4 Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-61.7255183474 stress="-8.139601896169157 0.888679838403248 -0.7258224224795425 0.888679838403248 -8.61084794734037 -1.85196925762391 -0.7258224224795425 -1.85196925762391 -8.449643209316621" pbc="F F F" Mo -0.14459490 0.11115480 0.11044915 -16.29457500 -21.98723189 -25.36754423 Mo 1.70960170 1.31143450 -0.16166483 13.61176935 8.03957566 -9.20399819 Mo 1.28829595 -0.16490224 1.64041416 15.04287009 -12.60940662 15.88926641 Mo -0.22187219 1.51878885 1.32834452 -12.36006444 26.55706285 18.68227601