32 Lattice="10.517339706420898 0.0 0.0 0.0 10.517339706420898 0.0 0.0 0.0 10.517339706420898" Properties=species:S:1:pos:R:3:forces:R:3 energy=-109.07546908312433 stress="10.87462749064903 -4.856471537861031 0.9658635054035472 -4.856471537861031 9.182684192040027 -0.08395682224584888 0.9658635054035472 -0.08395682224584888 9.411483676928011" pbc="F F F" Sm 0.31065165 0.04821017 -0.12072624 0.09378159 0.08976551 -0.09980212 Sm 2.84838549 2.55711729 -0.12787091 -0.53210636 0.28634505 0.12922582 Sm 2.52301189 -0.14807630 2.55474459 0.13722934 0.46963443 0.29130963 Sm -0.23094650 2.75491663 2.42271343 0.40591564 -0.49895004 0.24630485 Sm 5.38774304 0.04990450 -0.24795212 -0.42312943 0.19631283 0.55240473 Sm 8.02493047 2.43262176 0.23698948 -0.09181627 0.12411159 -0.38642559 Sm 8.04623955 -0.08356688 2.51607651 -0.12047870 0.12363598 0.25329174 Sm 5.22615047 2.44782915 2.81111737 -0.51235259 0.44848638 -0.86148028 Sm -0.19403276 5.42042182 -0.14086252 0.30338761 -0.31350669 0.30212844 Sm 2.53101157 7.83217638 -0.23331265 0.64516050 -0.32708891 0.14957018 Sm 2.44347182 5.18918284 2.48099651 0.60318628 0.22949841 0.44818446 Sm 0.18822135 8.13293140 2.40112267 0.23755516 -0.24902013 0.61881284 Sm 5.27619606 5.05388459 0.15183504 -0.07719740 0.08084552 -0.31827745 Sm 7.79936178 8.08445359 0.02270143 -0.25092642 -0.40501392 0.34522940 Sm 7.70082270 5.01113929 2.50339577 1.02290271 0.45468409 0.43027943 Sm 5.44269729 7.71287949 2.61879685 -0.98105284 0.36231980 0.32936153 Sm -0.06417375 -0.07751362 5.40956243 0.39350881 0.44059907 -0.18600895 Sm 2.48621260 2.73852225 5.34196360 -0.22156647 -0.31127711 -0.76171294 Sm 2.84700789 0.21097210 8.09822768 -0.49943828 -0.26603094 -0.17995183 Sm -0.02973336 2.66597243 7.94830596 0.31746911 0.22839731 -0.24067267 Sm 5.42849766 0.19878830 5.06635469 -0.58527927 -1.20489424 0.58849392 Sm 7.70658557 2.64626022 5.41488105 1.34045984 -0.46074152 -0.53446333 Sm 7.90480272 -0.10024352 8.11893418 -0.61183799 0.38683625 -0.38178269 Sm 5.15759584 2.42277724 7.66404738 0.53134459 0.90732512 0.55883435 Sm -0.23479707 5.39048131 5.06224702 0.43814754 -0.03574274 0.11927073 Sm 2.73740341 8.07117584 5.50848364 -0.47802098 -0.54698900 -1.72660284 Sm 2.78386664 5.22084437 7.94907092 -0.53298234 -0.38937235 -0.08732258 Sm 0.16658103 7.99601478 7.63017317 0.15754932 -0.23166764 0.10947363 Sm 5.38967324 5.06337690 5.10068520 -0.92257941 0.63021054 0.01730080 Sm 8.13607523 7.87361887 5.14255041 -0.46096740 -0.41703965 -0.23787248 Sm 8.03041821 5.23376255 7.63984077 -0.36155075 0.12123073 0.21578478 Sm 5.02330223 7.75556900 7.64934024 1.03568488 0.07709626 0.29711448