32 Lattice="13.134967634205715 0.0 0.0 0.0 13.134967634205715 0.0 0.0 0.0 13.134967634205715" Properties=species:S:1:pos:R:3:forces:R:3 energy=-23.12262063180031 stress="-0.0002952685353390811 -0.00011711844924451632 0.00010876466339560678 -0.00011711844924451632 -0.00035396970881724756 -4.423569521415458e-05 0.00010876466339560678 -4.423569521415458e-05 -0.0002860087671399801" free_energy=-23.12262063180031 pbc="F F F" Sr 0.02816477 0.02410438 0.06085807 -0.03494434 -0.02691063 -0.02320651 Sr 3.22867675 3.30280372 0.03268053 0.16149451 0.09504233 -0.10289083 Sr 3.29076786 0.05159712 3.27827879 0.09092440 -0.06441654 0.14095013 Sr 0.00817396 3.34352650 3.28166305 -0.08596239 0.03855259 0.14394908 Sr 6.60870026 0.01306525 0.04328151 -0.12261712 -0.05191249 -0.06656141 Sr 9.86746083 3.23572524 0.01201097 0.05608332 0.12872817 -0.04762212 Sr 9.84046504 0.06390552 3.28182739 0.07185026 -0.08248203 0.07440942 Sr 6.52919624 3.30510597 3.23003555 -0.09344708 0.12681773 0.16716364 Sr 0.05822640 6.58942749 0.02969130 -0.08616529 -0.10180050 -0.08952983 Sr 3.24975831 9.82856436 0.01706140 0.12294658 0.03766825 -0.05322874 Sr 3.25004215 6.50895663 3.32951709 0.19965160 -0.04728144 0.07829364 Sr 0.00386330 9.80214383 3.22638135 -0.04269420 0.06668774 0.14563090 Sr 6.62155146 6.56877736 0.00651135 -0.15770496 -0.10861645 -0.06658009 Sr 9.90382171 9.78866150 0.07109658 0.03393813 0.03259609 -0.03232929 Sr 9.80044551 6.57569133 3.32227708 0.08463424 -0.12462811 0.11008864 Sr 6.55454761 9.87302174 3.22363413 -0.10320288 0.04674648 0.14279347 Sr 0.02298869 0.02116579 6.61988905 -0.02799325 -0.03770683 -0.13072402 Sr 3.34052008 3.32480560 6.59456717 0.11163149 0.06825562 -0.15816605 Sr 3.34449210 0.04002231 9.83280407 0.07806935 -0.06970813 0.04336157 Sr 0.05891883 3.27065077 9.80304825 -0.07018502 0.09560571 0.07185130 Sr 6.62073766 0.02625751 6.52448008 -0.13191695 -0.06099135 -0.07007827 Sr 9.88030016 3.21849375 6.54013288 0.03220967 0.17401414 -0.06269776 Sr 9.89855509 0.01666679 9.87573150 0.00288304 -0.01601268 0.00507733 Sr 6.59079584 3.24356992 9.89768915 -0.06118828 0.13429918 0.02568791 Sr 0.03536755 6.56380532 6.55953975 -0.07126340 -0.07885364 -0.06918560 Sr 3.34096659 9.81739519 6.58771957 0.07704939 0.05775460 -0.11177226 Sr 3.30966511 6.51113452 9.88673248 0.11195069 -0.04950558 0.05196401 Sr 0.03658540 9.84086423 9.83132089 -0.00363840 0.00342931 0.01135024 Sr 6.55365096 6.55578079 6.51497375 -0.07786962 -0.12079006 -0.05273379 Sr 9.86160759 9.88082881 6.62786049 0.01131910 0.03027551 -0.11673301 Sr 9.84389458 6.57378473 9.85064643 0.02988899 -0.11510072 0.01521101 Sr 6.60201268 9.84635839 9.91124351 -0.10573157 0.02024372 0.02625729