64 Lattice="10.0 0.0 0.0 0.0 10.0 0.0 0.0 0.0 10.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=476.57385731459584 stress="-1507.093290688789 -81.7265423836352 11.777044457111515 -81.7265423836352 -1408.9753325266454 -130.57202279169348 11.777044457111515 -130.57202279169348 -1367.8037815315538" pbc="F F F" Pd -0.06703603 0.26509720 0.09971265 -16.31341721 -15.26822064 -18.19534216 Pd 1.00283426 1.26268590 1.28380950 47.68279808 -45.20457032 -4.62125113 Pd 1.85350770 2.68465858 0.44740598 8.62096082 21.37627825 -17.50552185 Pd 3.63112208 3.69214075 1.18393766 0.86779973 11.15977813 -3.86952143 Pd 2.53576338 0.04204766 3.10324970 -8.19271420 -9.01011689 -6.78269076 Pd 4.04058735 1.17678953 3.99481551 60.46927911 -19.24667367 -15.74073264 Pd -0.11501586 2.12825137 2.18931714 -46.21499887 36.01658583 37.94807171 Pd 1.74006883 3.76192279 4.08873811 2.20823458 -43.97725843 91.02219360 Pd 4.83297513 -0.17944943 0.01861734 -1.65311564 -0.78730696 -0.84251542 Pd 6.56141683 0.83263538 1.10517360 -99.62785324 7.64315345 -75.74088192 Pd 7.52850499 2.10828204 0.31882269 23.61845576 32.03727884 -19.69823011 Pd 8.70780484 4.14619873 1.72825078 291.06172925 -174.84191566 -132.69275207 Pd 7.47278882 0.38818244 2.23608819 76.77771411 -38.19720695 96.09362967 Pd 8.78995947 0.46324132 4.23222593 0.29730292 0.30442201 1.12472479 Pd 4.60100400 2.29494383 2.39610665 7.81484718 -0.53138094 -5.48468572 Pd 6.75486652 3.20880847 3.11446644 -5.87227043 -8.39060766 3.83679653 Pd 0.04558552 4.96165576 0.78114230 -14.36309411 -13.39775595 -7.28798980 Pd 1.44238965 6.22018728 1.37752608 48.14336036 -11.82414281 -24.62466849 Pd 2.22391205 7.63057408 0.10141327 5.04684975 8.60930125 -7.52232164 Pd 4.41211238 8.91475426 0.91179919 0.04221344 -0.71823632 0.17766735 Pd 1.65161277 4.53200207 2.72026670 -4.98788553 45.96654743 -87.28243354 Pd 3.21472123 6.56964822 3.69400058 21.20057264 -50.01358740 -74.30623586 Pd 0.22508453 6.88225744 2.41849640 -39.14896658 22.58979755 34.75265405 Pd 1.67040740 9.02487477 4.15030751 -2.98994971 6.04034628 -2.84797450 Pd 5.03386167 5.42056945 -0.02843414 -1.51863031 -2.25462023 -1.83135742 Pd 6.16600245 7.08054050 0.94874978 -205.48093551 -26.44357687 107.49827207 Pd 7.35870658 7.24893561 0.33072740 203.95436556 25.72874563 -111.53890351 Pd 9.00256939 8.28542148 1.19631032 5.45463849 3.36692729 3.13407549 Pd 7.72470550 4.73859410 2.17641596 -285.31289311 184.66265332 126.38064521 Pd 8.87017229 6.34422941 3.91220884 17.07022447 -11.50851467 -22.94795378 Pd 4.89802814 6.99684260 2.84547943 16.04310213 3.40725810 -9.94936252 Pd 6.14864816 8.25892011 4.32739285 -1.25910089 3.72657794 0.95549666 Pd 0.38718032 -0.42455351 5.43364231 -36.88842453 -128.13650522 -41.95935695 Pd 0.78672986 0.95441648 5.88429240 37.37555032 125.37389013 40.22317710 Pd 2.62671053 1.87539026 4.51657206 -57.92527414 26.16518318 26.46636991 Pd 3.67864464 3.87222352 6.06864187 -2.62231283 -2.40035462 2.30459618 Pd 2.73179369 -0.16644420 7.89642626 -0.69440387 -0.05022937 -0.79954275 Pd 4.38795615 1.25962664 8.78335587 36.14191362 -244.61841985 246.47504436 Pd 0.19931511 2.49748332 7.50193157 -7.92708730 -9.38328799 -3.45547469 Pd 1.17164845 4.10059818 8.29168786 -3.38597596 1.98182963 8.63864609 Pd 4.77308123 -0.35348780 5.02381918 6.45906357 -13.46487588 9.30914581 Pd 6.79101834 1.24832499 6.49747655 -7.24747104 -4.45376062 3.38918923 Pd 7.69113984 2.66399675 5.22216576 -16.39174890 -4.99002496 -21.38677152 Pd 9.05302738 3.38026205 6.30343652 21.78992914 11.52158540 17.52521714 Pd 7.99330254 0.01261415 7.97900117 -15.68018264 -20.66234635 -17.28384324 Pd 9.02698013 1.04677788 9.13509163 18.06102905 18.23890617 20.17068321 Pd 4.26247340 2.13443468 7.90550059 -35.39822993 244.94111492 -246.39508905 Pd 6.05663338 3.72255266 8.82593524 -1.36233751 -2.03613570 1.63695923 Pd 0.28181079 5.51266137 5.83939915 -76.71090768 -38.98383277 -54.98743750 Pd 1.47322851 6.11272447 6.68837040 62.35776542 43.41276748 35.94683351 Pd 2.56947911 7.25825786 4.95567197 -37.99182500 40.59114040 84.90712698 Pd 4.22244865 9.16498462 5.98338935 -0.09436746 -0.76406875 -0.48248827 Pd 2.65239860 5.40500615 7.93815060 -199.19234785 -245.11585662 -131.03456398 Pd 3.41772351 6.22994351 8.43117546 225.18742560 243.39141739 147.02638196 Pd 0.27626772 7.77103556 7.52979680 -20.80796821 -19.13280055 -19.05196293 Pd 1.16775308 8.96598545 8.60845583 17.80132423 23.49354004 21.27724397 Pd 4.97014598 5.32594668 4.89928475 -7.95594893 -7.37406886 -16.97438583 Pd 6.01705743 6.15030791 6.31477418 -4.90262833 6.92975700 -52.02126103 Pd 7.83455246 7.04661175 5.29778187 -21.77042338 -55.59451478 -34.80499294 Pd 8.02755807 8.26357032 6.34763346 10.36560723 66.45588307 57.95916172 Pd 7.00183271 5.24385946 7.37672249 34.53703169 -32.28910233 33.53562995 Pd 8.29629520 6.58772043 8.75189016 3.88829074 -0.18882529 1.08245846 Pd 5.26872684 7.27716882 7.42395853 -21.98787715 33.06492843 28.71792376 Pd 6.62856629 8.11327738 9.11382186 -0.46581102 3.05710839 2.43448124