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S2\n1.0\n5.158720 -0.022413 0.574646\n0.445898 7.997617 0.835875\n-0.107830 -0.036115 8.471843\nH C S\n16 18 2\ndirect\n0.312125 0.193812 0.376539 H\n0.335033 0.493372 0.907047 H\n0.645420 0.303394 0.612001 H\n0.675881 0.604122 0.635751 H\n0.925539 0.057688 0.570879 H\n0.261033 0.761321 0.808563 H\n0.223452 0.030241 0.652958 H\n0.312255 0.193761 0.876569 H\n0.166161 0.770596 0.617403 H\n0.645265 0.303474 0.111995 H\n0.675755 0.604196 0.135750 H\n0.166034 0.770669 0.117394 H\n0.925290 0.057747 0.070885 H\n0.260922 0.761387 0.308552 H\n0.223261 0.030309 0.152895 H\n0.334935 0.493418 0.407016 H\n0.088380 0.748781 0.743855 C\n0.178448 0.451905 0.845808 C\n0.164036 0.282391 0.830151 C\n0.913430 0.899164 0.779405 C\n0.009722 0.570545 0.771595 C\n0.977019 0.226909 0.741999 C\n0.807889 0.514084 0.696004 C\n0.791769 0.343972 0.681903 C\n0.014142 0.054567 0.684900 C\n0.088266 0.748845 0.243847 C\n0.163909 0.282446 0.330124 C\n0.913307 0.899223 0.279410 C\n0.009613 0.570608 0.271580 C\n0.976873 0.226972 0.241982 C\n0.807766 0.514154 0.195994 C\n0.791630 0.344044 0.181892 C\n0.013963 0.054629 0.184883 C\n0.178340 0.451959 0.345780 C\n0.648720 0.895957 0.401863 S\n0.648802 0.895912 0.901820 S\n","nsites":36,"nelements":3,"elements":["H","C","S"],"chemical_system":"C-H-S","density":1.4054488690372555,"density_atomic":0.10278210937851115,"volume":350.25550864522916,"volume_molar":5.8591332639637965,"formula_full":"H16 C18 S2","formula_reduced":"H8C9S","formula_anonymous":"AB8C9","energy_above_hull":5.363739444444444,"spacegroup":1},{"id":"jvasp-96528","created_at":"2022-09-04T14:36:20.071089Z","updated_at":"2022-09-04T14:36:20.071127Z","structure_string":"Mg8 B8 O20\n1.0\n3.122685 0.000000 0.000000\n0.000000 8.941855 -2.376924\n0.000000 0.011838 12.457528\nMg B O\n8 8 20\ndirect\n0.231391 0.147988 0.645130 Mg\n0.768607 0.852012 0.354870 Mg\n0.268608 0.147988 0.145130 Mg\n0.755250 0.397418 0.562664 Mg\n0.244748 0.602582 0.437336 Mg\n0.744748 0.397417 0.062664 Mg\n0.731391 0.852012 0.854870 Mg\n0.255251 0.602582 0.937336 Mg\n0.689183 0.857300 0.591347 B\n0.336513 0.667609 0.690294 B\n0.663485 0.332391 0.309707 B\n0.836512 0.332391 0.809707 B\n0.810815 0.857300 0.091347 B\n0.310816 0.142699 0.408653 B\n0.189184 0.142699 0.908654 B\n0.163486 0.667609 0.190294 B\n0.571879 0.796979 0.681460 O\n0.231455 0.677260 0.797844 O\n0.752577 0.445282 0.902136 O\n0.753238 0.759268 0.988983 O\n0.247422 0.554718 0.097864 O\n0.928119 0.796979 0.181460 O\n0.747421 0.445282 0.402136 O\n0.246761 0.240732 0.011017 O\n0.768218 0.006822 0.113020 O\n0.428120 0.203020 0.318541 O\n0.253238 0.240732 0.511017 O\n0.231781 0.993178 0.886981 O\n0.252577 0.554718 0.597864 O\n0.731780 0.006822 0.613020 O\n0.071879 0.203020 0.818541 O\n0.768543 0.322740 0.202156 O\n0.268219 0.993178 0.386981 O\n0.731454 0.322740 0.702156 O\n0.268544 0.677260 0.297844 O\n0.746760 0.759267 0.488983 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