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:forces:R:3 energy=-3.62908651095 stress="0.06769308724901466 0.01168771791313967 0.04201521452326787 0.01168771791313967 0.08388440879974925 0.012258490340003255 0.04201521452326787 0.012258490340003255 0.07412268880191207" pbc="F F F" O 0.02598936 -0.27670350 -0.03624564 0.40252944 0.44792922 0.36146660 O 1.40583543 1.25559716 1.20178472 -0.54184268 -0.21756693 -0.35633303 O 3.17240962 -0.22709028 -0.11909813 0.03872379 0.38693105 0.30972071 O 4.36136659 1.55835534 1.24645637 -0.92205133 0.54621867 -0.82065620 O -0.01806569 2.88099539 0.20070203 0.66314583 0.02300475 0.70555015 O 0.98562266 4.40085166 1.71607440 -0.02741640 -1.03336820 0.26782551 O 3.28187239 3.01001192 -0.01546661 1.23595935 -0.20383661 1.38855154 O 4.60170120 4.37793365 1.21904386 -0.70869431 -0.71299366 -0.54475237 O 0.00082602 0.24624097 3.14302402 0.59020742 0.82880000 0.39369689 O 1.35498893 1.37758928 4.70947124 -0.54584567 -0.21884710 -0.86032478 O 2.85512851 0.05280714 2.91333883 0.18783462 0.64338098 0.22921089 O 4.34655491 1.37241235 4.32230844 -0.45805389 -0.30345083 -0.43176229 O -0.08950840 2.72286420 3.13268308 0.50490263 -0.22114250 0.01936037 O 1.08301917 4.65488783 4.55988540 -0.01834750 -0.20025890 -0.35095624 O 2.70245745 3.16431082 2.81425730 -0.20250800 0.42340186 -0.12985854 O 4.37045262 4.53277713 4.33272567 -0.19854329 -0.18820181 -0.18073921