108 Lattice="7.929290282387358 0.0 0.0 0.0 7.929290282387358 0.0 0.0 0.0 7.929290282387358" Properties=species:S:1:pos:R:3:forces:R:3 energy=1.048653755625112 stress="-0.004311214528706774 -1.3232285264494342e-06 1.0828628469292995e-05 -1.3232285264494342e-06 -0.004300302192711023 1.2255412648758505e-05 1.0828628469292995e-05 1.2255412648758505e-05 -0.004310822113431588" free_energy=1.048653755625112 pbc="F F F" Ar 0.03012336 0.03223660 0.01301814 -0.01226047 -0.01246848 -0.01273553 Ar 1.29594423 1.35640900 0.02662962 0.00232527 -0.00272236 -0.02322385 Ar 1.32039200 0.01110615 1.28185224 0.00266438 -0.02123784 0.00181279 Ar 0.05077658 1.31415940 1.27703993 -0.02338255 0.00054899 0.00347321 Ar 2.60989073 0.03647573 0.02767285 0.00095962 -0.01513492 -0.01503110 Ar 3.97688904 1.28129125 0.01007761 -0.00226560 0.00169686 -0.02335532 Ar 4.05997329 0.04189632 1.27686737 -0.00587422 -0.02422927 0.00288736 Ar 2.72307661 1.38274887 1.38678009 -0.00411832 -0.00466313 -0.00107127 Ar 5.25047645 0.04856029 0.00766656 0.00386397 -0.01638398 -0.01863513 Ar 6.64784940 1.30680865 0.02573201 0.01402519 0.00203682 -0.01530620 Ar 6.62529566 0.01457932 1.23508739 0.01494008 -0.01649126 0.00230344 Ar 5.24245899 1.27850262 1.41324832 0.00585771 0.00283721 -0.00328222 Ar 0.00211584 2.62264154 0.04146330 -0.01726768 0.00247456 -0.01656451 Ar 1.35629901 3.95450164 0.01980402 -0.00266159 -0.00040816 -0.02189324 Ar 1.37101687 2.60805011 1.27276491 -0.00279173 0.00354955 0.00561462 Ar 0.01043104 4.00617989 1.28379161 -0.01890250 -0.00179186 0.00123569 Ar 2.59454469 2.61663150 0.04558482 0.00339244 -0.00028450 -0.02273644 Ar 3.92526930 3.88857703 0.00690743 -0.00099215 0.00167324 -0.02218035 Ar 4.00168993 2.59690888 1.27391845 -0.00169543 0.00436628 0.00266834 Ar 2.64798227 4.02726767 1.30919250 0.00083725 -0.00420662 0.00295915 Ar 5.25409307 2.62276959 0.01387283 0.00418777 -0.00146231 -0.02129953 Ar 6.64978743 3.91243279 0.02617491 0.01523307 0.00119617 -0.01503728 Ar 6.58042792 2.65353508 1.35609325 0.01955142 -0.00131976 -0.00347981 Ar 5.26340989 3.96819714 1.29025044 0.00121546 -0.00023787 0.00107178 Ar 0.00527671 5.25951969 0.02603603 -0.01581542 0.00215611 -0.01794677 Ar 1.39109670 6.61342570 0.03006243 -0.00212252 0.01781643 -0.01818170 Ar 1.32993852 5.34315568 1.26408081 -0.00403853 -0.00207289 0.00315158 Ar 0.01015068 6.64366021 1.26331146 -0.01544560 0.01650900 -0.00000702 Ar 2.60383039 5.27404945 0.05102976 0.00363795 0.00063862 -0.02438643 Ar 3.91340351 6.59794716 0.03406184 0.00137141 0.01586083 -0.01607197 Ar 3.97471483 5.27509519 1.30337098 -0.00019420 0.00047431 0.00190103 Ar 2.62639772 6.55600293 1.37383656 0.00219949 0.02404796 -0.00271237 Ar 5.23721811 5.20092595 0.03881389 0.00297190 0.00357259 -0.02316098 Ar 6.65457948 6.57070315 0.04686049 0.00920826 0.01046899 -0.01186879 Ar 6.60833730 5.33670802 1.33179368 0.02095835 -0.00316833 -0.00193090 Ar 5.27277407 6.57168536 1.33661170 -0.00140909 0.02252490 -0.00339885 Ar 0.03992327 0.00911444 2.61842401 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-0.00436464 0.00208136 Ar 3.88828761 6.61862688 2.67795009 0.00354790 0.02236813 -0.00359092 Ar 3.95031792 5.33366798 3.90766583 0.00008151 -0.00514092 0.00233630 Ar 2.63303884 6.56255941 3.91991790 -0.00062863 0.02137787 0.00366577 Ar 5.30799275 5.36031366 2.64098201 -0.00190934 -0.00319875 -0.00064404 Ar 6.58218381 6.61647361 2.60397997 0.01693922 0.01921317 0.00111253 Ar 6.64424105 5.34479963 3.88789255 0.02084548 -0.00120681 0.00262323 Ar 5.24170812 6.59202532 3.93971481 0.00370544 0.02236121 0.00065981 Ar 0.03656854 0.00993806 5.31515005 -0.01799809 -0.01566232 -0.00038741 Ar 1.29431524 1.32117067 5.25701174 -0.00166951 0.00261289 0.00579995 Ar 1.30621630 0.02021977 6.59426102 0.00100560 -0.01566610 0.01684201 Ar 0.01958130 1.31530848 6.65255463 -0.01495420 0.00153244 0.01475945 Ar 2.60456594 0.01427139 5.26806169 0.00299721 -0.02124848 0.00398266 Ar 4.01154673 1.37049503 5.21712675 -0.00188458 -0.00159499 0.00299638 Ar 3.93221975 0.02455217 6.60654036 0.00077524 -0.01628704 0.01372647 Ar 2.69042196 1.29703130 6.62326125 -0.00204226 0.00219623 0.01835950 Ar 5.33071365 0.00251083 5.33240272 -0.00314845 -0.02154385 -0.00012632 Ar 6.56120349 1.37530091 5.28447007 0.02068343 0.00075648 0.00235833 Ar 6.59076241 0.02830069 6.58614846 0.01288279 -0.01094018 0.01188179 Ar 5.27242002 1.30065797 6.64568445 -0.00003680 0.00049739 0.01993795 Ar 0.00597456 2.71405243 5.29924856 -0.02153718 -0.00358231 0.00105326 Ar 1.30514233 3.99016988 5.24462216 0.00034924 -0.00106957 0.00385285 Ar 1.33871874 2.69410324 6.56585713 -0.00032204 -0.00324104 0.02074845 Ar 0.04265720 3.98237058 6.65645052 -0.01638035 0.00041842 0.01538859 Ar 2.61459417 2.67091589 5.26065189 0.00257119 -0.00203918 0.00173937 Ar 3.92671762 4.02302393 5.32031050 0.00279999 -0.00079156 -0.00434507 Ar 3.99938801 2.65142631 6.61475225 -0.00180591 -0.00115902 0.02015561 Ar 2.68027191 3.92794882 6.58153343 -0.00324536 0.00131988 0.02175620 Ar 5.24022455 2.72053049 5.30360978 0.00353443 -0.00085016 -0.00280534 Ar 6.65698370 4.01299762 5.30443260 0.01961558 -0.00093194 -0.00140011 Ar 6.58207402 2.64265089 6.62958439 0.01647028 -0.00103464 0.01494858 Ar 5.34776672 3.92704952 6.62647131 -0.00012360 0.00469698 0.02030602 Ar 0.01173929 5.33474337 5.24055627 -0.02212919 -0.00062232 0.00308745 Ar 1.39889114 6.63171383 5.24784038 -0.00143674 0.02116928 0.00233939 Ar 1.27720635 5.28557603 6.57971273 0.00227631 0.00154277 0.02020462 Ar 0.00997426 6.62646632 6.57902380 -0.01010974 0.01108623 0.00998621 Ar 2.59664157 5.26190212 5.23472460 0.00266627 0.00252267 0.00313514 Ar 4.00598362 6.58610431 5.24605071 -0.00442260 0.02041501 0.00377898 Ar 3.92230939 5.23399996 6.59952657 0.00168531 0.00421624 0.02095215 Ar 2.64168061 6.62562843 6.65986396 0.00097141 0.01325313 0.01350159 Ar 5.29568488 5.32983761 5.29904401 0.00085488 -0.00411237 -0.00065183 Ar 6.61184929 6.59578959 5.28584981 0.01616123 0.01687467 -0.00218527 Ar 6.63661521 5.37119167 6.59917501 0.01568873 -0.00192789 0.01658001 Ar 5.31424546 6.59729093 6.57180944 -0.00232960 0.01649816 0.01733156