16 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:forces:R:3 energy=15478.47052085624 stress="-70771.62738528897 -30708.929546889958 -36259.98136155442 -30708.929546889958 -67317.10217611794 -28084.09790474076 -36259.98136155442 -28084.09790474076 -54021.48148545147" pbc="F F F" U -0.15618957 -0.26623684 0.35474538 -93.19564144 -72.02446638 -105.39634230 U 1.68391407 1.91634196 1.27518358 -2906.56707356 -6682.23079668 3312.07297156 U 2.81899960 0.25228388 0.25122585 -299.45557489 -2975.62269321 -2254.14607278 U 4.71122094 1.11584363 1.24839920 1889.41694660 699.36521058 923.14260884 U 0.27922154 3.21124196 0.25288705 -19013.72928064 -14538.36943728 -16933.19358065 U 1.35433630 4.41153674 1.25676213 13697.16876480 19912.57589530 13340.95119698 U 3.01592876 3.06477198 0.01032536 3476.95601561 2128.11120626 -3878.75699994 U 4.57505358 4.24789259 1.72255152 1707.32385156 981.14303305 -526.19983426 U 0.04272330 0.27577223 3.20215094 -17226.17237095 -12754.76533592 -14075.15012810 U 1.31855174 1.21738271 4.26797671 17955.25865686 8891.32553709 17875.30398020 U 2.76655943 -0.20392001 3.16938625 1444.04013196 -1474.36336677 -930.65329837 U 4.42567630 1.66733283 4.62835100 107.39963813 -53.50637682 88.32607998 U 0.47553375 2.94654403 3.34749932 -4984.33143387 3591.29822658 -2321.31433724 U 1.43632483 4.78623308 4.44540058 487.98954706 1515.17403196 1015.65782140 U 2.70185038 3.24129628 2.69336489 3665.15961842 698.66410504 4342.19537230 U 4.44887730 4.56545983 4.65634198 92.73820435 133.22522721 127.16056238