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{
"id": "mp-863354",
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{
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"structure_string": "Co4 Sn4 O12\n1.0\n5.394922 0.000000 0.000000\n0.000000 5.422766 0.000000\n0.000000 0.000000 7.810530\nCo Sn O\n4 4 12\ndirect\n0.027422 0.013487 0.750000 Co\n0.527422 0.486513 0.750000 Co\n0.472578 0.513487 0.250000 Co\n0.972578 0.986513 0.250000 Co\n0.500000 0.000000 0.000000 Sn\n0.500000 0.000000 0.500000 Sn\n0.000000 0.500000 0.000000 Sn\n0.000000 0.500000 0.500000 Sn\n0.593919 0.875068 0.250000 O\n0.831827 0.834778 0.566755 O\n0.831827 0.834778 0.933245 O\n0.331827 0.665222 0.566755 O\n0.331827 0.665222 0.933245 O\n0.093919 0.624932 0.250000 O\n0.906081 0.375068 0.750000 O\n0.668173 0.334778 0.066755 O\n0.668173 0.334778 0.433245 O\n0.168173 0.165222 0.066755 O\n0.168173 0.165222 0.433245 O\n0.406081 0.124932 0.750000 O\n",
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"formula_full": "Co4 Sn4 O12",
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{
"id": "mp-761574",
"created_at": "2022-09-04T14:44:56.579345Z",
"structure_string": "Co4 Sn4 O12\n1.0\n2.450566 -4.766873 -0.000180\n5.666757 -0.099325 -0.067878\n-2.450843 -1.260440 8.861649\nCo Sn O\n4 4 12\ndirect\n0.961909 0.076292 0.679264 Co\n0.038089 0.923715 0.320741 Co\n0.461917 0.076287 0.179252 Co\n0.538084 0.923713 0.820746 Co\n0.778925 0.442187 0.073680 Sn\n0.278915 0.442181 0.573664 Sn\n0.721091 0.557816 0.426328 Sn\n0.221072 0.557819 0.926328 Sn\n0.019229 0.254036 0.224031 O\n0.519235 0.254059 0.724022 O\n0.572484 0.253965 0.378369 O\n0.072460 0.253961 0.878361 O\n0.972646 0.746060 0.475468 O\n0.472635 0.746023 0.975477 O\n0.527363 0.253984 0.024526 O\n0.027354 0.253948 0.524531 O\n0.927547 0.746023 0.121633 O\n0.427519 0.746035 0.621628 O\n0.480764 0.745936 0.275982 O\n0.980760 0.745962 0.775968 O\n",
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{
"id": "mp-1247093",
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"structure_string": "Co4 Sn4 N8\n1.0\n5.674319 0.000000 0.000000\n0.000000 6.763164 0.000000\n0.000000 0.000000 5.518925\nCo Sn N\n4 4 8\ndirect\n0.570597 0.872554 0.997593 Co\n0.429403 0.127446 0.497593 Co\n0.929403 0.372554 0.497593 Co\n0.070597 0.627446 0.997593 Co\n0.587315 0.372135 0.003793 Sn\n0.412685 0.627865 0.503793 Sn\n0.912685 0.872135 0.503793 Sn\n0.087315 0.127865 0.003793 Sn\n0.608161 0.352382 0.410079 N\n0.391839 0.647618 0.910079 N\n0.891839 0.852382 0.910079 N\n0.108161 0.147618 0.410079 N\n0.562307 0.905539 0.338536 N\n0.437693 0.094461 0.838536 N\n0.937693 0.405539 0.838536 N\n0.062307 0.594461 0.338536 N\n",
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{
"id": "mp-1205069",
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"structure_string": "Co4 Sn4 N24 Cl20\n1.0\n23.718207 0.000000 0.000000\n0.000000 8.290148 0.000000\n0.000000 1.347217 8.755661\nCo Sn N Cl\n4 4 24 20\ndirect\n0.093759 0.072243 0.652644 Co\n0.593759 0.927757 0.847356 Co\n0.906241 0.927757 0.347356 Co\n0.406241 0.072243 0.152644 Co\n0.393943 0.656933 0.687391 Sn\n0.893943 0.343067 0.812609 Sn\n0.606057 0.343067 0.312609 Sn\n0.106057 0.656933 0.187391 Sn\n0.095927 0.115315 0.440433 N\n0.595927 0.884685 0.059567 N\n0.904073 0.884685 0.559567 N\n0.404073 0.115315 0.940433 N\n0.181526 0.341047 0.856514 N\n0.681526 0.658953 0.643486 N\n0.818474 0.658953 0.143486 N\n0.318474 0.341047 0.356514 N\n0.072151 0.238773 0.717453 N\n0.572151 0.761227 0.782547 N\n0.927849 0.761227 0.282547 N\n0.427849 0.238773 0.217453 N\n0.200004 0.388322 0.742807 N\n0.700004 0.611678 0.757193 N\n0.799996 0.611678 0.257193 N\n0.299996 0.388322 0.242807 N\n0.157706 0.026752 0.701576 N\n0.657706 0.973248 0.798424 N\n0.842294 0.973248 0.298424 N\n0.342294 0.026752 0.201576 N\n0.049656 0.924668 0.692752 N\n0.549656 0.075332 0.807248 N\n0.950344 0.075332 0.307248 N\n0.450344 0.924668 0.192752 N\n0.378664 0.633009 0.948435 Cl\n0.878664 0.366991 0.551565 Cl\n0.621336 0.366991 0.051565 Cl\n0.121336 0.633009 0.448435 Cl\n0.438873 0.902684 0.607719 Cl\n0.938873 0.097316 0.892281 Cl\n0.561127 0.097316 0.392281 Cl\n0.061127 0.902684 0.107719 Cl\n0.446969 0.438183 0.635449 Cl\n0.946969 0.561817 0.864551 Cl\n0.553031 0.561817 0.364551 Cl\n0.053031 0.438183 0.135449 Cl\n0.192066 0.659153 0.063207 Cl\n0.692066 0.340847 0.436793 Cl\n0.807934 0.340847 0.936793 Cl\n0.307934 0.659153 0.563207 Cl\n0.345542 0.193357 0.863621 Cl\n0.845542 0.806643 0.636379 Cl\n0.654458 0.806643 0.136379 Cl\n0.154458 0.193357 0.363621 Cl\n",
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"formula_full": "Co4 Sn4 N24 Cl20",
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{
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"structure_string": "Co4 Sn2 O8\n1.0\n-3.043619 3.152567 4.392038\n3.043619 -3.152567 4.392038\n3.043619 3.152567 -4.392038\nCo Sn O\n4 2 8\ndirect\n0.111806 0.861806 0.250000 Co\n0.888194 0.138194 0.750000 Co\n0.500000 0.000000 0.000000 Co\n0.500000 0.500000 0.500000 Co\n0.000000 0.500000 0.500000 Sn\n0.500000 0.500000 0.000000 Sn\n0.748258 0.265026 0.016768 O\n0.748258 0.731490 0.483232 O\n0.746636 0.264741 0.481895 O\n0.282846 0.264741 0.018105 O\n0.717154 0.735259 0.981895 O\n0.253364 0.735259 0.518105 O\n0.251742 0.268510 0.516768 O\n0.251742 0.734974 0.983232 O\n",
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{
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"structure_string": "Co4 Sn2\n1.0\n2.136345 -3.700259 0.000000\n2.136345 3.700259 0.000000\n0.000000 0.000000 5.233852\nCo Sn\n4 2\ndirect\n0.333333 0.666667 0.750000 Co\n0.000000 0.000000 0.000000 Co\n0.000000 0.000000 0.500000 Co\n0.666667 0.333333 0.250000 Co\n0.666667 0.333333 0.750000 Sn\n0.333333 0.666667 0.250000 Sn\n",
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{
"id": "mp-15868",
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"structure_string": "Co4 Sn1 Sb12\n1.0\n-4.598845 4.598845 4.598845\n4.598845 -4.598845 4.598845\n4.598845 4.598845 -4.598845\nCo Sn Sb\n4 1 12\ndirect\n0.500000 0.000000 0.000000 Co\n0.000000 0.000000 0.500000 Co\n0.000000 0.500000 0.000000 Co\n0.500000 0.500000 0.500000 Co\n0.000000 0.000000 0.000000 Sn\n0.840302 0.171830 0.331527 Sb\n0.668473 0.159698 0.828170 Sb\n0.508775 0.668473 0.840302 Sb\n0.668473 0.840302 0.508775 Sb\n0.491225 0.331527 0.159698 Sb\n0.331527 0.840302 0.171830 Sb\n0.171830 0.331527 0.840302 Sb\n0.828170 0.668473 0.159698 Sb\n0.331527 0.159698 0.491225 Sb\n0.840302 0.508775 0.668473 Sb\n0.159698 0.491225 0.331527 Sb\n0.159698 0.828170 0.668473 Sb\n",
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"formula_full": "Co4 Sn1 Sb12",
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{
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{
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"structure_string": "Co4 Si4 W4\n1.0\n2.425296 -4.048247 0.000000\n2.425296 4.048247 0.000000\n0.000000 0.000000 7.577910\nCo Si W\n4 4 4\ndirect\n0.832085 0.167915 0.000000 Co\n0.829089 0.648999 0.000000 Co\n0.351001 0.170911 0.000000 Co\n0.146384 0.853616 0.500000 Co\n0.161486 0.356207 0.500000 Si\n0.643793 0.838514 0.500000 Si\n0.010051 0.989949 0.231380 Si\n0.010051 0.989949 0.768620 Si\n0.667941 0.332059 0.689278 W\n0.339969 0.660031 0.818716 W\n0.339969 0.660031 0.181284 W\n0.667941 0.332059 0.310722 W\n",
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{
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}