40 Lattice="12.692071 0.0 0.0 0.0 15.538287 0.0 0.0 0.0 6.945818" Properties=species:S:1:pos:R:3:forces:R:3 energy=-103.20024681619579 stress="-0.010574473946803277 -6.326460528055454e-08 9.006590827270701e-08 -6.326460528055454e-08 -0.011343753323396993 2.673194327946395e-08 9.006590827270701e-08 2.673194327946395e-08 -0.011227259114089005" pbc="T T T" I 2.72098000 1.02381000 0.44582000 -0.04127284 -0.00390268 0.02461409 I 3.62507000 8.79296000 0.44582000 0.04125946 -0.00392252 0.02461703 I 2.81617000 4.81060000 0.57324000 -0.03837316 0.03863644 -0.01013092 I 3.52986000 12.57975000 0.57324000 0.03840914 0.03861652 -0.01015386 I 5.84132000 2.85932000 1.52616000 0.01391290 -0.03900171 0.06586578 I 0.50472000 10.62847000 1.52616000 -0.01393159 -0.03902697 0.06586115 I 5.86598000 6.72121000 1.71767000 -0.01623428 0.03759288 -0.02889420 I 0.48006000 14.49036000 1.71767000 0.01626617 0.03755310 -0.02886986 I 12.21202000 6.72121000 1.75524000 -0.01627794 0.03757100 0.02888027 I 6.82610000 14.49036000 1.75524000 0.01623596 0.03757166 0.02887601 I 12.18735000 2.85932000 1.94675000 0.01393415 -0.03900448 -0.06589469 I 6.85075000 10.62847000 1.94675000 -0.01394140 -0.03901791 -0.06589205 I 9.16220000 4.81060000 2.89967000 -0.03837447 0.03864717 0.01012119 I 9.87590000 12.57975000 2.89967000 0.03836037 0.03860385 0.01013140 I 9.06701000 1.02381000 3.02708000 -0.04126349 -0.00389888 -0.02460493 I 9.97110000 8.79296000 3.02708000 0.04125938 -0.00391875 -0.02461233 I 2.72098000 6.74533000 3.91873000 -0.04128725 0.00394989 0.02462514 I 3.62507000 14.51448000 3.91873000 0.04123362 0.00386994 0.02459606 I 2.81617000 2.95855000 4.04615000 -0.03837428 -0.03863826 -0.01013927 I 3.52986000 10.72768000 4.04615000 0.03840239 -0.03860510 -0.01016289 I 5.84132000 4.90982000 4.99907000 0.01392478 0.03903969 0.06584581 I 0.50472000 12.67897000 4.99907000 -0.01391694 0.03900391 0.06585278 I 5.86598000 1.04794000 5.19058000 -0.01623244 -0.03759671 -0.02889298 I 0.48006000 8.81708000 5.19058000 0.01624057 -0.03760232 -0.02888630 I 12.21202000 1.04794000 5.22814000 -0.01627608 -0.03757689 0.02888773 I 6.82610000 8.81708000 5.22814000 0.01621032 -0.03762295 0.02890112 I 12.18735000 4.90982000 5.41966000 0.01392983 0.03903836 -0.06585842 I 6.85075000 12.67897000 5.41966000 -0.01391055 0.03899075 -0.06586738 I 9.16220000 2.95855000 6.37258000 -0.03834899 -0.03864427 0.01009470 I 9.87590000 10.72768000 6.37258000 0.03832700 -0.03858770 0.01010559 I 9.06701000 6.74533000 6.49999000 -0.04127464 0.00394100 -0.02460833 I 9.97110000 14.51448000 6.49999000 0.04123028 0.00386107 -0.02458372 Pt 10.65164000 4.85173000 0.65954000 -0.02480078 -0.00002991 0.00072673 Pt 8.38646000 12.62087000 0.65954000 0.02490252 0.00001920 0.00068771 Pt 4.30561000 4.85173000 2.81337000 -0.02481489 -0.00006264 -0.00073838 Pt 2.04043000 12.62087000 2.81337000 0.02481461 0.00003870 -0.00070981 Pt 10.65164000 2.91742000 4.13244000 -0.02484330 -0.00001740 0.00084086 Pt 8.38646000 10.68656000 4.13244000 0.02491991 0.00007531 0.00082089 Pt 4.30561000 2.91742000 6.28628000 -0.02483891 0.00000851 -0.00073055 Pt 2.04043000 10.68656000 6.28628000 0.02481350 0.00004899 -0.00072103