612 Lattice="22.755524628377593 0.0 0.0 11.377762314188796 19.706862404617446 0.0 0.0 0.0 105.28557898562616" Properties=species:S:1:pos:R:3:forces:R:3 energy=-654.8869128948761 stress="-0.00026238457498994005 -1.5878723392648774e-07 -3.1574065063932334e-07 -1.5878723392648774e-07 -0.00026122561674466865 -1.1519812009499815e-06 -3.1574065063932334e-07 -1.1519812009499815e-06 -2.440362567433785e-10" pbc="T T F" Sr 0.00404837 0.00430668 26.28675939 -0.00000226 -0.00000850 -0.00000004 Sr 5.69292954 3.28878388 26.28675947 -0.00000236 -0.00000875 -0.00000006 Sr 3.79663580 0.00430677 26.28675936 -0.00000219 -0.00000849 0.00000009 Sr 1.90034207 3.28878381 26.28675947 -0.00000218 -0.00000864 -0.00000005 Sr 15.17439229 17.52149559 29.41668099 -0.00000213 -0.00000807 0.00000007 Sr 9.48551091 1.09911014 29.41668107 -0.00000168 -0.00000800 -0.00000015 Sr 18.96697971 17.52149556 29.41668098 -0.00000237 -0.00000834 -0.00000007 Sr 5.69292360 1.09911028 29.41668108 -0.00000247 -0.00000829 -0.00000028 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41.80857762 -0.00000171 -0.00000358 0.00000014 Sr 11.38173870 8.76264612 41.80857749 -0.00000202 -0.00000393 0.00000086 Sr 9.48544481 12.04712338 41.80857758 -0.00000058 -0.00000465 0.00000040 Sr 11.38171366 6.57290368 44.90521260 -0.00000113 -0.00000193 -0.00000009 Sr 17.07059500 9.85738086 44.90521268 -0.00000234 -0.00000378 -0.00000067 Sr 15.17430096 6.57290349 44.90521278 -0.00000028 -0.00000133 -0.00000115 Sr 13.27800734 9.85738089 44.90521260 -0.00000015 -0.00000340 -0.00000026 Sr 15.17427389 4.38315498 48.00184727 0.00000041 -0.00000180 0.00000164 Sr 20.86315525 7.66763194 48.00184741 -0.00000041 -0.00000069 -0.00000057 Sr 18.96686148 4.38315497 48.00184748 -0.00000101 -0.00000160 -0.00000009 Sr 17.07056782 7.66763201 48.00184736 -0.00000032 -0.00000151 -0.00000012 Sr 18.96683343 2.19340294 51.09848227 0.00000004 0.00000054 0.00000010 Sr 24.65571468 5.47788019 51.09848205 -0.00000030 -0.00000066 0.00000038 Sr 22.75942094 2.19340299 51.09848217 -0.00000023 0.00000092 0.00000050 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0.00000849 -0.00000022 Sr 13.27780629 9.85665029 72.78028330 0.00000229 0.00000760 0.00000007 Sr 15.17409402 4.38249959 75.91020479 0.00000232 0.00000844 0.00000017 Sr 20.86297521 7.66697654 75.91020488 0.00000227 0.00000849 0.00000001 Sr 18.96668144 4.38249951 75.91020477 0.00000234 0.00000855 0.00000020 Sr 17.07038778 7.66697662 75.91020491 0.00000228 0.00000850 0.00000006 Sr 3.79663595 6.57326087 26.28675953 -0.00000235 -0.00000854 -0.00000006 Sr 9.48551734 9.85773791 26.28675949 -0.00000254 -0.00000871 -0.00000009 Sr 7.58922342 6.57326086 26.28675956 -0.00000230 -0.00000841 -0.00000003 Sr 5.69292983 9.85773790 26.28675952 -0.00000234 -0.00000867 -0.00000008 Sr 7.58921727 4.38358728 29.41668112 -0.00000205 -0.00000796 0.00000020 Sr 13.27809851 7.66806426 29.41668109 -0.00000179 -0.00000786 0.00000012 Sr 11.38180473 4.38358726 29.41668108 -0.00000234 -0.00000852 0.00000013 Sr 9.48551121 7.66806436 29.41668118 -0.00000262 -0.00000815 -0.00000024 Sr 11.38179440 2.19389740 32.51802188 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30.34456796 13.14155939 54.19511661 0.00000107 0.00000092 0.00000178 Sr 13.27792454 16.42603651 54.19511694 0.00000088 0.00000117 -0.00000036 Sr 11.38163094 13.14155937 54.19511671 -0.00000021 0.00000166 0.00000061 Sr 32.24086180 16.42603642 54.19511688 0.00000002 0.00000144 0.00000041 Sr 11.38160363 10.95181058 57.29175151 0.00000085 0.00000306 -0.00000018 Sr 17.07048507 14.23628767 57.29175166 -0.00000033 0.00000231 -0.00000084 Sr 15.17419108 10.95181045 57.29175153 0.00000103 0.00000384 -0.00000035 Sr 13.27789737 14.23628769 57.29175161 0.00000171 0.00000233 -0.00000047 Sr 15.17416581 8.76206813 60.38838640 0.00000182 0.00000452 0.00000115 Sr 20.86304713 12.04654508 60.38838651 0.00000071 0.00000534 0.00000021 Sr 18.96675341 8.76206815 60.38838667 0.00000064 0.00000420 -0.00000093 Sr 17.07045961 12.04654528 60.38838653 0.00000151 0.00000354 -0.00000013 Sr 18.96673104 6.57233531 63.48502431 0.00000119 0.00000499 0.00000098 Sr 24.65561218 9.85681260 63.48502439 0.00000124 0.00000368 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