4000 Lattice="42.507811854306574 0.0 0.0 0.0 42.507811854306574 0.0 0.0 0.0 42.507811854306574" Properties=species:S:1:pos:R:3:Z:I:1:forces:R:3 energy=372449.51174634567 pbc="F F F" Ne 0.02785494 0.03051291 -0.01555679 10 -274.02575676 -303.40896350 -211.90526084 Ne 1.02433328 1.04780828 -0.01154216 10 145.90407306 96.60060815 -388.77947521 Ne 1.09795666 -0.01942286 1.05137481 10 -93.29781608 -382.47972674 -8.80473436 Ne 0.02990846 1.03481713 1.06346948 10 -391.21096849 35.12332404 97.14657293 Ne 2.17430977 0.01916298 0.03131482 10 -122.57572654 -387.18474985 -472.70328431 Ne 3.17887796 1.08249939 -0.02638503 10 223.84289399 -23.84544141 -351.79913898 Ne 3.17213908 -0.01404219 1.05266991 10 193.17786653 -381.94973294 91.57579761 Ne 2.16498978 1.04563131 1.01357756 10 -113.73118488 146.29700184 134.45191987 Ne 4.25673468 -0.03688187 0.03325034 10 -53.23846012 -221.51173550 -289.56651411 Ne 5.29737693 1.06048014 -0.00636634 10 23.81494296 -43.13673166 -405.78947414 Ne 5.33272095 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