32 Lattice="6.0 0.0 0.0 0.0 6.0 0.0 0.0 0.0 6.0" Properties=species:S:1:pos:R:3:Z:I:1:forces:R:3 energy=2274.07992602 pbc="F F F" S 0.06197183 -0.16973373 -0.25749070 16 -73.24660443 -76.05898923 -37.58714924 S 1.43199452 1.07428965 -0.20044440 16 -29.54712463 5.70831247 -218.07102157 S 1.53855109 0.46966817 1.32124062 16 -86.75579481 -231.27963434 -8.23633394 S 0.03506931 1.76442030 1.65366473 16 -236.74531689 -55.12288198 -47.81279922 S 3.42085837 -0.04432767 -0.22705270 16 -3.49980677 -137.08481988 -92.00609614 S 4.57255377 1.24546318 -0.04570225 16 154.85447685 -0.57157072 -88.76793000 S 4.66911338 -0.01377093 1.76475192 16 98.26291499 -92.07205190 6.69114241 S 2.95588739 1.49137216 1.30057933 16 101.26497773 -86.32508223 -9.29836173 S -0.01154322 3.01518508 0.16682340 16 -112.02131186 56.36758842 -111.08620897 S 1.81122740 4.36810690 0.07062714 16 -64.99633589 128.96799850 -137.12606412 S 1.48293165 2.87047644 1.57185018 16 -69.89856427 72.86101343 -73.21639686 S -0.03381125 4.77913633 1.63412589 16 -86.78708795 98.47453432 -31.98355650 S 3.23702542 2.80042674 0.14471297 16 3.43138170 53.84530069 -216.62522435 S 4.26192411 4.46490969 -0.23002846 16 63.77910059 94.10772770 -91.05907727 S 4.62263099 3.05036063 1.18800826 16 221.99187480 22.07335459 14.22140174 S 3.12593290 4.34000708 1.57759302 16 43.43442734 192.93344115 -34.77192909 S 0.00165017 -0.03766839 3.45445483 16 -174.99295754 -221.18619088 -33.48989630 S 1.23221714 0.98214825 3.17871475 16 -28.60498349 -11.53617244 12.76677662 S 1.88841265 -0.21020387 4.45283623 16 -26.28121761 -160.56012420 164.05104321 S -0.07790797 1.20038420 4.51229390 16 -137.21746795 43.93168291 179.01670518 S 2.84628414 0.06881812 3.03198024 16 109.12797493 -197.33068102 -39.12783376 S 4.21156333 1.59359286 3.28309307 16 194.28438724 -65.05736789 -8.48098107 S 4.64803915 -0.19660656 4.64526935 16 60.81185902 -60.31069095 47.52569764 S 3.03806039 1.45487073 4.76599513 16 30.82209677 -16.93320526 184.19825090 S 0.29637969 3.05957798 3.43873293 16 -246.45422991 4.63554717 -31.33339849 S 1.59476273 4.53099333 3.18686274 16 -10.26615758 193.46841253 14.00738101 S 1.63391685 2.92588762 4.21223271 16 25.59579788 39.59323885 282.38566329 S 0.02295220 4.40411058 4.45742157 16 -101.88184924 111.41543315 114.40008516 S 2.87252202 3.03320948 2.94057204 16 120.27148257 51.62150604 54.37534334 S 4.70040666 4.55646809 3.01560503 16 98.86202773 80.36859196 21.90585737 S 4.66980798 2.73413757 4.52184289 16 121.20891271 60.00147227 110.23036336 S 3.15019543 4.63350600 4.64618898 16 41.19311797 101.05430677 104.30454739