14101
3415.0000 -142.41370 -135.01267 7.40103 2.60253 -134.60754 909.36839
3420.0000 -142.40056 -136.09644 6.30412 2.54960 -135.40980 893.72208
3425.0000 -141.71885 -135.84398 5.87486 2.59060 -134.78829 921.57211
3430.0000 -139.83571 -133.01790 6.81781 2.64823 -133.91488 934.20225
3435.0000 -142.16163 -133.60454 8.55709 2.65458 -133.81875 929.57441
3440.0000 -140.87282 -133.91387 6.95895 2.67614 -133.49200 928.64400
3445.0000 -141.88945 -134.31761 7.57184 2.64142 -134.01818 914.82650
3450.0000 -141.96372 -135.35555 6.60818 2.54822 -135.43068 856.74577
3455.0000 -142.54780 -135.98970 6.55809 2.52030 -135.85377 861.29637
3460.0000 -140.43353 -133.50576 6.92777 2.54708 -135.44800 901.40971
3465.0000 -139.85969 -132.99077 6.86892 2.70425 -133.06592 979.31653
3470.0000 -141.71266 -134.42521 7.28744 2.62120 -134.32468 915.64732
3475.0000 -140.06255 -133.09378 6.96876 2.62853 -134.21350 950.51238
3480.0000 -141.67454 -134.54001 7.13453 2.66132 -133.71658 943.66339
3485.0000 -140.98522 -134.49473 6.49049 2.60329 -134.59612 901.85838
3490.0000 -140.04942 -132.24167 7.80775 2.65466 -133.81749 919.18849
3495.0000 -140.01760 -133.13439 6.88321 2.70169 -133.10471 989.46951
3500.0000 -141.84562 -135.08332 6.76230 2.60182 -134.61837 917.65214
FREEZING PROCESS: loop number 15 T-loop= 920.00000000000000
main_MD> interactions number 15 at Temperature= 920.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.18063 0.63107 -1.01635
force_rgl> df(natom) 2.58897 7.50895 -2.58020
3505.0000 -140.08957 -133.58694 6.50263 2.61014 -134.49230 915.75798
3510.0000 -141.78729 -135.50761 6.27968 2.62051 -134.33502 931.53574
3515.0000 -141.22371 -134.96169 6.26202 2.56969 -135.10533 870.78635
3520.0000 -140.90385 -133.69651 7.20734 2.58955 -134.80421 867.85658
3525.0000 -140.66132 -135.00479 5.65654 2.59584 -134.70890 896.32963
3530.0000 -140.44916 -133.88248 6.56668 2.55670 -135.30207 863.73674
3535.0000 -141.29018 -134.31135 6.97883 2.65650 -133.78961 946.07823
3540.0000 -142.92810 -135.86352 7.06459 2.57481 -135.02769 894.19492
3545.0000 -142.94657 -135.43402 7.51255 2.48244 -136.42759 822.03150
3550.0000 -143.10531 -135.78000 7.32530 2.56981 -135.10351 885.41902
3555.0000 -142.06812 -135.77768 6.29044 2.57400 -135.03987 886.23960
3560.0000 -140.45716 -134.39302 6.06414 2.60442 -134.57893 875.51194
3565.0000 -141.86937 -135.92881 5.94056 2.61684 -134.39068 926.19177
3570.0000 -141.32425 -135.85850 5.46575 2.53376 -135.64975 848.55442
3575.0000 -140.57965 -135.13635 5.44330 2.53689 -135.60230 863.71823
3580.0000 -140.96203 -133.54881 7.41322 2.61642 -134.39705 912.01291
3585.0000 -140.50982 -133.58861 6.92121 2.67773 -133.46787 941.67572
3590.0000 -141.70953 -134.39964 7.30989 2.69019 -133.27900 971.49263
3595.0000 -141.96436 -135.51588 6.44847 2.57225 -135.06651 897.98441
3600.0000 -141.23279 -134.86991 6.36288 2.61031 -134.48968 918.92166
3605.0000 -142.88806 -135.86443 7.02363 2.58722 -134.83955 869.92755
3610.0000 -140.69773 -133.58856 7.10918 2.53831 -135.58090 831.09128
3615.0000 -141.55894 -134.89211 6.66683 2.62341 -134.29111 911.51365
3620.0000 -139.69116 -134.07969 5.61147 2.62724 -134.23310 902.21146
3625.0000 -142.72638 -134.06865 8.65773 2.63164 -134.16643 913.44027
3630.0000 -139.73276 -133.45904 6.27371 2.64382 -133.98184 925.94374
3635.0000 -139.83396 -134.14534 5.68862 2.62763 -134.22720 905.87823
3640.0000 -141.73837 -134.01396 7.72441 2.62095 -134.32847 906.28368
3645.0000 -141.22979 -133.53343 7.69636 2.64536 -133.95847 943.79372
3650.0000 -140.89477 -133.56373 7.33104 2.61205 -134.46333 945.94519
3655.0000 -139.80659 -132.94301 6.86358 2.69528 -133.20191 990.57755
3660.0000 -141.26028 -134.98136 6.27892 2.65526 -133.80847 942.34940
3665.0000 -141.77778 -135.41327 6.36451 2.56451 -135.18370 881.52938
3670.0000 -139.81894 -133.99164 5.82729 2.64524 -133.96027 916.11937
3675.0000 -142.04816 -134.91764 7.13052 2.66160 -133.71237 970.09761
3680.0000 -141.84213 -134.66227 7.17986 2.61351 -134.44108 924.45524
3685.0000 -141.92993 -135.76304 6.16689 2.57695 -134.99523 872.86978
3690.0000 -142.71640 -135.55572 7.16068 2.51991 -135.85970 847.49286
3695.0000 -141.33120 -134.54335 6.78785 2.63511 -134.11376 927.07168
3700.0000 -140.92742 -133.95700 6.97042 2.63863 -134.06041 929.92314
3705.0000 -141.90309 -135.16604 6.73704 2.64999 -133.88833 969.22030
3710.0000 -140.48636 -133.51080 6.97556 2.61731 -134.38360 937.02614
3715.0000 -141.48211 -133.70494 7.77717 2.65320 -133.83967 924.53628
3720.0000 -140.66673 -134.30048 6.36625 2.63950 -134.04725 947.16863
3725.0000 -140.29803 -133.36960 6.92843 2.67809 -133.46236 948.27889
3730.0000 -140.83963 -133.01520 7.82443 2.63632 -134.09545 941.41196
3735.0000 -141.08117 -134.19782 6.88335 2.74841 -132.39673 993.09176
3740.0000 -141.53166 -135.07336 6.45830 2.65913 -133.74969 945.18141
3745.0000 -140.21394 -133.04338 7.17057 2.64081 -134.02737 954.06030
3750.0000 -141.47815 -135.50765 5.97050 2.62050 -134.33528 906.28501
FREEZING PROCESS: loop number 16 T-loop= 895.00000000000000
main_MD> interactions number 16 at Temperature= 895.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.40016 1.76159 -2.02185
force_rgl> df(natom) -0.64829 1.82925 0.80744
3755.0000 -141.88291 -135.47867 6.40424 2.55247 -135.36630 870.42713
3760.0000 -141.93543 -135.15355 6.78188 2.56517 -135.17375 848.17686
3765.0000 -141.52173 -135.08693 6.43480 2.58416 -134.88589 911.56809
3770.0000 -142.82690 -134.92935 7.89755 2.54332 -135.50489 901.64642
3775.0000 -142.34014 -134.93005 7.41008 2.56386 -135.19361 893.83901
3780.0000 -141.62622 -135.25144 6.37478 2.57746 -134.98744 905.49445
3785.0000 -142.99713 -135.48669 7.51044 2.55128 -135.38430 879.98120
3790.0000 -140.87563 -134.31666 6.55897 2.57616 -135.00727 893.50091
3795.0000 -141.24544 -133.62806 7.61738 2.63850 -134.06235 899.37062
3800.0000 -140.54289 -132.96977 7.57313 2.64017 -134.03711 918.09356
3805.0000 -140.44979 -134.06666 6.38313 2.67277 -133.54298 955.73826
3810.0000 -140.72036 -133.17326 7.54711 2.68962 -133.28764 986.50905
3815.0000 -141.10057 -133.14060 7.95997 2.70359 -133.07596 972.74978
3820.0000 -142.35706 -134.00213 8.35493 2.68646 -133.33553 998.39145
3825.0000 -141.74659 -135.15839 6.58820 2.60663 -134.54545 919.96932
3830.0000 -142.04385 -135.23486 6.80899 2.61257 -134.45545 879.31258
3835.0000 -141.45669 -135.82357 5.63312 2.50858 -136.03147 833.34616
3840.0000 -142.99802 -135.18479 7.81323 2.55110 -135.38708 855.05401
3845.0000 -140.83589 -133.24298 7.59291 2.61993 -134.34383 895.17703
3850.0000 -142.56487 -137.01507 5.54980 2.57030 -135.09605 876.57513
3855.0000 -143.06571 -137.11192 5.95379 2.40166 -137.65181 741.67445
3860.0000 -141.48431 -136.26780 5.21651 2.50205 -136.13041 818.24225
3865.0000 -142.58448 -136.61840 5.96609 2.48311 -136.41735 809.59630
3870.0000 -141.84615 -136.04972 5.79643 2.48623 -136.37019 812.19638
3875.0000 -143.06418 -135.80163 7.26255 2.49496 -136.23783 842.87084
3880.0000 -140.51728 -133.93013 6.58715 2.54029 -135.55082 859.86593
3885.0000 -140.95379 -132.86865 8.08513 2.67764 -133.46918 963.84547
3890.0000 -140.37170 -133.20766 7.16403 2.72474 -132.75548 981.70831
3895.0000 -141.17402 -134.06727 7.10675 2.64325 -133.99040 944.10092
3900.0000 -141.30365 -133.55007 7.75358 2.64248 -134.00207 911.20406
3905.0000 -141.29201 -134.05412 7.23789 2.66979 -133.58823 936.14472
3910.0000 -141.39527 -134.56511 6.83016 2.62892 -134.20758 910.38813
3915.0000 -140.94363 -134.44817 6.49545 2.60725 -134.53608 913.78460
3920.0000 -142.16788 -134.47705 7.69083 2.60968 -134.49926 917.54107
3925.0000 -141.84909 -134.87639 6.97269 2.67802 -133.46354 976.29667
3930.0000 -141.71199 -135.86245 5.84954 2.49317 -136.26497 823.02897
3935.0000 -140.69536 -133.49323 7.20213 2.62936 -134.20095 891.50222
3940.0000 -142.81950 -134.95697 7.86253 2.65491 -133.81376 922.79307
3945.0000 -142.62876 -136.44371 6.18505 2.59681 -134.69432 908.88643
3950.0000 -142.78874 -135.11520 7.67353 2.56147 -135.22986 867.11263
3955.0000 -142.91146 -135.44831 7.46314 2.50425 -136.09706 841.19857
3960.0000 -142.36544 -136.35310 6.01234 2.44219 -137.03760 779.57026
3965.0000 -141.37865 -132.90488 8.47376 2.58579 -134.86131 870.19371
3970.0000 -141.44089 -133.83123 7.60966 2.68736 -133.32187 976.84146
3975.0000 -141.76118 -135.13172 6.62946 2.64634 -133.94359 940.64934
3980.0000 -142.08490 -135.56200 6.52290 2.62575 -134.25564 914.52210
3985.0000 -142.39006 -136.19659 6.19346 2.50752 -136.04745 865.02662
3990.0000 -142.78935 -136.06889 6.72046 2.50956 -136.01655 836.42174
3995.0000 -141.67019 -135.08731 6.58288 2.54170 -135.52950 870.02343
4000.0000 -139.75027 -134.51004 5.24023 2.62465 -134.27234 908.88996
FREEZING PROCESS: loop number 17 T-loop= 870.00000000000000
main_MD> interactions number 17 at Temperature= 870.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.27295 -2.14788 0.48955
force_rgl> df(natom) -1.03240 -2.17272 -0.13522
4005.0000 -142.08095 -134.93483 7.14612 2.57823 -134.97585 904.31657
4010.0000 -143.01761 -135.51675 7.50086 2.54642 -135.45801 866.88083
4015.0000 -141.78781 -135.19296 6.59485 2.61335 -134.44363 930.81210
4020.0000 -141.26993 -134.24805 7.02188 2.56565 -135.16645 896.20273
4025.0000 -140.66256 -134.51237 6.15018 2.60380 -134.58835 911.02940
4030.0000 -143.03741 -135.33279 7.70462 2.57961 -134.95485 905.63958
4035.0000 -142.04271 -135.19168 6.85103 2.57049 -135.09318 913.42618
4040.0000 -143.43047 -137.09744 6.33303 2.45185 -136.89125 809.64275
4045.0000 -143.53019 -136.64795 6.88225 2.44186 -137.04252 809.31498
4050.0000 -143.85785 -137.73882 6.11903 2.43380 -137.16473 779.66199
4055.0000 -142.63281 -136.65887 5.97394 2.43396 -137.16238 792.10129
4060.0000 -142.63056 -135.58046 7.05009 2.52013 -135.85642 831.38210
4065.0000 -142.70401 -135.35479 7.34922 2.59100 -134.78229 907.52804
4070.0000 -142.35943 -134.61059 7.74884 2.54219 -135.52197 871.67166
4075.0000 -142.36700 -135.31145 7.05555 2.64318 -133.99147 913.10849
4080.0000 -143.02138 -136.80329 6.21809 2.51037 -136.00423 855.32648
4085.0000 -143.53689 -136.96500 6.57189 2.41849 -137.39679 808.32265
4090.0000 -143.73519 -136.65551 7.07968 2.46389 -136.70874 821.46752
4095.0000 -144.04058 -136.94311 7.09747 2.45099 -136.90427 830.05432
4100.0000 -140.83249 -134.67062 6.16187 2.53192 -135.67762 848.20222
4105.0000 -143.60142 -137.37900 6.22242 2.52024 -135.85476 822.51472
4110.0000 -144.17366 -138.18734 5.98632 2.39972 -137.68127 752.24643
4115.0000 -142.82752 -136.61550 6.21202 2.38213 -137.94780 748.96970
4120.0000 -140.37226 -132.67389 7.69837 2.57434 -135.03472 932.51876
4125.0000 -141.21988 -133.91638 7.30350 2.63516 -134.11308 935.45272
4130.0000 -141.43497 -134.05085 7.38413 2.63977 -134.04316 924.91271
4135.0000 -141.49880 -134.35889 7.13992 2.64751 -133.92583 933.77711
4140.0000 -142.33020 -136.06638 6.26382 2.54426 -135.49068 859.65024
4145.0000 -142.81566 -135.17560 7.64006 2.52076 -135.84686 837.09365
4150.0000 -141.92058 -135.69261 6.22797 2.53544 -135.62429 896.65938
4155.0000 -141.48037 -135.34118 6.13919 2.50135 -136.14103 832.13542
4160.0000 -141.93161 -135.02384 6.90778 2.58553 -134.86522 867.98191
4165.0000 -142.97870 -136.70174 6.27697 2.51796 -135.88928 847.62305
4170.0000 -142.84916 -134.53870 8.31046 2.49910 -136.17504 872.09696
4175.0000 -143.08746 -134.29458 8.79288 2.60479 -134.57329 916.34023
4180.0000 -141.47441 -134.33968 7.13473 2.61500 -134.41858 925.48087
4185.0000 -141.76896 -134.90514 6.86382 2.61190 -134.46559 938.53675
4190.0000 -142.97471 -136.14219 6.83252 2.57308 -135.05392 868.07895
4195.0000 -141.80050 -135.92008 5.88042 2.51432 -135.94445 836.77714
4200.0000 -142.04656 -135.64471 6.40186 2.50991 -136.01123 876.37069
4205.0000 -142.32222 -136.15706 6.16516 2.52676 -135.75584 867.20322
4210.0000 -143.18327 -137.17003 6.01324 2.45741 -136.80693 763.75246
4215.0000 -143.61998 -137.69074 5.92924 2.44275 -137.02910 791.95658
4220.0000 -142.61001 -136.60794 6.00208 2.42128 -137.35452 784.50890
4225.0000 -142.19109 -135.10694 7.08415 2.51735 -135.89844 864.95103
4230.0000 -143.32509 -136.77904 6.54605 2.54877 -135.42230 895.30918
4235.0000 -141.56346 -134.44813 7.11532 2.52730 -135.74777 896.32883
4240.0000 -141.96889 -136.19056 5.77832 2.53599 -135.61594 866.86847
4245.0000 -142.59124 -136.30030 6.29094 2.53744 -135.59403 860.48525
4250.0000 -142.48376 -134.19382 8.28994 2.57127 -135.08137 889.54609
FREEZING PROCESS: loop number 18 T-loop= 845.00000000000000
main_MD> interactions number 18 at Temperature= 845.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.60193 0.96495 -1.04164
force_rgl> df(natom) -0.00767 -1.40365 0.73773
4255.0000 -142.25249 -136.16377 6.08872 2.64100 -134.02446 952.69701
4260.0000 -142.05220 -135.67583 6.37637 2.48477 -136.39221 849.62960
4265.0000 -141.90280 -135.71144 6.19136 2.51549 -135.92664 847.49915
4270.0000 -142.08811 -135.79624 6.29187 2.51608 -135.91769 871.76229
4275.0000 -142.78975 -137.20570 5.58405 2.46485 -136.69423 805.55151
4280.0000 -142.50294 -137.47235 5.03059 2.42059 -137.36487 785.73817
4285.0000 -142.41371 -136.48583 5.92788 2.44591 -136.98116 794.16804
4290.0000 -140.78297 -135.17140 5.61157 2.56493 -135.17746 884.77248
4295.0000 -141.90501 -135.72491 6.18010 2.57473 -135.02896 900.01489
4300.0000 -141.41233 -135.35719 6.05514 2.53777 -135.58903 866.50845
4305.0000 -141.78847 -136.24168 5.54680 2.58609 -134.85677 903.46839
4310.0000 -142.04503 -136.21968 5.82535 2.48183 -136.43684 827.65972
4315.0000 -142.06416 -136.19784 5.86632 2.53794 -135.58641 869.71467
4320.0000 -139.99306 -134.63539 5.35767 2.59124 -134.77864 914.41110
4325.0000 -143.47531 -136.00759 7.46772 2.54716 -135.44676 861.65254
4330.0000 -142.42194 -136.40447 6.01747 2.50908 -136.02387 849.42873
4335.0000 -142.51284 -136.10039 6.41245 2.53824 -135.58185 847.13562
4340.0000 -141.58645 -135.21407 6.37237 2.54742 -135.44274 850.16628
4345.0000 -141.83058 -135.93400 5.89659 2.56506 -135.17541 879.46163
4350.0000 -143.27550 -137.26855 6.00695 2.52187 -135.82994 842.67310
4355.0000 -141.68019 -136.15332 5.52687 2.48971 -136.31741 818.66349
4360.0000 -142.72058 -136.41620 6.30439 2.51965 -135.86368 853.24630
4365.0000 -141.37556 -135.34575 6.02981 2.49662 -136.21271 840.61800
4370.0000 -142.05222 -135.68332 6.36890 2.55142 -135.38213 839.24467
4375.0000 -141.85953 -136.39902 5.46051 2.47329 -136.56621 817.53173
4380.0000 -142.55500 -134.92511 7.62989 2.54580 -135.46732 870.83426
4385.0000 -143.01694 -136.52107 6.49587 2.58077 -134.93734 918.19199
4390.0000 -142.12547 -136.23046 5.89501 2.48547 -136.38163 814.01926
4395.0000 -142.17001 -136.51264 5.65736 2.47383 -136.55810 785.31302
4400.0000 -141.93828 -136.07203 5.86625 2.48810 -136.34179 822.87627
4405.0000 -141.89071 -135.87260 6.01811 2.56451 -135.18382 861.07146
4410.0000 -141.98839 -136.01839 5.97000 2.47856 -136.48639 786.35175
4415.0000 -141.25858 -134.85295 6.40563 2.54397 -135.49507 856.69210
4420.0000 -142.16426 -135.32071 6.84355 2.55465 -135.33320 862.79433
4425.0000 -140.86840 -134.73776 6.13064 2.56633 -135.15616 874.33758
4430.0000 -142.92327 -136.82946 6.09381 2.56527 -135.17220 875.01868
4435.0000 -142.84872 -137.22059 5.62812 2.50291 -136.11739 860.23061
4440.0000 -143.68494 -136.63875 7.04619 2.45340 -136.86776 836.58071
4445.0000 -142.31920 -135.47701 6.84219 2.50840 -136.03421 852.03982
4450.0000 -142.93647 -137.63343 5.30303 2.53638 -135.61003 874.68411
4455.0000 -142.17284 -135.22204 6.95081 2.47576 -136.52876 831.78363
4460.0000 -142.73999 -136.49261 6.24738 2.54473 -135.48357 877.73962
4465.0000 -142.99573 -135.82906 7.16667 2.47837 -136.48930 830.70472
4470.0000 -142.11023 -135.60687 6.50336 2.50457 -136.09223 845.26124
4475.0000 -140.36563 -135.09514 5.27049 2.57860 -134.97019 883.66696
4480.0000 -141.65760 -135.23289 6.42472 2.54954 -135.41068 854.70125
4485.0000 -141.84477 -134.59181 7.25296 2.54038 -135.54950 862.18640
4490.0000 -141.71723 -135.29906 6.41817 2.55082 -135.39125 878.48769
4495.0000 -141.82315 -136.75905 5.06410 2.49741 -136.20068 831.90278
4500.0000 -143.32110 -138.26389 5.05721 2.43488 -137.14835 756.37391
FREEZING PROCESS: loop number 19 T-loop= 820.00000000000000
main_MD> interactions number 19 at Temperature= 820.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.24426 -1.07780 -1.65135
force_rgl> df(natom) 0.16208 1.37652 2.18804
4505.0000 -142.97378 -137.35515 5.61864 2.41379 -137.46804 783.57198
4510.0000 -143.06409 -137.53191 5.53218 2.47177 -136.58936 832.07035
4515.0000 -143.49149 -137.22469 6.26679 2.39995 -137.67779 769.02550
4520.0000 -143.84049 -138.03812 5.80237 2.37242 -138.09491 757.59745
4525.0000 -143.83952 -137.36514 6.47438 2.38071 -137.96940 723.26094
4530.0000 -144.07294 -137.88296 6.18998 2.38841 -137.85261 728.38513
4535.0000 -142.43492 -135.93661 6.49831 2.43524 -137.14284 791.26461
4540.0000 -142.10514 -135.88507 6.22007 2.46843 -136.63983 809.76331
4545.0000 -142.82528 -136.36347 6.46181 2.52794 -135.73794 828.30358
4550.0000 -143.01440 -136.22599 6.78841 2.46745 -136.65482 795.42735
4555.0000 -142.51559 -136.69973 5.81585 2.49134 -136.29265 847.56011
4560.0000 -143.14259 -136.16101 6.98158 2.51137 -135.98914 855.28113
4565.0000 -143.71681 -135.99177 7.72504 2.48065 -136.45471 842.26809
4570.0000 -143.44616 -136.94728 6.49888 2.48205 -136.43343 812.39473
4575.0000 -143.38828 -137.88178 5.50650 2.41563 -137.44008 810.77593
4580.0000 -141.52221 -135.68644 5.83577 2.45264 -136.87915 803.90733
4585.0000 -142.59928 -136.00106 6.59822 2.49651 -136.21428 844.97004
4590.0000 -143.30269 -136.77790 6.52480 2.49761 -136.19766 826.16196
4595.0000 -142.44218 -135.91723 6.52495 2.47084 -136.60337 808.77455
4600.0000 -142.04582 -136.06875 5.97707 2.54519 -135.47664 860.50521
4605.0000 -143.16491 -136.03666 7.12825 2.51334 -135.95934 798.32236
4610.0000 -142.21269 -136.64758 5.56511 2.51016 -136.00750 847.70682
4615.0000 -142.87952 -136.85044 6.02908 2.44752 -136.95678 818.34809
4620.0000 -141.93711 -135.32404 6.61307 2.48596 -136.37430 833.05417
4625.0000 -140.81310 -135.17152 5.64159 2.53095 -135.69232 847.59502
4630.0000 -143.08801 -137.54246 5.54556 2.53301 -135.66122 850.29371
4635.0000 -143.04337 -135.94336 7.10001 2.43796 -137.10170 788.53908
4640.0000 -143.70595 -135.51173 8.19422 2.50191 -136.13249 858.97119
4645.0000 -142.62359 -136.05066 6.57293 2.53976 -135.55881 886.24319
4650.0000 -141.43061 -135.33533 6.09528 2.53328 -135.65707 851.24985
4655.0000 -142.03718 -135.73731 6.29987 2.52394 -135.79864 857.16504
4660.0000 -141.43972 -135.61286 5.82686 2.52538 -135.77677 847.95143
4665.0000 -143.20530 -136.73322 6.47208 2.48769 -136.34795 839.28503
4670.0000 -141.77306 -135.53075 6.24231 2.47317 -136.56811 851.20230
4675.0000 -141.52091 -134.53861 6.98229 2.55936 -135.26176 866.26301
4680.0000 -141.09670 -134.68035 6.41635 2.58569 -134.86281 894.72945
4685.0000 -142.55710 -135.60603 6.95108 2.54871 -135.42322 879.06488
4690.0000 -142.73054 -136.80175 5.92878 2.48761 -136.34927 818.32256
4695.0000 -142.14515 -135.18801 6.95714 2.52515 -135.78035 857.87041
4700.0000 -141.95092 -135.78553 6.16539 2.50736 -136.04983 841.99548
4705.0000 -140.80056 -134.15924 6.64132 2.54704 -135.44857 867.41115
4710.0000 -142.53851 -136.07253 6.46598 2.56646 -135.15415 890.85223
4715.0000 -143.10133 -136.48407 6.61726 2.50639 -136.06460 819.78597
4720.0000 -142.74156 -134.95049 7.79107 2.54422 -135.49132 895.83129
4725.0000 -142.86891 -135.75761 7.11131 2.49697 -136.20739 813.52060
4730.0000 -142.58053 -136.00734 6.57320 2.51586 -135.92105 788.75617
4735.0000 -143.49357 -137.52030 5.97326 2.46237 -136.73169 812.65936
4740.0000 -143.18412 -138.46644 4.71768 2.38228 -137.94557 768.60586
4745.0000 -142.97876 -135.85053 7.12824 2.43680 -137.11920 764.71573
4750.0000 -142.21022 -135.76945 6.44076 2.51750 -135.89622 873.34617
FREEZING PROCESS: loop number 20 T-loop= 795.00000000000000
main_MD> interactions number 20 at Temperature= 795.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.23637 -0.62014 2.27728
force_rgl> df(natom) -0.11108 -2.40830 -0.15351
4755.0000 -141.65543 -136.24304 5.41239 2.50777 -136.04373 822.14806
4760.0000 -143.25509 -135.98696 7.26813 2.50725 -136.05154 858.64808
4765.0000 -144.18259 -138.27524 5.90734 2.40643 -137.57956 795.66590
4770.0000 -143.64528 -137.00759 6.63769 2.41713 -137.41745 794.88028
4775.0000 -142.82200 -136.79145 6.03055 2.48384 -136.40635 815.36456
4780.0000 -143.24888 -137.92342 5.32545 2.47833 -136.48980 827.63271
4785.0000 -144.25267 -137.35523 6.89745 2.40190 -137.64823 753.25095
4790.0000 -143.06651 -136.63735 6.42916 2.43534 -137.14138 802.47284
4795.0000 -143.74916 -138.32774 5.42142 2.44092 -137.05684 825.43848
4800.0000 -144.03884 -138.66636 5.37248 2.34645 -138.48858 705.33684
4805.0000 -144.21866 -138.04729 6.17137 2.35571 -138.34821 735.23594
4810.0000 -143.32209 -138.16022 5.16188 2.37466 -138.06101 765.32141
4815.0000 -144.47631 -138.22288 6.25343 2.38668 -137.87880 761.59350
4820.0000 -143.11714 -136.92200 6.19514 2.42817 -137.25011 794.64564
4825.0000 -143.40187 -136.92397 6.47790 2.48212 -136.43247 818.20951
4830.0000 -144.29096 -136.91575 7.37520 2.42616 -137.28055 797.86543
4835.0000 -141.91424 -135.91044 6.00380 2.46552 -136.68404 808.32592
4840.0000 -142.63380 -136.04963 6.58417 2.55450 -135.33546 861.28526
4845.0000 -143.22292 -137.49923 5.72369 2.44874 -136.93826 776.77382
4850.0000 -142.68704 -137.56823 5.11881 2.39310 -137.78150 742.43264
4855.0000 -144.10024 -138.19671 5.90354 2.43201 -137.19187 783.41418
4860.0000 -143.80261 -137.32440 6.47820 2.43021 -137.21912 797.16135
4865.0000 -144.17521 -137.83943 6.33578 2.43489 -137.14825 797.20115
4870.0000 -144.47616 -138.83994 5.63623 2.42607 -137.28182 778.85625
4875.0000 -142.51704 -136.79155 5.72550 2.39409 -137.76658 765.23534
4880.0000 -142.90769 -137.63861 5.26909 2.41234 -137.49000 760.70133
4885.0000 -143.26528 -137.26294 6.00234 2.41790 -137.40577 763.68169
4890.0000 -142.61619 -137.15270 5.46349 2.40377 -137.61988 775.59195
4895.0000 -142.75496 -137.54941 5.20555 2.44195 -137.04123 801.81586
4900.0000 -143.73798 -137.19769 6.54030 2.45854 -136.78984 796.28610
4905.0000 -143.09368 -136.12642 6.96727 2.47424 -136.55191 791.90194
4910.0000 -142.07050 -135.08474 6.98576 2.53585 -135.61808 859.21910
4915.0000 -142.76244 -136.71990 6.04253 2.54261 -135.51563 857.93224
4920.0000 -142.34331 -137.63423 4.70907 2.47672 -136.51432 812.65466
4925.0000 -142.70336 -137.51381 5.18954 2.44824 -136.94593 781.10247
4930.0000 -141.74492 -135.79478 5.95014 2.47508 -136.53911 772.83222
4935.0000 -141.60916 -135.07509 6.53407 2.57462 -135.03057 884.15294
4940.0000 -141.86778 -135.21806 6.64972 2.54448 -135.48738 870.87320
4945.0000 -142.70647 -136.32151 6.38496 2.54426 -135.49061 861.15088
4950.0000 -142.72363 -136.09464 6.62899 2.50184 -136.13351 821.96780
4955.0000 -142.67294 -137.64652 5.02642 2.43012 -137.22056 778.42410
4960.0000 -142.86493 -136.30497 6.55996 2.41414 -137.46267 784.40852
4965.0000 -143.68666 -137.20058 6.48607 2.46331 -136.71754 839.85086
4970.0000 -143.33963 -137.88288 5.45675 2.40835 -137.55044 785.98402
4975.0000 -143.11193 -137.49015 5.62178 2.36805 -138.16127 734.20307
4980.0000 -143.95343 -138.07512 5.87831 2.42756 -137.25937 806.38795
4985.0000 -143.17554 -136.94563 6.22991 2.43065 -137.21242 802.80660
4990.0000 -143.63300 -137.03533 6.59767 2.47542 -136.53403 803.21997
4995.0000 -142.86885 -136.61410 6.25475 2.43255 -137.18365 801.61975
5000.0000 -143.51389 -135.40777 8.10612 2.53424 -135.64252 862.38548
FREEZING PROCESS: loop number 21 T-loop= 770.00000000000000
main_MD> interactions number 21 at Temperature= 770.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.63647 1.92729 -0.35080
force_rgl> df(natom) -0.60259 -1.30748 2.05013
5005.0000 -142.97157 -135.89445 7.07712 2.54163 -135.53059 871.39391
5010.0000 -142.82946 -137.73471 5.09475 2.49643 -136.21550 825.41291
5015.0000 -143.55570 -137.45268 6.10301 2.38053 -137.97205 737.77745
5020.0000 -142.53102 -137.33467 5.19635 2.45706 -136.81219 829.73013
5025.0000 -143.70254 -137.18478 6.51776 2.40828 -137.55150 752.86348
5030.0000 -143.60575 -138.22795 5.37781 2.38939 -137.83778 725.06208
5035.0000 -143.68573 -137.71023 5.97550 2.39920 -137.68912 740.43696
5040.0000 -143.13312 -136.50403 6.62909 2.42493 -137.29915 799.67497
5045.0000 -142.99868 -136.97523 6.02345 2.42579 -137.28606 786.69522
5050.0000 -143.22874 -137.55458 5.67416 2.47651 -136.51749 811.30509
5055.0000 -144.01722 -138.05532 5.96190 2.38802 -137.85855 738.33101
5060.0000 -144.59978 -138.15765 6.44213 2.38844 -137.85226 780.52472
5065.0000 -143.00685 -135.95877 7.04808 2.45872 -136.78701 821.31133
5070.0000 -144.28098 -139.27889 5.00209 2.42080 -137.36170 791.84041
5075.0000 -142.98859 -137.84071 5.14788 2.34530 -138.50604 748.23288
5080.0000 -143.14369 -138.16162 4.98208 2.37326 -138.08220 737.54637
5085.0000 -144.17824 -137.47641 6.70183 2.41091 -137.51166 746.47810
5090.0000 -142.97925 -137.11832 5.86093 2.42370 -137.31774 798.22867
5095.0000 -142.87409 -138.76437 4.10972 2.32083 -138.87680 698.22010
5100.0000 -144.11029 -138.43840 5.67189 2.35644 -138.33717 742.37431
5105.0000 -143.63267 -138.40861 5.22406 2.41146 -137.50337 764.86454
5110.0000 -145.12942 -138.66538 6.46403 2.36981 -138.13456 748.07544
5115.0000 -143.60065 -137.81538 5.78527 2.35379 -138.37732 742.78775
5120.0000 -144.54709 -138.97135 5.57575 2.35339 -138.38331 733.26237
5125.0000 -143.76172 -136.93035 6.83137 2.37133 -138.11152 745.29010
5130.0000 -143.08997 -136.42347 6.66650 2.45032 -136.91442 800.98231
5135.0000 -144.24749 -138.71553 5.53196 2.43714 -137.11415 804.66272
5140.0000 -142.44626 -137.57729 4.86897 2.38538 -137.89862 758.04712
5145.0000 -144.04344 -139.18913 4.85431 2.35172 -138.40875 732.18392
5150.0000 -143.39301 -138.73433 4.65868 2.32005 -138.88866 710.24299
5155.0000 -143.81702 -138.56820 5.24883 2.34140 -138.56513 690.98847
5160.0000 -142.85071 -137.28451 5.56620 2.41318 -137.47731 775.54333
5165.0000 -143.10427 -137.04098 6.06329 2.38351 -137.92693 725.83259
5170.0000 -143.17225 -138.00696 5.16530 2.40302 -137.63123 756.68513
5175.0000 -143.94573 -138.57060 5.37513 2.35663 -138.33432 729.43743
5180.0000 -142.66438 -137.02070 5.64368 2.37363 -138.07671 749.71638
5185.0000 -141.81309 -136.27968 5.53341 2.45965 -136.77299 804.28997
5190.0000 -141.79747 -136.25093 5.54654 2.47683 -136.51257 820.24069
5195.0000 -142.70233 -137.81144 4.89089 2.46405 -136.70634 814.96043
5200.0000 -144.86902 -138.14163 6.72739 2.35366 -138.37925 739.49145
5205.0000 -144.90398 -139.56626 5.33772 2.30828 -139.06702 729.07592
5210.0000 -145.19378 -139.43203 5.76175 2.25468 -139.87930 665.32866
5215.0000 -143.81680 -138.10671 5.71009 2.29951 -139.19996 697.70721
5220.0000 -143.26776 -137.87066 5.39710 2.34839 -138.45918 731.20764
5225.0000 -143.78438 -138.40800 5.37638 2.37002 -138.13132 735.71223
5230.0000 -143.22817 -137.03698 6.19120 2.39078 -137.81675 733.73439
5235.0000 -143.88982 -137.23178 6.65803 2.42758 -137.25906 762.22803
5240.0000 -142.92848 -137.41636 5.51213 2.40942 -137.53424 768.95828
5245.0000 -142.72715 -137.81497 4.91219 2.37731 -138.02089 718.98754
5250.0000 -144.58873 -138.30652 6.28221 2.39615 -137.73535 753.12680
FREEZING PROCESS: loop number 22 T-loop= 745.00000000000000
main_MD> interactions number 22 at Temperature= 745.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.08684 -0.69376 -2.93919
force_rgl> df(natom) -1.54711 -2.20728 -1.32088
5255.0000 -144.84419 -138.75244 6.09175 2.33862 -138.60725 708.59044
5260.0000 -144.86008 -138.77391 6.08618 2.36828 -138.15773 767.61497
5265.0000 -144.49627 -138.63980 5.85647 2.33168 -138.71244 751.65372
5270.0000 -144.20399 -138.04877 6.15522 2.34861 -138.45587 731.13213
5275.0000 -144.29673 -139.37144 4.92529 2.32498 -138.81388 708.73122
5280.0000 -144.01613 -138.09708 5.91904 2.33222 -138.70419 715.60331
5285.0000 -143.35233 -137.67558 5.67676 2.40879 -137.54370 761.34456
5290.0000 -141.98527 -135.50399 6.48128 2.45882 -136.78549 815.02937
5295.0000 -144.32367 -138.08918 6.23449 2.50296 -136.11651 823.99833
5300.0000 -143.56407 -137.60579 5.95828 2.39391 -137.76934 754.27136
5305.0000 -143.49148 -137.96569 5.52579 2.39824 -137.70372 752.70769
5310.0000 -143.93222 -137.27013 6.66209 2.39068 -137.81826 759.91269
5315.0000 -144.19547 -137.05514 7.14033 2.44771 -136.95397 774.71611
5320.0000 -142.38014 -137.00516 5.37498 2.42243 -137.33711 764.62127
5325.0000 -143.42134 -138.39640 5.02494 2.39091 -137.81480 736.05058
5330.0000 -144.52016 -138.54264 5.97752 2.30980 -139.04407 704.34087
5335.0000 -141.73543 -135.75552 5.97991 2.44453 -137.00210 802.87684
5340.0000 -143.93610 -138.13276 5.80334 2.48431 -136.39927 816.11303
5345.0000 -144.03213 -137.80765 6.22448 2.37552 -138.04802 767.57913
5350.0000 -142.94942 -137.70544 5.24397 2.37856 -138.00189 711.31697
5355.0000 -144.44458 -138.67626 5.76832 2.34719 -138.47730 725.92123
5360.0000 -144.25864 -138.60550 5.65314 2.34080 -138.57425 733.25971
5365.0000 -143.12999 -137.88481 5.24518 2.35642 -138.33752 710.90793
5370.0000 -143.48982 -137.60708 5.88274 2.41939 -137.38317 768.60592
5375.0000 -143.68578 -138.46699 5.21878 2.42295 -137.32914 750.15873
5380.0000 -143.89809 -137.77062 6.12747 2.32037 -138.88376 708.81602
5385.0000 -143.38334 -137.84856 5.53478 2.39390 -137.76941 773.78910
5390.0000 -144.52128 -139.02015 5.50114 2.34729 -138.47585 732.13882
5395.0000 -143.95925 -138.26117 5.69808 2.33656 -138.63843 684.63091
5400.0000 -142.52406 -137.20310 5.32096 2.37505 -138.05508 737.37108
5405.0000 -141.88139 -135.99475 5.88664 2.47129 -136.59653 762.33016
5410.0000 -143.58373 -137.93663 5.64710 2.46720 -136.65856 802.05791
5415.0000 -145.14924 -139.49057 5.65867 2.34792 -138.46624 696.49898
5420.0000 -143.71381 -137.95104 5.76277 2.38010 -137.97856 742.36268
5425.0000 -143.78721 -138.28612 5.50109 2.32631 -138.79379 695.08973
5430.0000 -144.43295 -139.47020 4.96275 2.31609 -138.94863 700.76456
5435.0000 -144.74953 -138.64396 6.10556 2.31894 -138.90543 711.75443
5440.0000 -144.17507 -139.34460 4.83048 2.29281 -139.30144 709.72688
5445.0000 -143.93153 -138.65905 5.27249 2.30740 -139.08037 733.73619
5450.0000 -144.47845 -139.72734 4.75111 2.27894 -139.51175 708.25710
5455.0000 -144.72589 -138.86947 5.85643 2.31765 -138.92504 716.42434
5460.0000 -144.56032 -139.35427 5.20605 2.35353 -138.38126 749.98407
5465.0000 -145.54225 -140.14042 5.40183 2.27417 -139.58407 677.49051
5470.0000 -145.14428 -139.56770 5.57658 2.30338 -139.14128 694.51561
5475.0000 -144.86193 -139.12800 5.73393 2.28112 -139.47859 687.75701
5480.0000 -145.14209 -138.06137 7.08071 2.32770 -138.77279 701.33334
5485.0000 -142.49896 -137.65785 4.84111 2.38848 -137.85152 751.30335
5490.0000 -145.08379 -138.62421 6.45958 2.37150 -138.10899 762.52597
5495.0000 -144.09505 -137.36119 6.73386 2.39453 -137.75995 771.63270
5500.0000 -143.26291 -137.31251 5.95040 2.40026 -137.67311 766.04782
FREEZING PROCESS: loop number 23 T-loop= 720.00000000000000
main_MD> interactions number 23 at Temperature= 720.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.32671 1.08152 -1.10926
force_rgl> df(natom) -4.70419 4.50422 7.41490
5505.0000 -143.31184 -137.74972 5.56212 2.41804 -137.40361 763.29407
5510.0000 -143.94901 -138.54703 5.40198 2.41306 -137.47906 767.47964
5515.0000 -144.66413 -139.06255 5.60158 2.32746 -138.77636 713.14907
5520.0000 -144.78782 -139.45361 5.33422 2.31080 -139.02888 701.96034
5525.0000 -143.10413 -137.97236 5.13177 2.31846 -138.91283 730.18188
5530.0000 -145.86981 -140.12224 5.74757 2.30181 -139.16514 723.10313
5535.0000 -144.65592 -139.51006 5.14587 2.23796 -140.13270 640.15488
5540.0000 -145.47317 -139.34214 6.13103 2.27104 -139.63144 684.72279
5545.0000 -143.08672 -138.92655 4.16017 2.33380 -138.68024 742.55034
5550.0000 -144.25236 -138.59764 5.65472 2.34308 -138.53968 725.19910
5555.0000 -145.21772 -139.43948 5.77824 2.30118 -139.17471 681.06784
5560.0000 -145.03894 -139.10928 5.92966 2.30112 -139.17557 684.97346
5565.0000 -143.71287 -138.67090 5.04196 2.34201 -138.55579 745.68871
5570.0000 -143.19980 -137.74367 5.45612 2.38229 -137.94541 757.03888
5575.0000 -143.49556 -138.17711 5.31844 2.39304 -137.78250 761.00900
5580.0000 -143.96921 -138.81503 5.15418 2.35691 -138.33006 730.26610
5585.0000 -143.69949 -138.17704 5.52245 2.32192 -138.86035 722.76897
5590.0000 -143.28742 -138.90512 4.38230 2.36965 -138.13703 740.36468
5595.0000 -144.82330 -139.66274 5.16056 2.34472 -138.51478 731.05523
5600.0000 -145.37570 -140.36164 5.01405 2.24022 -140.09845 655.76581
5605.0000 -144.58133 -139.10944 5.47189 2.25847 -139.82195 635.29281
5610.0000 -144.62215 -139.64767 4.97449 2.31357 -138.98685 736.22149
5615.0000 -143.37861 -137.26647 6.11214 2.33535 -138.65682 697.95935
5620.0000 -143.29133 -137.78954 5.50179 2.41475 -137.45338 770.61911
5625.0000 -143.82353 -138.28840 5.53512 2.39917 -137.68953 780.73232
5630.0000 -145.30734 -139.19154 6.11580 2.38384 -137.92189 778.92411
5635.0000 -144.80905 -139.61060 5.19845 2.28236 -139.45980 693.24553
5640.0000 -144.19422 -139.42045 4.77378 2.28118 -139.47783 690.35795
5645.0000 -144.64360 -137.93535 6.70825 2.33658 -138.63809 729.53710
5650.0000 -144.27651 -137.47183 6.80468 2.39832 -137.70239 796.18827
5655.0000 -144.73046 -139.22117 5.50929 2.33379 -138.68050 738.17855
5660.0000 -143.36944 -138.40781 4.96163 2.30532 -139.11185 696.21728
5665.0000 -143.53908 -138.47096 5.06812 2.32152 -138.86635 730.61502
5670.0000 -144.40792 -139.94397 4.46394 2.32466 -138.81874 719.25302
5675.0000 -145.22931 -140.14422 5.08509 2.24873 -139.96948 658.97974
5680.0000 -145.23984 -141.31587 3.92397 2.22413 -140.34243 641.15249
5685.0000 -146.39758 -140.43558 5.96200 2.18854 -140.88169 615.76819
5690.0000 -144.46946 -138.67582 5.79364 2.29878 -139.21108 718.95378
5695.0000 -143.74854 -138.58338 5.16516 2.29673 -139.24205 698.13419
5700.0000 -144.55281 -139.10665 5.44615 2.32507 -138.81251 701.72985
5705.0000 -143.59123 -138.22488 5.36634 2.35783 -138.31607 745.78238
5710.0000 -143.27885 -137.73463 5.54422 2.34164 -138.56141 692.33429
5715.0000 -144.66678 -139.53846 5.12832 2.33117 -138.72017 713.53549
5720.0000 -144.32578 -137.69659 6.62919 2.37197 -138.10181 753.66019
5725.0000 -144.21604 -139.37802 4.83802 2.32933 -138.74799 719.57872
5730.0000 -143.74127 -138.82210 4.91917 2.27622 -139.55286 661.83086
5735.0000 -144.60565 -139.44524 5.16041 2.27897 -139.51122 663.23527
5740.0000 -145.76351 -140.74607 5.01744 2.25489 -139.87612 657.18344
5745.0000 -145.47921 -140.86124 4.61797 2.20933 -140.56666 612.05307
5750.0000 -144.82007 -140.01271 4.80736 2.22461 -140.33505 617.94998
FREEZING PROCESS: loop number 24 T-loop= 695.00000000000000
main_MD> interactions number 24 at Temperature= 695.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.82430 -0.46687 -0.79810
force_rgl> df(natom) -3.26823 -0.11626 1.33192
5755.0000 -144.46618 -140.01379 4.45239 2.27018 -139.64447 648.34834
5760.0000 -144.94461 -139.95696 4.98765 2.27905 -139.51002 627.34047
5765.0000 -144.82722 -139.10881 5.71841 2.30075 -139.18112 675.83431
5770.0000 -143.87685 -139.17221 4.70464 2.31036 -139.03558 684.61928
5775.0000 -143.78536 -137.87986 5.90551 2.37339 -138.08024 752.42932
5780.0000 -145.00364 -139.36989 5.63375 2.33508 -138.66095 720.69790
5785.0000 -143.76350 -138.79443 4.96907 2.26928 -139.65803 670.80492
5790.0000 -145.06839 -139.80685 5.26155 2.23363 -140.19841 655.71300
5795.0000 -144.92350 -140.10532 4.81817 2.23716 -140.14486 651.46138
5800.0000 -145.47092 -140.15306 5.31786 2.25366 -139.89480 655.52953
5805.0000 -144.55996 -139.58511 4.97485 2.24494 -140.02703 651.40273
5810.0000 -143.07958 -137.04777 6.03180 2.35817 -138.31099 730.34617
5815.0000 -144.56115 -138.85698 5.70418 2.36952 -138.13900 721.95145
5820.0000 -145.79880 -139.23324 6.56555 2.29899 -139.20790 708.05946
5825.0000 -143.61432 -138.20245 5.41187 2.33656 -138.63840 699.15871
5830.0000 -144.72991 -138.59468 6.13523 2.33444 -138.67062 704.43293
5835.0000 -143.55262 -138.48657 5.06605 2.36221 -138.24969 708.79995
5840.0000 -143.37701 -139.11740 4.25961 2.32739 -138.77746 714.08385
5845.0000 -144.76235 -138.95587 5.80648 2.28656 -139.39623 667.55162
5850.0000 -144.29090 -138.54316 5.74774 2.32242 -138.85270 705.31314
5855.0000 -143.49113 -138.73933 4.75181 2.31651 -138.94227 709.50153
5860.0000 -144.35307 -138.69759 5.65548 2.33396 -138.67793 726.37415
5865.0000 -144.80458 -139.29631 5.50827 2.35771 -138.31790 773.08438
5870.0000 -144.50551 -139.34312 5.16239 2.29367 -139.28850 689.66525
5875.0000 -144.37066 -138.33390 6.03676 2.32538 -138.80783 744.06488
5880.0000 -142.00934 -137.51357 4.49578 2.33098 -138.72307 694.27737
5885.0000 -144.12273 -138.25534 5.86739 2.36814 -138.15981 706.37171
5890.0000 -144.12385 -139.23572 4.88813 2.32458 -138.82005 693.44897
5895.0000 -143.56957 -138.67754 4.89203 2.30775 -139.07507 709.41633
5900.0000 -144.78206 -140.56658 4.21547 2.28652 -139.39680 682.77602
5905.0000 -145.34690 -140.23639 5.11051 2.20969 -140.56122 648.03247
5910.0000 -144.83547 -140.39213 4.44334 2.21335 -140.50579 651.51400
5915.0000 -144.83921 -139.24104 5.59816 2.25330 -139.90034 672.66333
5920.0000 -144.50218 -138.71468 5.78750 2.32090 -138.87577 710.67236
5925.0000 -144.25529 -139.15229 5.10300 2.34533 -138.50553 732.98049
5930.0000 -144.44202 -139.05531 5.38671 2.27581 -139.55910 675.07935
5935.0000 -144.38915 -138.86732 5.52183 2.33141 -138.71644 709.48526
5940.0000 -144.30419 -139.78973 4.51445 2.29631 -139.24848 690.16544
5945.0000 -145.33132 -140.13725 5.19408 2.24528 -140.02191 637.62013
5950.0000 -144.85495 -140.43265 4.42230 2.19849 -140.73103 623.25684
5955.0000 -144.99358 -140.51716 4.47642 2.21986 -140.40708 660.30356
5960.0000 -144.57012 -139.42169 5.14843 2.29263 -139.30422 672.83200
5965.0000 -145.18535 -139.75056 5.43478 2.24573 -140.01505 653.14539
5970.0000 -143.54912 -138.78172 4.76739 2.26956 -139.65394 665.98384
5975.0000 -144.07602 -139.18922 4.88681 2.32112 -138.87242 677.75127
5980.0000 -144.19747 -137.96034 6.23714 2.31359 -138.98657 678.61696
5985.0000 -144.12336 -137.90835 6.21500 2.35009 -138.43346 712.97753
5990.0000 -142.99814 -138.35375 4.64439 2.37784 -138.01277 724.22130
5995.0000 -143.91941 -139.11506 4.80435 2.34133 -138.56616 679.90316
6000.0000 -142.79604 -137.38518 5.41086 2.34250 -138.54845 722.80218
FREEZING PROCESS: loop number 25 T-loop= 670.00000000000000
main_MD> interactions number 25 at Temperature= 670.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.64187 -5.91351 -2.74974
force_rgl> df(natom) 2.87487 -0.50584 -0.62236
6005.0000 -143.00614 -137.54527 5.46087 2.38743 -137.86746 740.17194
6010.0000 -143.28859 -138.63334 4.65525 2.41566 -137.43969 724.33160
6015.0000 -145.04633 -139.76384 5.28249 2.30847 -139.06410 706.51904
6020.0000 -144.44747 -138.82530 5.62217 2.27048 -139.63990 684.30784
6025.0000 -145.74408 -141.07723 4.66685 2.25168 -139.92479 660.91431
6030.0000 -145.06693 -139.95340 5.11353 2.22780 -140.28677 634.01751
6035.0000 -144.44980 -139.85637 4.59343 2.23166 -140.22827 629.02944
6040.0000 -146.07437 -141.26978 4.80459 2.20068 -140.69781 607.62566
6045.0000 -144.91230 -139.96399 4.94831 2.18700 -140.90515 617.10522
6050.0000 -144.89214 -140.46439 4.42776 2.24274 -140.06040 652.93936
6055.0000 -145.19053 -139.35857 5.83196 2.27261 -139.60769 667.13504
6060.0000 -144.88530 -139.48741 5.39789 2.26407 -139.73709 666.02161
6065.0000 -144.91111 -139.84792 5.06319 2.27332 -139.59685 677.04187
6070.0000 -144.75048 -140.17966 4.57082 2.23802 -140.13179 646.30262
6075.0000 -145.55690 -141.18200 4.37490 2.20307 -140.66157 622.22790
6080.0000 -144.40054 -140.36368 4.03686 2.18562 -140.92601 616.31193
6085.0000 -145.66165 -140.41087 5.25078 2.22419 -140.34146 631.57292
6090.0000 -145.63322 -140.75836 4.87486 2.18449 -140.94317 659.73197
6095.0000 -146.13071 -141.18854 4.94217 2.19346 -140.80722 669.04845
6100.0000 -145.93780 -140.77438 5.16342 2.18800 -140.89000 651.91512
6105.0000 -146.24857 -140.17205 6.07652 2.18180 -140.98390 646.46562
6110.0000 -144.57966 -139.75974 4.81991 2.24804 -139.98006 668.82080
6115.0000 -145.03933 -140.08425 4.95508 2.24825 -139.97687 663.91322
6120.0000 -144.95151 -140.51115 4.44036 2.24731 -139.99102 642.24832
6125.0000 -144.81281 -139.87134 4.94147 2.25433 -139.88462 648.47938
6130.0000 -144.66636 -139.57451 5.09185 2.25936 -139.80851 652.22134
6135.0000 -144.31311 -139.74589 4.56722 2.27559 -139.56249 649.65193
6140.0000 -143.84601 -137.99533 5.85067 2.30868 -139.06094 707.14216
6145.0000 -144.57949 -139.46941 5.11008 2.31655 -138.94168 686.81922
6150.0000 -145.30353 -140.22095 5.08258 2.28606 -139.40380 673.82955
6155.0000 -143.97535 -138.23287 5.74248 2.29271 -139.30299 656.48811
6160.0000 -143.68312 -138.50737 5.17575 2.37797 -138.01087 779.82661
6165.0000 -144.34387 -139.69650 4.64737 2.30828 -139.06700 699.55139
6170.0000 -145.66869 -140.89257 4.77612 2.25102 -139.93490 647.66430
6175.0000 -144.24956 -139.49051 4.75906 2.26155 -139.77528 660.52844
6180.0000 -144.73889 -139.31690 5.42199 2.29577 -139.25670 687.58909
6185.0000 -144.99978 -140.56229 4.43749 2.30190 -139.16381 684.93443
6190.0000 -144.76691 -140.35763 4.40928 2.25353 -139.89687 646.18052
6195.0000 -144.24917 -139.91261 4.33656 2.23332 -140.20309 660.21200
6200.0000 -145.59348 -139.18647 6.40701 2.28289 -139.45188 683.58176
6205.0000 -145.52808 -140.24430 5.28378 2.26783 -139.68006 672.31485
6210.0000 -145.39322 -139.52424 5.86898 2.23901 -140.11682 646.21996
6215.0000 -145.34416 -139.67501 5.66915 2.26208 -139.76723 658.69130
6220.0000 -144.66279 -140.10833 4.55445 2.25527 -139.87037 659.08054
6225.0000 -144.90953 -139.68540 5.22413 2.25685 -139.84643 636.15774
6230.0000 -145.39956 -140.82247 4.57710 2.20810 -140.58525 637.65848
6235.0000 -145.54257 -141.00911 4.53346 2.20018 -140.70534 613.81550
6240.0000 -145.64732 -140.38744 5.25988 2.22213 -140.37265 627.17487
6245.0000 -144.77726 -139.90685 4.87041 2.21918 -140.41734 635.94158
6250.0000 -145.05974 -140.40074 4.65900 2.26023 -139.79520 657.09128
FREEZING PROCESS: loop number 26 T-loop= 645.00000000000000
main_MD> interactions number 26 at Temperature= 645.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.15700 -1.02541 -7.45813
force_rgl> df(natom) 0.51282 1.18399 1.05675
6255.0000 -144.60359 -139.75719 4.84639 2.24416 -140.03886 650.04474
6260.0000 -145.64388 -140.95258 4.69130 2.22439 -140.33839 638.86191
6265.0000 -145.30525 -140.87583 4.42942 2.21670 -140.45490 625.81058
6270.0000 -146.40696 -141.44529 4.96168 2.20898 -140.57203 626.97702
6275.0000 -145.69935 -141.36075 4.33860 2.15341 -141.41409 585.66617
6280.0000 -145.55663 -139.74951 5.80712 2.19438 -140.79329 626.07686
6285.0000 -144.98322 -139.94708 5.03614 2.24078 -140.09010 677.61174
6290.0000 -146.16357 -141.51647 4.64710 2.21721 -140.44732 652.34724
6295.0000 -146.73870 -140.83840 5.90030 2.17478 -141.09030 654.87762
6300.0000 -145.24028 -140.09407 5.14621 2.22657 -140.30544 656.45906
6305.0000 -145.17544 -139.78599 5.38945 2.19512 -140.78200 641.12160
6310.0000 -146.42407 -141.70517 4.71890 2.17508 -141.08570 640.58772
6315.0000 -146.56790 -142.00200 4.56590 2.13935 -141.62725 585.43924
6320.0000 -146.19704 -141.51749 4.67954 2.16682 -141.21096 594.86544
6325.0000 -145.13505 -140.19951 4.93554 2.18152 -140.98812 628.68029
6330.0000 -145.64978 -141.14354 4.50624 2.19776 -140.74199 629.89253
6335.0000 -145.79025 -141.18202 4.60823 2.14022 -141.61408 584.65489
6340.0000 -144.41026 -139.98328 4.42698 2.17111 -141.14594 588.68933
6345.0000 -145.06340 -140.23277 4.83063 2.23986 -140.10392 622.32260
6350.0000 -144.48480 -139.88700 4.59780 2.26738 -139.68695 668.36647
6355.0000 -145.12014 -140.67974 4.44040 2.21514 -140.47864 628.53472
6360.0000 -145.41027 -140.57242 4.83784 2.21300 -140.51101 628.80555
6365.0000 -144.79903 -140.21466 4.58437 2.20495 -140.63311 631.85028
6370.0000 -146.04737 -141.75413 4.29325 2.20692 -140.60317 630.12365
6375.0000 -144.09299 -139.11368 4.97931 2.20699 -140.60216 643.16916
6380.0000 -144.62647 -140.22107 4.40540 2.26142 -139.77718 662.77590
6385.0000 -144.90332 -139.80762 5.09570 2.24908 -139.96424 646.55518
6390.0000 -144.80105 -139.35612 5.44493 2.24631 -140.00623 659.97868
6395.0000 -145.87552 -140.85491 5.02061 2.20851 -140.57909 626.16250
6400.0000 -144.01292 -139.41960 4.59332 2.23135 -140.23291 623.57375
6405.0000 -145.67001 -141.63283 4.03718 2.18574 -140.92418 606.25682
6410.0000 -145.94561 -142.16143 3.78419 2.12295 -141.87576 537.58106
6415.0000 -146.07864 -141.34149 4.73715 2.12588 -141.83134 560.64230
6420.0000 -145.83479 -141.04260 4.79219 2.19425 -140.79516 621.14574
6425.0000 -145.66658 -141.36419 4.30239 2.14334 -141.56677 593.23186
6430.0000 -146.16888 -142.09996 4.06892 2.12753 -141.80640 581.23199
6435.0000 -146.16498 -141.66873 4.49625 2.13173 -141.74277 590.57706
6440.0000 -144.84178 -141.62889 3.21289 2.15974 -141.31818 595.72022
6445.0000 -144.79172 -139.03366 5.75807 2.25082 -139.93780 655.39534
6450.0000 -145.21825 -140.40273 4.81552 2.29070 -139.33345 703.35267
6455.0000 -144.24832 -139.76289 4.48543 2.23503 -140.17722 642.91484
6460.0000 -144.30377 -139.23766 5.06612 2.30872 -139.06043 690.73308
6465.0000 -146.06948 -139.87308 6.19640 2.24265 -140.06165 679.21399
6470.0000 -146.42859 -140.79495 5.63364 2.21047 -140.54937 653.72829
6475.0000 -145.56920 -140.88424 4.68496 2.19683 -140.75613 619.53574
6480.0000 -146.26099 -141.42480 4.83619 2.14972 -141.47013 594.26551
6485.0000 -145.04210 -140.12848 4.91362 2.19732 -140.74868 605.77856
6490.0000 -145.96031 -141.12046 4.83986 2.17449 -141.09461 593.88076
6495.0000 -144.98427 -140.02929 4.95498 2.21269 -140.51568 651.16617
6500.0000 -144.56391 -139.41315 5.15077 2.29812 -139.22108 704.80139
FREEZING PROCESS: loop number 27 T-loop= 620.00000000000000
main_MD> interactions number 27 at Temperature= 620.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.65340 0.27613 0.70373
force_rgl> df(natom) -0.14909 -1.47329 -2.30139
6505.0000 -145.35057 -140.49020 4.86037 2.26214 -139.76636 677.97034
6510.0000 -145.15477 -140.46619 4.68858 2.21587 -140.46759 646.17274
6515.0000 -146.30499 -139.94380 6.36119 2.23793 -140.13316 677.58386
6520.0000 -145.25093 -140.80992 4.44100 2.23967 -140.10690 676.64416
6525.0000 -146.35943 -141.48909 4.87033 2.19114 -140.84242 595.04608
6530.0000 -145.05840 -140.22458 4.83383 2.21234 -140.52101 626.54948
6535.0000 -145.48254 -140.54600 4.93654 2.20308 -140.66143 602.62251
6540.0000 -144.83329 -140.35856 4.47472 2.22784 -140.28618 652.44476
6545.0000 -146.00998 -141.33289 4.67709 2.20067 -140.69797 639.18685
6550.0000 -145.06257 -140.73807 4.32450 2.18718 -140.90243 626.54105
6555.0000 -146.55224 -141.91668 4.63556 2.13013 -141.76694 574.28288
6560.0000 -145.60602 -141.11556 4.49046 2.12342 -141.86860 594.01794
6565.0000 -145.83341 -141.13417 4.69923 2.14138 -141.59655 599.96102
6570.0000 -145.21824 -140.79741 4.42084 2.16846 -141.18604 626.20497
6575.0000 -146.11008 -141.94260 4.16748 2.13771 -141.65206 588.51449
6580.0000 -145.79209 -141.42551 4.36658 2.12381 -141.86271 574.89591
6585.0000 -144.94376 -140.03366 4.91010 2.20206 -140.67684 604.21056
6590.0000 -145.50060 -141.12042 4.38019 2.20034 -140.70289 611.11057
6595.0000 -144.78717 -140.46489 4.32228 2.21379 -140.49913 646.99920
6600.0000 -144.76590 -140.40112 4.36478 2.21160 -140.53224 628.31787
6605.0000 -145.28360 -140.76463 4.51897 2.20674 -140.60588 598.76280
6610.0000 -145.91561 -141.45185 4.46375 2.17532 -141.08214 581.18282
6615.0000 -145.48006 -140.74235 4.73771 2.18621 -140.91707 601.60046
6620.0000 -146.07734 -141.92407 4.15327 2.17523 -141.08345 596.51169
6625.0000 -145.74261 -141.88750 3.85511 2.12076 -141.90896 547.40718
6630.0000 -144.72194 -139.95255 4.76940 2.16946 -141.17095 593.17091
6635.0000 -145.26494 -140.46157 4.80337 2.17741 -141.05050 607.76914
6640.0000 -145.28005 -140.68271 4.59734 2.21731 -140.44576 626.15261
6645.0000 -145.51200 -140.99569 4.51631 2.16392 -141.25484 599.70822
6650.0000 -145.20012 -139.66758 5.53253 2.23891 -140.11844 653.78369
6655.0000 -144.69981 -139.61438 5.08543 2.25740 -139.83809 625.23356
6660.0000 -146.10313 -141.21640 4.88672 2.28414 -139.43293 672.31468
6665.0000 -144.97263 -140.37629 4.59633 2.18349 -140.95822 599.96218
6670.0000 -144.97414 -139.77372 5.20042 2.19180 -140.83238 617.95016
6675.0000 -145.01060 -139.90509 5.10551 2.25420 -139.88661 665.61032
6680.0000 -144.48922 -139.49443 4.99478 2.24014 -140.09971 639.37027
6685.0000 -145.30575 -139.49193 5.81382 2.26282 -139.75596 655.24373
6690.0000 -145.33059 -140.42700 4.90359 2.25375 -139.89351 645.17276
6695.0000 -145.27415 -140.62740 4.64675 2.22210 -140.37306 617.13529
6700.0000 -143.78232 -139.00396 4.77836 2.30682 -139.08913 691.58053
6705.0000 -144.82071 -139.52432 5.29639 2.28314 -139.44802 670.56438
6710.0000 -146.28565 -141.99280 4.29284 2.19272 -140.81834 625.10185
6715.0000 -146.02293 -141.72153 4.30141 2.15633 -141.36987 609.79809
6720.0000 -144.23799 -139.70468 4.53331 2.20278 -140.66590 627.49997
6725.0000 -144.31477 -139.44622 4.86855 2.29448 -139.27619 703.52792
6730.0000 -144.82469 -140.50327 4.32142 2.24186 -140.07361 631.15627
6735.0000 -144.94544 -139.92722 5.01821 2.20252 -140.66982 602.47027
6740.0000 -145.63495 -140.78178 4.85317 2.24387 -140.04325 658.71714
6745.0000 -145.71283 -141.26502 4.44781 2.16138 -141.29334 590.59537
6750.0000 -144.72457 -139.79061 4.93397 2.22734 -140.29368 627.27021
FREEZING PROCESS: loop number 28 T-loop= 595.00000000000000
main_MD> interactions number 28 at Temperature= 595.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.44697 -1.03906 -1.75658
force_rgl> df(natom) -0.09281 1.13326 2.73857
6755.0000 -145.75580 -140.77965 4.97614 2.23006 -140.25252 636.13481
6760.0000 -146.49142 -141.44872 5.04269 2.18535 -140.93005 593.40519
6765.0000 -145.40136 -140.91125 4.49011 2.17412 -141.10022 609.98774
6770.0000 -144.80790 -139.65288 5.15502 2.23279 -140.21108 650.59187
6775.0000 -145.57432 -139.96081 5.61351 2.26065 -139.78885 650.95781
6780.0000 -144.67202 -140.49021 4.18181 2.25140 -139.92902 657.14012
6785.0000 -145.12346 -140.79871 4.32475 2.19534 -140.77874 600.41736
6790.0000 -145.11265 -139.99398 5.11867 2.19663 -140.75911 594.98190
6795.0000 -146.21453 -141.11906 5.09547 2.23286 -140.21004 637.89321
6800.0000 -145.52013 -140.66862 4.85151 2.16216 -141.28157 590.44625
6805.0000 -145.83832 -140.88246 4.95586 2.18413 -140.94861 588.74015
6810.0000 -146.37848 -141.32300 5.05548 2.16870 -141.18245 589.37576
6815.0000 -146.30555 -142.13768 4.16787 2.12572 -141.83376 556.84404
6820.0000 -145.32568 -140.98853 4.33715 2.12798 -141.79955 540.83636
6825.0000 -145.19817 -141.07171 4.12647 2.21145 -140.53459 622.42674
6830.0000 -145.16492 -139.75152 5.41340 2.20531 -140.62763 624.36653
6835.0000 -145.75467 -140.19543 5.55924 2.23578 -140.16580 640.57757
6840.0000 -145.64835 -141.42579 4.22256 2.19304 -140.81363 625.69005
6845.0000 -146.87040 -143.41353 3.45687 2.11751 -141.95830 545.52708
6850.0000 -145.31374 -141.56454 3.74919 2.09341 -142.32351 533.18778
6855.0000 -144.60445 -140.54253 4.06192 2.19231 -140.82466 582.69973
6860.0000 -143.95330 -139.42121 4.53210 2.23605 -140.16174 607.81682
6865.0000 -145.86165 -141.51801 4.34364 2.19682 -140.75629 625.83950
6870.0000 -144.87439 -140.61888 4.25551 2.16118 -141.29645 578.22656
6875.0000 -146.32958 -142.04815 4.28143 2.17269 -141.12195 600.11745
6880.0000 -146.37478 -141.69089 4.68389 2.10489 -142.14948 597.46969
6885.0000 -146.41290 -141.98297 4.42993 2.09283 -142.33230 601.41412
6890.0000 -147.16335 -141.87966 5.28369 2.13379 -141.71149 627.06603
6895.0000 -147.33234 -141.90267 5.42966 2.12194 -141.89111 632.71101
6900.0000 -147.05552 -142.03421 5.02131 2.08557 -142.44225 584.21390
6905.0000 -147.17000 -143.10935 4.06065 2.09279 -142.33289 587.25581
6910.0000 -146.76274 -142.16110 4.60164 2.07696 -142.57277 580.73471
6915.0000 -146.43110 -141.20623 5.22488 2.10421 -142.15983 576.46022
6920.0000 -146.99594 -142.14832 4.84762 2.12122 -141.90203 557.40674
6925.0000 -146.11958 -142.26576 3.85382 2.11243 -142.03518 565.30635
6930.0000 -146.17302 -141.57246 4.60057 2.12287 -141.87695 564.19878
6935.0000 -145.95274 -141.59074 4.36200 2.14116 -141.59984 581.65926
6940.0000 -145.75848 -141.34405 4.41444 2.17442 -141.09570 618.04819
6945.0000 -145.57104 -141.14895 4.42209 2.16945 -141.17107 602.77615
6950.0000 -145.30533 -141.04708 4.25825 2.16705 -141.20744 611.23322
6955.0000 -146.12037 -142.28102 3.83935 2.12735 -141.80916 571.22800
6960.0000 -146.11884 -141.98678 4.13206 2.14695 -141.51210 584.19989
6965.0000 -146.59370 -142.10377 4.48993 2.13408 -141.70715 578.50181
6970.0000 -146.72227 -141.97533 4.74694 2.14156 -141.59374 589.72731
6975.0000 -146.54611 -142.28918 4.25693 2.12666 -141.81955 567.74644
6980.0000 -145.69405 -140.84027 4.85378 2.15439 -141.39927 592.11591
6985.0000 -146.23231 -142.00494 4.22737 2.17167 -141.13740 607.67036
6990.0000 -144.51505 -140.64096 3.87409 2.16835 -141.18773 621.80318
6995.0000 -144.68932 -140.91892 3.77040 2.20298 -140.66294 631.38662
7000.0000 -145.69630 -141.02851 4.66779 2.20152 -140.68497 634.71551
FREEZING PROCESS: loop number 29 T-loop= 570.00000000000000
main_MD> interactions number 29 at Temperature= 570.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.50573 -2.04220 2.11190
force_rgl> df(natom) -5.37469 1.66655 -3.71262
7005.0000 -145.63752 -140.64377 4.99375 2.18110 -140.99455 599.06411
7010.0000 -145.78395 -140.38075 5.40319 2.18418 -140.94778 609.09024
7015.0000 -145.68234 -140.56850 5.11383 2.20520 -140.62923 610.26244
7020.0000 -145.56531 -140.38326 5.18204 2.21397 -140.49629 629.47446
7025.0000 -146.98729 -142.39161 4.59568 2.15253 -141.42755 597.80492
7030.0000 -146.46964 -142.43927 4.03037 2.11329 -142.02216 569.24140
7035.0000 -146.70545 -142.26731 4.43814 2.05902 -142.84474 548.63341
7040.0000 -146.07620 -142.21598 3.86021 2.10717 -142.11497 560.70029
7045.0000 -145.91807 -141.49074 4.42733 2.16121 -141.29602 595.00717
7050.0000 -146.08534 -141.20801 4.87734 2.14236 -141.58165 577.03675
7055.0000 -146.04759 -141.23778 4.80981 2.16413 -141.25166 605.25926
7060.0000 -146.61175 -142.05224 4.55951 2.14699 -141.51149 596.53313
7065.0000 -146.06217 -142.14259 3.91958 2.10330 -142.17360 535.37948
7070.0000 -145.78625 -141.22197 4.56428 2.11540 -141.99017 560.57776
7075.0000 -145.95767 -142.15665 3.80102 2.11895 -141.93637 569.89878
7080.0000 -146.29204 -142.66642 3.62562 2.07992 -142.52799 552.52342
7085.0000 -146.76070 -142.37173 4.38897 2.09372 -142.31885 574.68065
7090.0000 -147.53945 -143.50436 4.03509 2.08900 -142.39031 545.92569
7095.0000 -147.33725 -143.31614 4.02111 2.03256 -143.24576 514.64094
7100.0000 -146.60683 -142.57677 4.03006 2.09515 -142.29706 575.19149
7105.0000 -147.27713 -142.74927 4.52786 2.08054 -142.51861 566.12651
7110.0000 -146.25093 -141.72703 4.52389 2.06897 -142.69396 572.79695
7115.0000 -147.13513 -142.83718 4.29796 2.07196 -142.64850 589.55500
7120.0000 -147.13328 -142.95896 4.17431 2.03251 -143.24638 525.96320
7125.0000 -146.93041 -142.94466 3.98575 2.07018 -142.67556 563.04204
7130.0000 -146.98313 -143.05678 3.92635 2.03378 -143.22717 567.08808
7135.0000 -146.69936 -142.64192 4.05744 2.03261 -143.24497 545.33019
7140.0000 -147.79324 -143.38050 4.41273 2.06870 -142.69801 575.76613
7145.0000 -146.58580 -142.75233 3.83347 2.05532 -142.90079 560.53230
7150.0000 -146.58355 -142.13546 4.44810 2.10211 -142.19163 592.91112
7155.0000 -146.15388 -141.66916 4.48472 2.13224 -141.73503 581.42513
7160.0000 -147.09900 -142.11023 4.98877 2.10177 -142.19674 567.41178
7165.0000 -146.22838 -141.21196 5.01642 2.14995 -141.46666 579.52592
7170.0000 -145.91351 -142.41520 3.49831 2.14633 -141.52140 590.30037
7175.0000 -145.50917 -142.02594 3.48323 2.09477 -142.30292 538.97044
7180.0000 -146.24085 -142.23552 4.00533 2.07922 -142.53847 552.21349
7185.0000 -146.64793 -141.76715 4.88077 2.08970 -142.37968 547.83424
7190.0000 -146.22428 -141.39758 4.82670 2.11953 -141.92756 544.90232
7195.0000 -144.97944 -140.58476 4.39468 2.17780 -141.04458 605.10713
7200.0000 -145.81008 -141.88817 3.92192 2.16956 -141.16939 559.74502
7205.0000 -146.59144 -142.43431 4.15713 2.11593 -141.98226 542.52857
7210.0000 -146.13994 -141.28815 4.85180 2.12941 -141.77786 565.48877
7215.0000 -145.96592 -141.32650 4.63942 2.15991 -141.31558 602.35229
7220.0000 -146.28801 -141.59309 4.69492 2.13168 -141.74345 562.46561
7225.0000 -146.55378 -142.73224 3.82154 2.11631 -141.97645 548.80009
7230.0000 -146.55129 -141.83060 4.72069 2.10633 -142.12765 546.84965
7235.0000 -146.19244 -141.67408 4.51836 2.13906 -141.63160 578.88634
7240.0000 -146.11627 -141.51683 4.59944 2.13018 -141.76618 552.06048
7245.0000 -146.87715 -142.88518 3.99197 2.08481 -142.45376 549.78373
7250.0000 -147.09586 -142.04266 5.05320 2.11120 -142.05386 546.10442
FREEZING PROCESS: loop number 30 T-loop= 545.00000000000000
main_MD> interactions number 30 at Temperature= 545.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.66935 1.57326 -0.90474
force_rgl> df(natom) 1.03491 -0.65126 1.85315
7255.0000 -146.50913 -142.26988 4.23925 2.12272 -141.87927 571.43024
7260.0000 -146.81393 -142.01208 4.80185 2.10672 -142.12182 538.97866
7265.0000 -147.33410 -143.03829 4.29582 2.09528 -142.29522 611.04589
7270.0000 -147.87958 -143.14793 4.73164 2.02705 -143.32921 572.87480
7275.0000 -147.16586 -142.56514 4.60072 2.03801 -143.16306 567.85499
7280.0000 -148.52466 -144.23737 4.28729 2.02005 -143.43526 564.06702
7285.0000 -148.16444 -143.94245 4.22199 1.96379 -144.28786 508.71160
7290.0000 -147.84465 -143.50173 4.34292 2.00969 -143.59235 536.56721
7295.0000 -147.46994 -143.72631 3.74363 2.00675 -143.63684 525.89425
7300.0000 -146.64715 -142.47718 4.16997 2.04642 -143.03564 550.69653
7305.0000 -147.28463 -143.18829 4.09634 2.03074 -143.27324 536.25826
7310.0000 -147.72661 -144.07916 3.64745 1.99295 -143.84600 501.49293
7315.0000 -147.73900 -143.34575 4.39325 2.01057 -143.57899 522.51654
7320.0000 -146.60122 -142.49791 4.10331 2.06539 -142.74816 577.82946
7325.0000 -147.95148 -143.71618 4.23531 2.04356 -143.07895 560.49196
7330.0000 -147.18299 -143.46694 3.71605 2.01144 -143.56572 521.06269
7335.0000 -147.78192 -144.52615 3.25577 1.98727 -143.93213 492.09665
7340.0000 -146.97514 -143.64346 3.33167 1.98425 -143.97783 483.66150
7345.0000 -147.11080 -143.56014 3.55065 2.04720 -143.02387 521.27653
7350.0000 -147.14530 -142.73742 4.40788 2.02911 -143.29801 491.27872
7355.0000 -147.12653 -143.26606 3.86048 2.03293 -143.24015 518.35893
7360.0000 -146.81776 -141.87223 4.94554 2.07195 -142.64879 552.19959
7365.0000 -147.03613 -142.10774 4.92839 2.10522 -142.14456 559.59555
7370.0000 -146.27690 -141.85988 4.41702 2.09461 -142.30538 549.03092
7375.0000 -147.36155 -143.33278 4.02876 2.11365 -142.01670 594.91200
7380.0000 -147.60164 -143.41099 4.19065 2.03799 -143.16347 541.39063
7385.0000 -148.01908 -142.56901 5.45007 2.03191 -143.25549 551.68808
7390.0000 -145.96828 -141.76631 4.20197 2.08497 -142.45146 587.93216
7395.0000 -146.70136 -142.41672 4.28465 2.10176 -142.19695 562.99644
7400.0000 -146.90511 -142.93861 3.96650 2.02120 -143.41788 489.88401
7405.0000 -147.23436 -142.70548 4.52888 2.05644 -142.88383 529.73328
7410.0000 -146.33403 -142.63199 3.70204 2.06497 -142.75452 531.55510
7415.0000 -146.87648 -143.01205 3.86443 2.08669 -142.42538 561.22999
7420.0000 -145.87207 -142.72476 3.14731 2.07196 -142.64859 564.78229
7425.0000 -147.35788 -142.79763 4.56025 2.04690 -143.02832 518.35032
7430.0000 -146.70419 -142.86132 3.84287 2.05198 -142.95131 525.27585
7435.0000 -148.50062 -143.48917 5.01145 2.03805 -143.16243 535.08773
7440.0000 -147.79894 -142.97666 4.82228 2.02430 -143.37089 541.01960
7445.0000 -147.82706 -143.36604 4.46103 2.04219 -143.09970 548.15813
7450.0000 -147.18133 -143.47887 3.70246 2.03802 -143.16290 535.00182
7455.0000 -147.63255 -143.38909 4.24346 2.04509 -143.05583 528.19649
7460.0000 -147.28668 -143.30507 3.98161 2.03375 -143.22771 524.56749
7465.0000 -147.06875 -143.16130 3.90744 2.02428 -143.37121 508.81209
7470.0000 -146.44686 -142.18828 4.25858 2.05060 -142.97235 525.63410
7475.0000 -146.35934 -141.63865 4.72069 2.10074 -142.21245 558.56228
7480.0000 -146.29790 -141.84617 4.45173 2.11086 -142.05902 567.60162
7485.0000 -145.99122 -141.91815 4.07307 2.10139 -142.20252 569.34013
7490.0000 -146.06048 -142.02313 4.03735 2.10162 -142.19901 566.24964
7495.0000 -145.70628 -141.03831 4.66797 2.14078 -141.60557 563.43570
7500.0000 -147.14312 -142.87892 4.26420 2.12499 -141.84486 587.66086
FREEZING PROCESS: loop number 31 T-loop= 520.00000000000000
main_MD> interactions number 31 at Temperature= 520.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.93569 -1.98925 3.61725
force_rgl> df(natom) -1.94341 -0.80268 -2.05101
7505.0000 -146.31568 -141.86282 4.45286 2.09148 -142.35271 554.26027
7510.0000 -147.35111 -142.88357 4.46754 2.06428 -142.76491 560.93119
7515.0000 -146.76820 -142.57310 4.19510 2.09954 -142.23053 537.48641
7520.0000 -145.38985 -141.31446 4.07540 2.12153 -141.89733 556.34036
7525.0000 -146.81515 -143.03053 3.78462 2.08107 -142.51058 540.49946
7530.0000 -146.99180 -143.34229 3.64951 2.03198 -143.25451 509.35674
7535.0000 -147.23866 -142.91783 4.32083 2.06229 -142.79513 536.97560
7540.0000 -147.21530 -143.31187 3.90343 2.01996 -143.43671 505.70509
7545.0000 -147.65450 -143.67376 3.98074 2.03786 -143.16532 509.68372
7550.0000 -146.94944 -143.78272 3.16672 1.99179 -143.86364 505.99170
7555.0000 -147.88884 -144.36921 3.51962 1.99939 -143.74838 505.23139
7560.0000 -147.51106 -143.55726 3.95380 1.95942 -144.35417 473.94287
7565.0000 -146.45261 -141.67757 4.77504 2.06525 -142.75031 541.10751
7570.0000 -146.90285 -141.81689 5.08597 2.10326 -142.17424 573.13096
7575.0000 -146.51168 -142.55854 3.95314 2.06182 -142.80229 525.51301
7580.0000 -145.97506 -142.53749 3.43757 2.09321 -142.32654 550.08543
7585.0000 -146.82737 -143.44747 3.37991 2.04711 -143.02512 509.83424
7590.0000 -146.02860 -142.49376 3.53483 2.03273 -143.24316 491.93339
7595.0000 -146.54167 -142.85240 3.68927 2.08072 -142.51589 523.07812
7600.0000 -147.22988 -142.97190 4.25799 2.04895 -142.99726 509.36384
7605.0000 -146.72288 -143.16340 3.55948 2.05182 -142.95384 490.53041
7610.0000 -146.02789 -142.11018 3.91770 2.06479 -142.75718 491.23436
7615.0000 -146.55538 -142.25767 4.29771 2.08570 -142.44036 546.53758
7620.0000 -146.58732 -142.88082 3.70650 2.10314 -142.17608 555.74221
7625.0000 -146.32181 -142.74639 3.57542 2.05858 -142.85138 527.78269
7630.0000 -146.81621 -142.78558 4.03063 2.09955 -142.23048 545.23082
7635.0000 -145.96332 -142.31045 3.65287 2.07867 -142.54684 528.88307
7640.0000 -146.69028 -141.94511 4.74517 2.11060 -142.06293 557.03931
7645.0000 -146.59569 -142.05235 4.54334 2.10984 -142.07452 580.75665
7650.0000 -146.64847 -142.87258 3.77588 2.07955 -142.53356 554.49901
7655.0000 -147.38944 -143.12779 4.26165 2.06233 -142.79449 534.29479
7660.0000 -147.77102 -143.62982 4.14121 2.02673 -143.33405 491.44006
7665.0000 -147.06129 -142.73560 4.32569 2.03179 -143.25732 508.18578
7670.0000 -146.88410 -142.84004 4.04406 2.04305 -143.08677 505.25074
7675.0000 -147.76549 -143.66619 4.09931 2.02722 -143.32668 490.47889
7680.0000 -147.57840 -143.53495 4.04345 2.02263 -143.39615 505.92913
7685.0000 -146.94456 -143.03752 3.90705 2.02354 -143.38236 521.10836
7690.0000 -147.55929 -143.40874 4.15055 2.05539 -142.89968 558.20428
7695.0000 -147.70994 -143.36344 4.34650 2.03258 -143.24533 542.86115
7700.0000 -146.88036 -142.57214 4.30822 2.05098 -142.96659 555.12629
7705.0000 -146.50392 -143.37552 3.12840 2.07026 -142.67434 504.26286
7710.0000 -146.56568 -142.50811 4.05757 2.05050 -142.97386 491.04656
7715.0000 -146.05453 -142.18670 3.86783 2.09363 -142.32011 517.10019
7720.0000 -146.12530 -141.74899 4.37632 2.11229 -142.03734 526.78137
7725.0000 -146.96074 -143.09365 3.86709 2.07697 -142.57257 522.05990
7730.0000 -146.45662 -142.46484 3.99179 2.05098 -142.96653 501.78722
7735.0000 -146.42282 -141.45368 4.96914 2.09490 -142.30098 534.33412
7740.0000 -145.88754 -141.93355 3.95398 2.14362 -141.56250 574.74070
7745.0000 -146.96600 -142.38508 4.58092 2.08115 -142.50925 516.64566
7750.0000 -146.81757 -143.08835 3.72922 2.08512 -142.44914 530.59352
FREEZING PROCESS: loop number 32 T-loop= 495.00000000000000
main_MD> interactions number 32 at Temperature= 495.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.23246 -0.35662 0.20412
force_rgl> df(natom) -0.80258 0.18297 2.84319
7755.0000 -146.94174 -143.92843 3.01331 2.00982 -143.59037 462.25580
7760.0000 -146.96090 -143.84453 3.11637 1.97150 -144.17112 429.67549
7765.0000 -146.64984 -142.92813 3.72171 2.03406 -143.22302 483.35161
7770.0000 -147.12338 -142.83176 4.29161 2.04214 -143.10046 481.27061
7775.0000 -146.47496 -142.22009 4.25487 2.08816 -142.40306 528.18037
7780.0000 -146.62531 -142.69361 3.93170 2.06908 -142.69223 523.51670
7785.0000 -146.48700 -143.17269 3.31431 2.02716 -143.32760 489.21497
7790.0000 -146.45802 -143.07742 3.38059 2.03352 -143.23114 482.41966
7795.0000 -146.88968 -143.28847 3.60121 2.02635 -143.33982 477.27552
7800.0000 -146.73084 -143.81104 2.91980 1.99687 -143.78660 442.07985
7805.0000 -146.54444 -142.50573 4.03870 2.00930 -143.59818 460.45401
7810.0000 -146.88609 -142.83661 4.04948 2.05919 -142.84215 512.02393
7815.0000 -146.36110 -142.68440 3.67670 2.05754 -142.86714 543.06183
7820.0000 -147.83274 -143.22868 4.60405 2.09528 -142.29507 552.07206
7825.0000 -145.95059 -142.04670 3.90389 2.07093 -142.66419 531.03782
7830.0000 -147.27096 -142.99396 4.27699 2.04596 -143.04266 499.71373
7835.0000 -146.72559 -142.86934 3.85625 2.03365 -143.22912 475.97195
7840.0000 -146.97787 -143.32190 3.65598 2.05565 -142.89577 529.76538
7845.0000 -147.03540 -143.20046 3.83494 2.02084 -143.42329 495.96384
7850.0000 -147.35069 -143.57634 3.77434 2.00823 -143.61443 459.73848
7855.0000 -147.25696 -143.31600 3.94097 2.01644 -143.49000 499.23883
7860.0000 -147.53320 -143.86031 3.67289 1.99594 -143.80062 466.47115
7865.0000 -147.25565 -143.77808 3.47757 1.99661 -143.79060 482.55005
7870.0000 -147.59422 -143.69537 3.89885 1.98752 -143.92826 488.79443
7875.0000 -148.47967 -145.01143 3.46824 1.95720 -144.38779 461.03220
7880.0000 -147.31875 -144.00262 3.31612 1.95427 -144.43224 461.05895
7885.0000 -147.74561 -143.72612 4.01948 2.00890 -143.60430 485.35215
7890.0000 -147.49624 -143.81075 3.68550 2.02093 -143.42194 516.49195
7895.0000 -148.37482 -144.76668 3.60815 1.94399 -144.58797 447.87559
7900.0000 -147.57358 -143.35236 4.22122 1.98459 -143.97274 468.92509
7905.0000 -147.91198 -144.13980 3.77219 2.02969 -143.28916 529.01373
7910.0000 -147.89289 -144.49321 3.39968 1.97042 -144.18745 445.62165
7915.0000 -148.34898 -144.53089 3.81810 1.95631 -144.40131 438.38363
7920.0000 -146.78099 -143.09759 3.68341 1.99296 -143.84579 475.14984
7925.0000 -147.31996 -143.79403 3.52593 2.02441 -143.36919 504.93247
7930.0000 -146.85811 -142.86824 3.98986 2.02917 -143.29710 500.97952
7935.0000 -147.26160 -144.10124 3.16037 2.01791 -143.46780 488.18766
7940.0000 -146.70280 -142.57488 4.12792 2.03943 -143.14155 506.14865
7945.0000 -146.79745 -142.83288 3.96457 2.06701 -142.72366 517.85115
7950.0000 -147.50071 -143.12601 4.37470 2.02061 -143.42679 475.94877
7955.0000 -146.92901 -143.70191 3.22710 2.01741 -143.47526 485.50111
7960.0000 -148.14250 -145.24701 2.89549 1.96366 -144.28994 440.22822
7965.0000 -147.32404 -144.73999 2.58405 1.92620 -144.85758 431.49033
7970.0000 -147.64455 -144.48579 3.15876 1.93565 -144.71447 450.54562
7975.0000 -147.64682 -144.34898 3.29784 1.95426 -144.43237 473.98663
7980.0000 -148.40643 -144.74073 3.66569 1.96263 -144.30557 489.80592
7985.0000 -148.34441 -144.86121 3.48320 1.93464 -144.72975 463.38500
7990.0000 -148.09175 -144.69106 3.40069 1.93807 -144.67779 466.29002
7995.0000 -148.02807 -143.89797 4.13010 1.96863 -144.21454 483.36226
8000.0000 -147.29893 -143.27609 4.02284 2.00929 -143.59841 510.39548
FREEZING PROCESS: loop number 33 T-loop= 470.00000000000000
main_MD> interactions number 33 at Temperature= 470.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.54356 0.31191 0.13085
force_rgl> df(natom) 1.99432 1.71100 -1.80972
8005.0000 -147.59877 -144.06860 3.53017 2.01153 -143.56447 502.89863
8010.0000 -147.33942 -143.79255 3.54687 1.99849 -143.76206 494.65499
8015.0000 -147.74507 -143.77789 3.96718 1.98097 -144.02753 483.23098
8020.0000 -147.17031 -143.36786 3.80245 2.00266 -143.69889 480.31375
8025.0000 -148.25180 -145.21716 3.03464 1.94076 -144.63693 465.99943
8030.0000 -148.04459 -144.67513 3.36947 1.92732 -144.84058 419.08833
8035.0000 -148.45069 -144.91306 3.53762 1.93518 -144.72147 454.53943
8040.0000 -148.09413 -144.67695 3.41718 1.93185 -144.77202 466.50504
8045.0000 -148.62602 -145.52491 3.10111 1.91002 -145.10282 441.25376
8050.0000 -149.30764 -145.84481 3.46284 1.85820 -145.88815 402.10697
8055.0000 -148.83131 -145.15501 3.67630 1.91603 -145.01177 460.55713
8060.0000 -148.63360 -145.27925 3.35435 1.90948 -145.11107 473.92808
8065.0000 -148.85976 -145.33289 3.52687 1.90515 -145.17658 455.68680
8070.0000 -148.92321 -145.49987 3.42334 1.89162 -145.38166 428.04904
8075.0000 -149.21757 -145.85144 3.36613 1.86161 -145.83652 413.52718
8080.0000 -148.71974 -145.66319 3.05654 1.87655 -145.61006 434.58908
8085.0000 -148.10228 -145.07710 3.02518 1.85402 -145.95150 407.16917
8090.0000 -148.68440 -145.43984 3.24456 1.91175 -145.07662 442.23800
8095.0000 -148.65679 -145.62789 3.02889 1.85549 -145.92931 398.78519
8100.0000 -148.29431 -144.55665 3.73766 1.92646 -144.85364 456.31728
8105.0000 -148.83009 -145.40274 3.42735 1.91675 -145.00086 452.36899
8110.0000 -148.73930 -144.73933 3.99996 1.92569 -144.86533 441.98091
8115.0000 -149.09917 -145.39005 3.70912 1.91457 -145.03396 457.22379
8120.0000 -148.52045 -145.05972 3.46073 1.91594 -145.01311 471.28185
8125.0000 -148.51794 -144.44440 4.07354 1.91391 -145.04387 464.54359
8130.0000 -148.87546 -145.81606 3.05940 1.91360 -145.04861 475.75849
8135.0000 -149.08927 -146.16962 2.91965 1.88555 -145.47372 450.59241
8140.0000 -148.69554 -145.45308 3.24246 1.86230 -145.82606 429.09197
8145.0000 -148.36650 -144.43382 3.93267 1.88549 -145.47466 455.60803
8150.0000 -148.86263 -145.07686 3.78577 1.93737 -144.68839 492.63715
8155.0000 -149.07232 -145.48459 3.58773 1.89899 -145.27001 460.13541
8160.0000 -148.79663 -146.20953 2.58710 1.87492 -145.63478 440.17275
8165.0000 -149.57571 -146.07778 3.49792 1.83724 -146.20593 403.72179
8170.0000 -148.99662 -146.20635 2.79027 1.87541 -145.62744 437.66409
8175.0000 -148.85522 -145.43379 3.42143 1.86183 -145.83319 425.44462
8180.0000 -148.36748 -144.59421 3.77327 1.91233 -145.06784 468.60063
8185.0000 -148.94513 -145.27630 3.66883 1.91567 -145.01719 477.24104
8190.0000 -148.43285 -144.85654 3.57631 1.90914 -145.11623 469.92949
8195.0000 -149.14711 -145.08466 4.06245 1.90513 -145.17702 462.81120
8200.0000 -148.13046 -144.41274 3.71773 1.91544 -145.02071 474.19284
8205.0000 -148.91563 -145.11484 3.80079 1.92772 -144.83452 476.76412
8210.0000 -148.65693 -145.33086 3.32607 1.90832 -145.12864 457.39242
8215.0000 -148.95011 -145.17950 3.77061 1.90702 -145.14825 465.46447
8220.0000 -148.74115 -144.80262 3.93853 1.92867 -144.82012 488.97351
8225.0000 -148.80385 -144.49757 4.30628 1.93627 -144.70501 491.29286
8230.0000 -148.49974 -144.38535 4.11438 1.96668 -144.24410 520.43958
8235.0000 -148.81616 -145.53512 3.28104 1.94750 -144.53478 507.34180
8240.0000 -149.15212 -144.86860 4.28352 1.88224 -145.52382 450.11646
8245.0000 -148.85772 -144.64299 4.21474 1.90436 -145.18864 461.41602
8250.0000 -148.91980 -144.95451 3.96529 1.92167 -144.92624 485.48557
FREEZING PROCESS: loop number 34 T-loop= 445.00000000000000
main_MD> interactions number 34 at Temperature= 445.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.42333 0.07541 1.20957
force_rgl> df(natom) 3.06166 -1.58810 3.96926
8255.0000 -148.84071 -145.17785 3.66286 1.91886 -144.96882 474.32573
8260.0000 -149.12174 -145.79311 3.32864 1.87721 -145.60007 446.60364
8265.0000 -149.17232 -145.56482 3.60750 1.88392 -145.49837 445.94081
8270.0000 -148.85289 -145.78058 3.07231 1.86583 -145.77254 432.12620
8275.0000 -149.53685 -145.91394 3.62291 1.87796 -145.58870 439.70659
8280.0000 -149.55735 -146.48413 3.07322 1.83260 -146.27617 402.07302
8285.0000 -148.70537 -145.76019 2.94519 1.83869 -146.18392 410.36807
8290.0000 -149.12759 -146.06544 3.06214 1.84809 -146.04135 412.66785
8295.0000 -148.32711 -144.74341 3.58370 1.88356 -145.50391 444.20563
8300.0000 -148.24286 -144.75029 3.49257 1.92686 -144.84766 484.34263
8305.0000 -148.54185 -144.99859 3.54327 1.92600 -144.86062 474.64123
8310.0000 -147.30998 -143.82723 3.48275 1.93846 -144.67175 480.42343
8315.0000 -149.06227 -145.46211 3.60015 1.94297 -144.60342 474.20359
8320.0000 -148.93316 -145.91477 3.01838 1.86790 -145.74117 432.29081
8325.0000 -149.85405 -146.42789 3.42616 1.84653 -146.06507 416.28308
8330.0000 -149.27198 -146.35937 2.91261 1.83490 -146.24134 402.63523
8335.0000 -148.96476 -145.69958 3.26518 1.87296 -145.66450 431.29931
8340.0000 -149.03565 -145.86446 3.17118 1.85707 -145.90532 422.70137
8345.0000 -148.52469 -145.08841 3.43628 1.87956 -145.56454 433.72012
8350.0000 -148.33061 -144.34684 3.98377 1.92833 -144.82535 478.27929
8355.0000 -148.67904 -145.19745 3.48159 1.93135 -144.77950 481.64705
8360.0000 -148.83950 -145.05061 3.78889 1.88956 -145.41286 446.21871
8365.0000 -148.97618 -146.03580 2.94038 1.86999 -145.70951 435.63143
8370.0000 -148.81762 -145.44609 3.37153 1.85956 -145.86759 424.69527
8375.0000 -148.88993 -145.29746 3.59248 1.88210 -145.52597 439.25990
8380.0000 -148.94047 -145.46334 3.47713 1.88775 -145.44036 448.74532
8385.0000 -148.67239 -145.27294 3.39944 1.87446 -145.64177 439.71248
8390.0000 -148.83221 -145.75348 3.07873 1.87450 -145.64117 442.07980
8395.0000 -148.94161 -145.04091 3.90070 1.88257 -145.51879 441.90354
8400.0000 -149.40519 -145.78063 3.62456 1.87739 -145.59729 438.73122
8405.0000 -148.79808 -145.79079 3.00729 1.85927 -145.87191 421.31210
8410.0000 -148.36162 -145.05936 3.30226 1.88430 -145.49260 428.27534
8415.0000 -148.61758 -144.47009 4.14749 1.91606 -145.01123 450.18872
8420.0000 -149.25393 -145.70644 3.54749 1.91488 -145.02916 450.06181
8425.0000 -148.76865 -145.77565 2.99300 1.87092 -145.69538 413.79774
8430.0000 -148.99918 -145.62096 3.37822 1.87778 -145.59139 421.61921
8435.0000 -147.94520 -144.86084 3.08436 1.91188 -145.07465 419.66911
8440.0000 -148.22920 -144.33638 3.89281 1.93476 -144.72783 460.81487
8445.0000 -148.29858 -145.28941 3.00916 1.94403 -144.58745 470.02987
8450.0000 -149.54458 -145.48995 4.05463 1.86697 -145.75527 419.74477
8455.0000 -148.56376 -145.74439 2.81937 1.87706 -145.60237 438.66529
8460.0000 -148.55349 -144.99974 3.55375 1.91117 -145.08549 472.48355
8465.0000 -148.93210 -146.11145 2.82065 1.89043 -145.39980 449.30792
8470.0000 -148.82120 -144.87294 3.94826 1.87484 -145.63600 416.87418
8475.0000 -149.09375 -146.41305 2.68070 1.84239 -146.12784 408.73728
8480.0000 -149.05713 -145.94880 3.10833 1.82764 -146.35130 394.75479
8485.0000 -149.00609 -145.49415 3.51194 1.86190 -145.83216 430.22588
8490.0000 -148.75616 -145.65146 3.10470 1.88939 -145.41550 443.68457
8495.0000 -148.61724 -145.51311 3.10413 1.88458 -145.48842 419.31186
8500.0000 -148.67631 -145.65828 3.01803 1.89012 -145.40447 411.64593
FREEZING PROCESS: loop number 35 T-loop= 420.00000000000000
main_MD> interactions number 35 at Temperature= 420.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.96925 3.09371 0.46156
force_rgl> df(natom) 1.00739 1.95419 1.12502
8505.0000 -149.33220 -145.86393 3.46827 1.85965 -145.86621 418.48992
8510.0000 -149.25069 -145.55976 3.69092 1.87457 -145.64006 435.38318
8515.0000 -149.69324 -146.44736 3.24588 1.84660 -146.06397 414.13745
8520.0000 -148.72611 -145.67983 3.04628 1.85892 -145.87734 432.82487
8525.0000 -149.54964 -146.50708 3.04255 1.87219 -145.67619 442.96310
8530.0000 -149.37619 -145.67501 3.70117 1.85108 -145.99615 419.98421
8535.0000 -149.52598 -145.81169 3.71429 1.86085 -145.84798 423.45383
8540.0000 -149.13559 -146.04452 3.09108 1.89919 -145.26690 452.70719
8545.0000 -148.71634 -145.85657 2.85977 1.86427 -145.79626 417.11117
8550.0000 -148.43399 -145.39257 3.04141 1.86944 -145.71785 400.35016
8555.0000 -149.08205 -145.16686 3.91519 1.91605 -145.01147 472.13697
8560.0000 -148.66716 -145.92513 2.74203 1.87627 -145.61438 437.20085
8565.0000 -148.89553 -146.10763 2.78790 1.84575 -146.07691 396.88198
8570.0000 -149.18380 -145.53085 3.65295 1.87310 -145.66241 414.08436
8575.0000 -149.15054 -146.48469 2.66585 1.87407 -145.64773 407.74695
8580.0000 -149.19161 -145.28006 3.91156 1.83957 -146.17059 387.19668
8585.0000 -148.25330 -144.24868 4.00462 1.93970 -144.65302 490.61230
8590.0000 -148.76363 -145.18279 3.58084 1.92519 -144.87297 479.32052
8595.0000 -148.63515 -145.07484 3.56031 1.91909 -144.96537 470.21497
8600.0000 -149.05750 -145.50358 3.55392 1.87481 -145.63648 436.30862
8605.0000 -148.83490 -145.07486 3.76005 1.89294 -145.36170 451.92781
8610.0000 -148.83858 -145.30933 3.52924 1.92183 -144.92380 470.42274
8615.0000 -149.38212 -145.81180 3.57032 1.89624 -145.31170 454.16222
8620.0000 -149.30692 -146.55391 2.75301 1.83508 -146.23860 401.13241
8625.0000 -148.85065 -145.98946 2.86119 1.81862 -146.48812 382.86245
8630.0000 -148.79602 -145.18911 3.60690 1.90612 -145.16202 472.83629
8635.0000 -149.12297 -145.76508 3.35789 1.86736 -145.74942 430.46086
8640.0000 -149.41717 -146.06476 3.35242 1.85731 -145.90162 422.97591
8645.0000 -149.11212 -145.42200 3.69012 1.87832 -145.58328 441.20012
8650.0000 -149.24291 -145.33338 3.90953 1.87058 -145.70058 432.53190
8655.0000 -149.07486 -145.66001 3.41485 1.88673 -145.45582 452.32723
8660.0000 -148.74608 -145.77071 2.97537 1.85377 -145.95533 422.87900
8665.0000 -149.05933 -145.40944 3.64989 1.85934 -145.87095 422.90326
8670.0000 -148.78931 -145.75202 3.03730 1.88458 -145.48842 454.94300
8675.0000 -149.10597 -145.36212 3.74384 1.87739 -145.59738 433.48576
8680.0000 -148.23586 -144.67122 3.56464 1.90809 -145.13205 434.02536
8685.0000 -148.25874 -144.50888 3.74987 1.92415 -144.88874 449.27113
8690.0000 -149.10459 -145.76787 3.33672 1.90875 -145.12206 451.72965
8695.0000 -149.03290 -145.79067 3.24223 1.88408 -145.49602 429.47594
8700.0000 -149.49284 -145.94171 3.55113 1.87828 -145.58392 438.45195
8705.0000 -148.67148 -145.35140 3.32008 1.87430 -145.64415 448.07396
8710.0000 -148.74014 -146.20550 2.53464 1.87475 -145.63739 441.40763
8715.0000 -149.76114 -146.13656 3.62458 1.83586 -146.22679 407.42924
8720.0000 -149.22177 -146.29368 2.92810 1.84644 -146.06639 413.19738
8725.0000 -149.29803 -145.86167 3.43637 1.85953 -145.86801 409.25513
8730.0000 -149.20284 -146.49588 2.70696 1.84254 -146.12548 406.34989
8735.0000 -149.07787 -145.98271 3.09516 1.83818 -146.19163 405.08790
8740.0000 -149.45163 -146.33841 3.11322 1.84837 -146.03722 417.85174
8745.0000 -149.60477 -146.42999 3.17478 1.82969 -146.32027 395.56850
8750.0000 -148.28470 -145.03777 3.24692 1.87126 -145.69032 435.24810
FREEZING PROCESS: loop number 36 T-loop= 395.00000000000000
main_MD> interactions number 36 at Temperature= 395.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.45121 -0.75570 1.25811
force_rgl> df(natom) -1.30004 -1.89273 -3.98297
8755.0000 -149.23386 -146.10661 3.12725 1.86063 -145.85131 424.10158
8760.0000 -148.99916 -146.85465 2.14451 1.83118 -146.29777 396.91486
8765.0000 -149.32540 -146.14597 3.17943 1.80568 -146.68419 379.86347
8770.0000 -149.03167 -146.11041 2.92127 1.82936 -146.32529 398.46866
8775.0000 -148.90070 -145.58318 3.31752 1.84704 -146.05733 411.67268
8780.0000 -149.11860 -145.90141 3.21719 1.84792 -146.04404 419.09358
8785.0000 -149.47526 -146.16293 3.31234 1.84424 -146.09982 408.91893
8790.0000 -149.55636 -146.70897 2.84739 1.82240 -146.43079 388.14733
8795.0000 -149.41269 -146.14402 3.26867 1.81877 -146.48572 389.50877
8800.0000 -149.21050 -146.21358 2.99692 1.84730 -146.05337 414.26157
8805.0000 -149.20887 -146.27627 2.93260 1.82660 -146.36717 399.32374
8810.0000 -149.14784 -146.27406 2.87379 1.82195 -146.43759 391.77722
8815.0000 -149.48583 -146.92862 2.55721 1.83002 -146.31535 391.91261
8820.0000 -148.98434 -146.34230 2.64204 1.83197 -146.28576 399.64467
8825.0000 -148.97988 -146.12096 2.85892 1.84446 -146.09648 407.45108
8830.0000 -149.56971 -146.33630 3.23341 1.83844 -146.18770 411.37049
8835.0000 -149.50451 -146.66094 2.84358 1.80041 -146.76405 369.80213
8840.0000 -149.03073 -145.66886 3.36187 1.84092 -146.15016 405.30038
8845.0000 -149.13317 -145.96052 3.17265 1.86179 -145.83386 431.63116
8850.0000 -149.78070 -146.46306 3.31764 1.83583 -146.22725 405.07569
8855.0000 -149.01423 -145.88380 3.13043 1.83134 -146.29522 399.07783
8860.0000 -149.67122 -146.57285 3.09837 1.82158 -146.44317 388.45312
8865.0000 -149.21310 -146.96671 2.24639 1.80611 -146.67770 373.65756
8870.0000 -149.55115 -146.86514 2.68601 1.79661 -146.82156 369.94291
8875.0000 -148.81746 -145.97097 2.84649 1.83602 -146.22431 405.45585
8880.0000 -149.13707 -146.10604 3.03103 1.85044 -146.00576 408.37133
8885.0000 -149.43492 -146.16291 3.27201 1.84394 -146.10424 408.54424
8890.0000 -149.39230 -146.70777 2.68454 1.81530 -146.53833 381.18274
8895.0000 -148.89135 -146.00145 2.88990 1.85918 -145.87327 420.15111
8900.0000 -149.41233 -146.59973 2.81260 1.83713 -146.20749 403.19349
8905.0000 -149.91339 -146.59468 3.31872 1.80324 -146.72109 371.10837
8910.0000 -149.43995 -146.87835 2.56160 1.79739 -146.80978 372.70441
8915.0000 -149.84504 -146.86937 2.97567 1.77686 -147.12100 350.37562
8920.0000 -149.58184 -146.87630 2.70554 1.80809 -146.64766 380.58532
8925.0000 -149.89686 -147.06278 2.83408 1.78949 -146.92958 363.60036
8930.0000 -149.62516 -146.56180 3.06336 1.80494 -146.69530 375.42967
8935.0000 -149.57118 -146.61799 2.95319 1.81327 -146.56917 381.59182
8940.0000 -149.37685 -146.26231 3.11454 1.81831 -146.49277 389.36237
8945.0000 -148.94566 -145.77338 3.17228 1.82903 -146.33029 391.85718
8950.0000 -149.79870 -146.44427 3.35443 1.83193 -146.28637 397.13146
8955.0000 -149.57411 -146.50012 3.07398 1.81570 -146.53230 387.69373
8960.0000 -149.36649 -146.26881 3.09767 1.81407 -146.55703 385.03379
8965.0000 -149.42883 -146.17725 3.25159 1.84188 -146.13551 410.50569
8970.0000 -149.37614 -146.65640 2.71975 1.80973 -146.62270 388.75543
8975.0000 -149.77636 -146.74148 3.03488 1.81535 -146.53757 374.07138
8980.0000 -149.31569 -145.99153 3.32416 1.86613 -145.76801 413.30926
8985.0000 -148.98702 -146.40920 2.57782 1.84434 -146.09828 399.75422
8990.0000 -148.70368 -145.64113 3.06255 1.85447 -145.94466 392.38939
8995.0000 -148.69581 -145.73950 2.95632 1.86107 -145.84464 402.46519
9000.0000 -149.25452 -146.05090 3.20362 1.87938 -145.56721 432.03612
FREEZING PROCESS: loop number 37 T-loop= 370.00000000000000
main_MD> interactions number 37 at Temperature= 370.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.24952 -0.15140 1.16719
force_rgl> df(natom) 1.26460 1.49866 -1.06823
9005.0000 -149.79232 -147.00732 2.78500 1.79849 -146.79309 367.99126
9010.0000 -149.64875 -147.14993 2.49882 1.77991 -147.07465 348.29892
9015.0000 -149.55967 -146.37178 3.18790 1.80914 -146.63168 375.93959
9020.0000 -149.89109 -146.97083 2.92026 1.80343 -146.71827 371.66678
9025.0000 -149.74846 -146.83965 2.90880 1.77611 -147.13234 348.66060
9030.0000 -149.83081 -147.09807 2.73274 1.79423 -146.85772 364.58129
9035.0000 -149.96085 -147.45550 2.50535 1.75846 -147.39978 332.58557
9040.0000 -149.78890 -146.81513 2.97377 1.77529 -147.14471 348.98401
9045.0000 -149.86967 -146.79968 3.06999 1.80764 -146.65441 376.27710
9050.0000 -149.77599 -146.96411 2.81188 1.80152 -146.74726 373.87152
9055.0000 -149.80575 -147.14375 2.66200 1.79001 -146.92162 357.33809
9060.0000 -149.30921 -146.99002 2.31919 1.78419 -147.00985 356.52720
9065.0000 -149.87672 -147.61038 2.26634 1.75610 -147.43551 330.18561
9070.0000 -150.05698 -147.10278 2.95420 1.76650 -147.27802 341.53667
9075.0000 -149.37746 -146.78214 2.59533 1.78753 -146.95930 358.00890
9080.0000 -149.41700 -146.03681 3.38019 1.82163 -146.44243 391.79417
9085.0000 -149.59639 -146.97004 2.62635 1.81231 -146.58365 381.60021
9090.0000 -149.49392 -146.76101 2.73291 1.80833 -146.64397 382.37227
9095.0000 -149.72517 -146.42646 3.29871 1.82251 -146.42915 389.49708
9100.0000 -149.17354 -146.52890 2.64465 1.81155 -146.59519 380.04107
9105.0000 -149.11464 -146.25530 2.85934 1.81417 -146.55550 387.72431
9110.0000 -149.69103 -147.16069 2.53034 1.80733 -146.65920 374.68098
9115.0000 -149.36393 -146.36828 2.99565 1.78407 -147.01171 359.29740
9120.0000 -149.30268 -146.53995 2.76273 1.81442 -146.55166 383.51013
9125.0000 -149.74935 -147.18996 2.55939 1.78219 -147.04015 354.50657
9130.0000 -149.28814 -146.72182 2.56632 1.77092 -147.21102 345.74461
9135.0000 -149.82934 -146.78324 3.04611 1.77797 -147.10411 350.42694
9140.0000 -149.60548 -145.99574 3.60974 1.84036 -146.15863 405.09315
9145.0000 -150.12495 -147.42661 2.69833 1.78097 -147.05870 352.50566
9150.0000 -149.32592 -146.86876 2.45715 1.78854 -146.94392 361.14817
9155.0000 -150.07809 -147.68987 2.38822 1.77594 -147.13483 345.64253
9160.0000 -149.63125 -147.30188 2.32936 1.76480 -147.30365 341.18878
9165.0000 -149.67580 -146.94471 2.73109 1.78772 -146.95633 355.94568
9170.0000 -149.53705 -146.24015 3.29690 1.81297 -146.57363 383.97903
9175.0000 -149.58040 -145.71283 3.86757 1.83146 -146.29348 399.10184
9180.0000 -149.47326 -146.67927 2.79400 1.85377 -145.95534 417.42103
9185.0000 -149.59554 -146.42905 3.16649 1.82295 -146.42237 390.99847
9190.0000 -150.30888 -147.49939 2.80949 1.79213 -146.88947 361.09718
9195.0000 -149.30204 -146.19591 3.10614 1.79961 -146.77611 371.10452
9200.0000 -149.53299 -146.59807 2.93492 1.81757 -146.50397 387.95342
9205.0000 -149.62390 -146.36799 3.25591 1.80800 -146.64896 379.71448
9210.0000 -149.21508 -146.63111 2.58397 1.83857 -146.18574 408.13868
9215.0000 -149.93423 -146.88307 3.05116 1.80870 -146.63844 375.45313
9220.0000 -149.64222 -145.94141 3.70081 1.79155 -146.89832 362.00146
9225.0000 -149.66445 -146.44669 3.21775 1.83545 -146.23304 401.28755
9230.0000 -149.42816 -147.00411 2.42405 1.82354 -146.41352 389.89808
9235.0000 -149.65466 -146.84845 2.80621 1.79515 -146.84368 367.25733
9240.0000 -150.02460 -146.94264 3.08196 1.79404 -146.86064 368.03282
9245.0000 -149.75995 -147.74484 2.01511 1.75784 -147.40913 329.93000
9250.0000 -150.08437 -147.29966 2.78471 1.74096 -147.66509 313.61120
FREEZING PROCESS: loop number 38 T-loop= 345.00000000000000
main_MD> interactions number 38 at Temperature= 345.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.07999 -2.75212 1.11730
force_rgl> df(natom) 0.77539 0.01309 -0.71585
9255.0000 -149.47289 -146.94347 2.52943 1.76235 -147.34077 337.35549
9260.0000 -149.91135 -146.90862 3.00273 1.77953 -147.08050 353.75623
9265.0000 -149.56780 -147.02090 2.54690 1.79257 -146.88281 361.12250
9270.0000 -149.92369 -147.35892 2.56477 1.77086 -147.21182 345.94757
9275.0000 -149.49182 -147.22155 2.27027 1.76461 -147.30658 338.30834
9280.0000 -149.90414 -147.23656 2.66759 1.77487 -147.15117 350.77025
9285.0000 -149.90665 -147.46178 2.44487 1.75450 -147.45988 327.49275
9290.0000 -150.15707 -147.48016 2.67691 1.74677 -147.57699 319.37251
9295.0000 -149.98488 -147.20688 2.77800 1.77648 -147.12668 345.82860
9300.0000 -150.25448 -147.90331 2.35117 1.75256 -147.48926 326.27976
9305.0000 -149.66936 -146.91822 2.75114 1.76022 -147.37313 335.99571
9310.0000 -149.31012 -146.67366 2.63646 1.78082 -147.06093 352.72204
9315.0000 -149.86179 -147.27074 2.59105 1.78888 -146.93875 358.17011
9320.0000 -149.88958 -147.51763 2.37194 1.76026 -147.37253 332.26234
9325.0000 -149.87559 -147.31774 2.55785 1.76606 -147.28461 336.05009
9330.0000 -149.75831 -146.92629 2.83202 1.76799 -147.25535 339.48454
9335.0000 -149.62177 -145.83107 3.79070 1.80851 -146.64120 377.83959
9340.0000 -148.95506 -146.79412 2.16093 1.83476 -146.24343 387.72923
9345.0000 -149.86001 -147.19234 2.66767 1.80266 -146.72998 369.88903
9350.0000 -149.72750 -147.06826 2.65924 1.76673 -147.27439 342.01782
9355.0000 -149.78346 -146.89426 2.88920 1.76625 -147.28170 339.29189
9360.0000 -149.48204 -147.13639 2.34566 1.75413 -147.46537 329.85090
9365.0000 -150.06715 -147.55526 2.51189 1.75534 -147.44712 329.58365
9370.0000 -149.95168 -147.31985 2.63183 1.75676 -147.42562 331.07514
9375.0000 -150.03574 -146.89483 3.14091 1.77497 -147.14964 348.67680
9380.0000 -149.82873 -147.52685 2.30188 1.76374 -147.31985 335.47391
9385.0000 -150.07511 -147.86240 2.21270 1.73682 -147.72783 313.26286
9390.0000 -149.83117 -146.81698 3.01418 1.76120 -147.35835 337.66537
9395.0000 -149.70223 -147.40684 2.29539 1.77490 -147.15062 351.59886
9400.0000 -149.83601 -147.27941 2.55660 1.74776 -147.56197 323.55991
9405.0000 -149.37234 -146.85038 2.52196 1.79506 -146.84516 362.67831
9410.0000 -149.89907 -147.24931 2.64975 1.77610 -147.13246 346.26061
9415.0000 -150.62458 -148.24462 2.37996 1.74390 -147.62045 317.73439
9420.0000 -149.93619 -147.36261 2.57357 1.73403 -147.77000 311.04325
9425.0000 -150.52546 -148.40980 2.11567 1.75520 -147.44919 331.01693
9430.0000 -150.11227 -147.33601 2.77626 1.73334 -147.78044 311.48455
9435.0000 -150.32404 -147.46089 2.86315 1.76137 -147.35572 336.24869
9440.0000 -149.78584 -147.18310 2.60274 1.77203 -147.19419 347.69757
9445.0000 -150.13211 -147.59523 2.53687 1.73302 -147.78533 311.26201
9450.0000 -150.03527 -147.06760 2.96767 1.77207 -147.19350 347.23817
9455.0000 -149.70545 -146.62482 3.08064 1.80461 -146.70038 375.27433
9460.0000 -149.29598 -146.35017 2.94581 1.81649 -146.52031 384.74940
9465.0000 -149.54687 -146.49284 3.05403 1.82890 -146.33220 394.16203
9470.0000 -149.87239 -147.08398 2.78841 1.79889 -146.78710 368.39013
9475.0000 -150.18719 -147.13495 3.05223 1.78666 -146.97241 354.62776
9480.0000 -150.20504 -147.32250 2.88254 1.78629 -146.97805 354.94817
9485.0000 -150.28065 -147.68653 2.59411 1.75220 -147.49474 327.23667
9490.0000 -150.24485 -147.67169 2.57316 1.74694 -147.57442 319.32159
9495.0000 -150.37946 -147.80884 2.57062 1.73062 -147.82169 308.16178
9500.0000 -149.58354 -147.27848 2.30506 1.75616 -147.43472 330.51111
FREEZING PROCESS: loop number 39 T-loop= 320.00000000000000
main_MD> interactions number 39 at Temperature= 320.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.70667 1.50346 1.78757
force_rgl> df(natom) 1.56275 1.36304 -1.02642
9505.0000 -149.93567 -147.66448 2.27119 1.76306 -147.33003 334.08081
9510.0000 -150.25862 -147.79396 2.46466 1.73635 -147.73492 313.69284
9515.0000 -150.04881 -147.51291 2.53589 1.72215 -147.95013 302.46645
9520.0000 -150.02614 -147.68555 2.34060 1.75218 -147.49494 325.66345
9525.0000 -149.94026 -147.33502 2.60524 1.74918 -147.54049 319.18346
9530.0000 -149.42248 -147.42525 1.99722 1.75493 -147.45326 326.74805
9535.0000 -149.79802 -147.52457 2.27344 1.75962 -147.38225 330.10688
9540.0000 -149.83935 -147.73489 2.10447 1.73192 -147.80198 304.52274
9545.0000 -149.89861 -147.57849 2.32012 1.73310 -147.78411 305.48880
9550.0000 -150.16167 -148.05067 2.11100 1.74952 -147.53525 322.42998
9555.0000 -150.52709 -148.20085 2.32624 1.71139 -148.11314 289.90094
9560.0000 -150.27257 -147.62264 2.64993 1.72402 -147.92171 305.22154
9565.0000 -150.44868 -148.10551 2.34317 1.71999 -147.98284 296.10883
9570.0000 -149.60515 -146.80423 2.80092 1.76868 -147.24494 342.87034
9575.0000 -150.49983 -148.25095 2.24888 1.74257 -147.64068 318.16230
9580.0000 -150.54577 -148.29486 2.25091 1.69971 -148.29014 280.80469
9585.0000 -150.57942 -147.71043 2.86900 1.73647 -147.73314 312.42383
9590.0000 -150.05609 -147.47749 2.57860 1.74785 -147.56067 323.14924
9595.0000 -149.76057 -147.43538 2.32519 1.75523 -147.44877 325.64939
9600.0000 -149.84344 -146.96953 2.87391 1.76783 -147.25783 345.11940
9605.0000 -150.16887 -147.75512 2.41375 1.77670 -147.12339 350.00784
9610.0000 -150.44390 -148.01112 2.43278 1.71306 -148.08789 291.04251
9615.0000 -150.28608 -147.72551 2.56057 1.71634 -148.03812 293.56723
9620.0000 -150.22698 -147.88504 2.34194 1.70938 -148.14360 283.04951
9625.0000 -149.93414 -147.51900 2.41515 1.73821 -147.70674 311.37172
9630.0000 -149.56293 -147.06423 2.49871 1.76610 -147.28399 335.71335
9635.0000 -150.15619 -147.82714 2.32905 1.74644 -147.58203 318.45357
9640.0000 -149.87937 -147.12838 2.75099 1.76311 -147.32929 334.00108
9645.0000 -150.29580 -147.75780 2.53800 1.74140 -147.65828 319.38656
9650.0000 -149.73232 -147.42887 2.30345 1.74009 -147.67828 316.60579
9655.0000 -150.13672 -147.74718 2.38953 1.75543 -147.44572 329.63306
9660.0000 -150.23761 -147.85659 2.38102 1.75139 -147.50699 326.71808
9665.0000 -150.20422 -147.86581 2.33842 1.73362 -147.77630 310.34660
9670.0000 -149.84219 -147.28661 2.55558 1.72724 -147.87296 303.43511
9675.0000 -150.17943 -148.22180 1.95764 1.73911 -147.69301 315.59839
9680.0000 -150.16881 -147.49896 2.66985 1.72940 -147.84021 307.14165
9685.0000 -149.66767 -147.28827 2.37940 1.76868 -147.24496 343.77943
9690.0000 -150.42109 -147.38528 3.03581 1.74732 -147.56862 320.01710
9695.0000 -150.19870 -147.52228 2.67642 1.76040 -147.37041 333.93807
9700.0000 -149.91497 -147.53665 2.37832 1.74991 -147.52930 323.46821
9705.0000 -150.35156 -147.75447 2.59709 1.74598 -147.58890 322.06556
9710.0000 -149.83778 -147.53757 2.30021 1.75196 -147.49826 327.39122
9715.0000 -150.07300 -147.83919 2.23381 1.73573 -147.74435 314.85802
9720.0000 -149.80400 -147.62821 2.17579 1.72916 -147.84381 303.47265
9725.0000 -149.85330 -147.40186 2.45144 1.76031 -147.37174 332.97801
9730.0000 -150.19222 -147.68160 2.51062 1.75505 -147.45150 334.52779
9735.0000 -150.42520 -148.04437 2.38083 1.72288 -147.93903 299.70890
9740.0000 -149.67807 -147.17406 2.50402 1.73839 -147.70393 312.46762
9745.0000 -149.78317 -147.67780 2.10537 1.74225 -147.64550 316.49502
9750.0000 -150.00623 -147.73948 2.26675 1.73096 -147.81665 303.53457
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 13 [min], 38.8517298 [s].
main_MD> Deallocating global variables
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