32 Lattice="42.0 0.0 0.0 0.0 42.0 0.0 0.0 0.0 42.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=530.5945360514397 stress="-0.006550417701010642 -5.2380756055594816e-05 1.755715606823166e-06 -5.2380756055594816e-05 -0.006348624431370768 4.777430567142895e-05 1.755715606823166e-06 4.777430567142895e-05 -0.006550004736549003" pbc="F F F" Cs 20.85540510 21.11115480 21.11044915 -8.85657384 -8.15041272 -8.92611909 Cs 22.70960170 22.31143450 20.83833517 -2.73295582 -3.57713287 -15.28537903 Cs 22.28829595 20.83509776 22.64041416 -3.18796446 -14.71637727 -3.20557663 Cs 20.77812781 22.51878885 22.32834452 -14.78972683 -1.78114778 -3.29681447 Cs 23.87679405 20.95894820 21.20259391 2.33382715 -12.93310787 -10.62494324 Cs 25.56504129 22.20865944 20.86550211 10.82605132 -3.41004773 -12.14970068 Cs 25.28802619 21.22277084 22.68584377 11.31065151 -13.46199733 -4.58055423 Cs 24.18362810 22.69581920 22.64685009 3.23131787 -5.47537571 -3.86923093 Cs 21.26959405 24.17626233 20.85402479 -10.33476115 2.11684222 -13.69566867 Cs 22.70996341 25.49207130 21.15300231 -2.89430798 13.69421502 -13.08912682 Cs 22.53848316 23.99143838 22.41852158 -6.39082911 1.21295516 -4.73912376 Cs 20.95789336 25.38825682 22.27041603 -13.05403165 11.72691382 -2.67092790 Cs 24.19178619 24.17895518 21.29140871 4.30652159 2.33309441 -17.33655775 Cs 25.61455359 25.53253581 21.14904689 9.99889021 9.56222044 -9.00601824 Cs 25.28091226 24.10609294 22.46603997 16.96726384 3.02438323 -3.77417632 Cs 23.80598025 25.32157598 22.51361598 2.68833051 17.55280053 -2.49672179 Cs 20.85198705 20.97567541 24.06329927 -12.51858684 -10.34193638 2.07726842 Cs 22.43745442 22.27846858 23.99451428 -4.25460847 -4.49111689 3.57169542 Cs 22.34126820 20.84140700 25.31668137 -1.85869858 -12.68331655 10.70538855 Cs 20.91986395 22.26995482 25.59073906 -11.37432780 -1.92231058 11.04718130 Cs 24.27219963 20.93381326 24.13132919 2.74244749 -14.95902473 4.80944374 Cs 25.75978669 22.22592512 23.78504734 16.66252666 -2.46244571 4.13307202 Cs 25.68365717 21.20288723 25.58343331 8.78638816 -6.81850542 9.65933222 Cs 23.79585403 22.44809454 25.72094491 2.78625908 -3.53557441 15.43132667 Cs 21.23171545 24.18190327 23.82183498 -15.21060784 3.45923932 3.02195958 Cs 22.71219253 25.42485375 24.12990665 -3.87036270 16.59211903 4.11209561 Cs 22.28220450 24.00607847 25.56210000 -4.45325419 1.20008618 14.67004832 Cs 21.13362859 25.32702941 25.57034430 -10.11959486 9.29620844 9.04961311 Cs 24.04852473 24.05473499 23.91561068 4.00001511 2.67085009 6.33789527 Cs 25.63661615 25.40480033 23.87719504 13.19744931 12.40767635 3.57088075 Cs 25.29869006 24.11041876 25.26735611 12.61221175 2.36624879 12.57238825 Cs 23.83533445 25.24148635 25.58611608 3.45104056 11.50397691 13.97705033