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:Z:I:1:forces:R:3 energy=44.028807898023004 pbc="F F F" I 0.21008836 -0.03021732 -0.13403454 53 -0.35633177 1.13508817 1.29714322 I 1.69291415 1.60945423 1.38360995 53 -43.87522890 -38.45094054 15.62381655 I 2.99941939 -0.08002748 -0.15128492 53 1.72404814 0.26573126 0.76059377 I 4.52460080 1.47432887 1.77800982 53 8.79999266 5.79672254 -10.78040849 I 0.24492716 3.07186066 -0.00614550 53 -115.70648030 -112.45226970 -158.89506376 I 1.22130818 4.21395672 1.45131024 53 95.64992399 168.66630978 157.20213243 I 2.80719205 3.16303893 0.15601606 53 72.60071232 15.83069671 -62.64444164 I 4.51307585 4.41238661 1.74484987 53 -0.89440527 -1.38567695 2.32912251 I -0.10223162 0.03792452 3.02903015 53 -1.40920198 -1.14312555 -6.46657924 I 1.37491347 1.55141072 4.49454572 53 -66.02480437 -51.50129821 62.90245265 I 2.74096176 0.07849397 2.85936652 53 6.20136386 -33.56393297 17.32886977 I 4.33456304 1.48023017 4.46648410 53 38.67865146 -28.17673441 32.81445500 I -0.26876825 2.95143034 2.71000712 53 -28.61983544 -27.03604216 23.94472728 I 1.63660430 4.13153652 4.17148997 53 -165.62799045 211.23698565 127.91991488 I 2.80839116 2.70392014 3.28711717 53 199.56031502 -108.24782030 -204.00585272 I 4.52131025 4.39827827 4.48171707 53 -0.70072896 -0.97369333 0.66911779