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=1351.1477074520594 stress="-0.039029535078785774 0.00042926412336448237 -0.0009617488990608461 0.00042926412336448237 -0.03811392845552978 -0.0007571823651818003 -0.0009617488990608461 -0.0007571823651818003 -0.04090641206670941" free_energy=1351.1477074520594 pbc="F F F" Cd 20.85540510 21.11115480 21.11044915 -35.02012799 -36.20734859 -38.97199241 Cd 22.70960170 22.31143450 20.83833517 -26.31569033 -36.71288672 -100.28643670 Cd 22.28829595 20.83509776 22.64041416 -16.69480658 -88.59559194 -24.85121039 Cd 20.77812781 22.55248065 22.32834452 -86.73752069 -12.56227120 -14.00509957 Cd 23.90278341 20.95894820 21.20259391 12.06876897 -79.27813735 -62.25327257 Cd 25.56504129 22.20865944 20.86550211 49.45031005 -15.18932611 -61.45585519 Cd 25.28802619 21.22277084 22.68584377 65.87346457 -108.72054799 -76.88431371 Cd 24.18362810 22.69581920 22.64685009 31.58826874 -80.03208834 -40.89449526 Cd 21.26959405 23.89955883 20.85402479 -59.52627269 13.98866411 -78.34866164 Cd 22.70996341 25.49207130 21.15300231 -33.63005263 86.06780336 -91.80232408 Cd 22.53848316 23.95774659 22.41852158 -65.49661687 14.51134168 -42.55931060 Cd 20.95789336 25.38825682 22.27041603 -70.43709788 58.02845247 -20.53602185 Cd 24.19178619 24.14270954 21.29140871 28.07472304 15.96767036 -140.60433856 Cd 25.61455359 25.53253581 21.14904689 51.85581398 50.72265909 -46.25037270 Cd 25.28091226 24.10609294 22.46603997 139.90035015 28.06634863 -20.12129643 Cd 23.80598025 25.32157598 22.51361598 36.23362123 129.31702673 -24.27807481 Cd 20.85198705 20.97567541 23.96913470 -61.75234843 -47.31587410 0.00991360 Cd 22.43745442 22.27846858 23.99451428 -53.61015260 -55.95091557 53.92407031 Cd 22.09686535 20.84140700 25.31668137 14.60849413 -64.20453030 44.68100151 Cd 20.91986395 21.94575019 25.59073906 -49.82061212 11.19278670 53.41668140 Cd 24.57094789 20.93381326 24.13132919 -15.94633448 -95.70331518 50.41769922 Cd 25.75978669 21.99883484 23.78504734 119.45129217 18.05780663 59.02633736 Cd 25.68365717 21.20288723 25.58343331 38.07127724 -26.49853369 53.44299386 Cd 23.79585403 22.44809454 25.72094491 15.53626532 -28.67923558 96.19675483 Cd 21.23171545 24.18190327 23.82183498 -113.33868316 23.04915748 33.07611923 Cd 22.71219253 25.42485375 24.12990665 -49.69712420 120.97489159 37.41170718 Cd 22.28220450 24.28278197 25.56210000 -17.78097362 -19.40240594 91.32950169 Cd 21.13362859 25.32702941 25.57034430 -67.74269353 56.74023422 41.73523313 Cd 24.04852473 24.05473499 23.91561068 31.44572120 19.05350002 69.85240005 Cd 25.63661615 25.40480033 23.87719504 77.21628412 69.89802489 28.84780164 Cd 25.29869006 24.11041876 25.26735611 80.42637353 14.33644480 81.04640453 Cd 23.83533445 25.24148635 25.58611608 31.74607936 65.08019586 89.68845692