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{
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"structure_string": "Sr4 Re12 S22\n1.0\n10.973143 -4.579092 0.000000\n10.973143 4.579092 0.000000\n9.062287 0.000000 7.697590\nSr Re S\n4 12 22\ndirect\n0.689351 0.689351 0.689351 Sr\n0.189351 0.189351 0.189351 Sr\n0.310649 0.310649 0.310649 Sr\n0.810649 0.810649 0.810649 Sr\n0.616374 0.493722 0.287307 Re\n0.287307 0.616374 0.493722 Re\n0.493722 0.287307 0.616374 Re\n0.787307 0.993722 0.116374 Re\n0.116374 0.787307 0.993722 Re\n0.993722 0.116374 0.787307 Re\n0.383626 0.506278 0.712693 Re\n0.712693 0.383626 0.506278 Re\n0.506278 0.712693 0.383626 Re\n0.212693 0.006278 0.883626 Re\n0.883626 0.212693 0.006278 Re\n0.006278 0.883626 0.212693 Re\n0.799004 0.191901 0.418130 S\n0.418130 0.799004 0.191901 S\n0.191901 0.418130 0.799004 S\n0.918130 0.691901 0.299004 S\n0.299004 0.918130 0.691901 S\n0.691901 0.299004 0.918130 S\n0.200996 0.808099 0.581870 S\n0.581870 0.200996 0.808099 S\n0.808099 0.581870 0.200996 S\n0.081870 0.308099 0.700996 S\n0.700996 0.081870 0.308099 S\n0.308099 0.700996 0.081870 S\n0.503475 0.996525 0.250000 S\n0.250000 0.503475 0.996525 S\n0.996525 0.250000 0.503475 S\n0.750000 0.496525 0.003475 S\n0.003475 0.750000 0.496525 S\n0.496525 0.003475 0.750000 S\n0.407934 0.407934 0.407934 S\n0.907934 0.907934 0.907934 S\n0.592066 0.592066 0.592066 S\n0.092066 0.092066 0.092066 S\n",
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{
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"structure_string": "Sr4 Re4 N12\n1.0\n5.265209 5.557458 0.000000\n-5.265209 5.557458 0.000000\n0.000000 1.890732 5.997317\nSr Re N\n4 4 12\ndirect\n0.313564 0.686436 0.250000 Sr\n0.907988 0.092012 0.250000 Sr\n0.092012 0.907988 0.750000 Sr\n0.686436 0.313564 0.750000 Sr\n0.795876 0.624831 0.253497 Re\n0.375169 0.204124 0.246503 Re\n0.624831 0.795876 0.753497 Re\n0.204124 0.375169 0.746503 Re\n0.767880 0.985718 0.666221 N\n0.132462 0.596796 0.667859 N\n0.330301 0.358000 0.983065 N\n0.596796 0.132462 0.167859 N\n0.867538 0.403204 0.332141 N\n0.232120 0.014282 0.333779 N\n0.985718 0.767880 0.166221 N\n0.358000 0.330301 0.483065 N\n0.642000 0.669699 0.516935 N\n0.014282 0.232120 0.833779 N\n0.403204 0.867538 0.832141 N\n0.669699 0.642000 0.016935 N\n",
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"formula_full": "Sr4 Re4 N12",
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{
"id": "mp-1245971",
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"structure_string": "Sr4 Re4 N8\n1.0\n6.916777 0.000000 0.361631\n0.000000 7.410090 0.000000\n-2.152942 0.000000 4.665133\nSr Re N\n4 4 8\ndirect\n0.330396 0.911240 0.665216 Sr\n0.669604 0.411240 0.834784 Sr\n0.669604 0.088760 0.334784 Sr\n0.330396 0.588760 0.165216 Sr\n0.140465 0.343474 0.570267 Re\n0.859535 0.843474 0.929733 Re\n0.859535 0.656526 0.429733 Re\n0.140465 0.156526 0.070267 Re\n0.179931 0.904168 0.089980 N\n0.820069 0.404168 0.410020 N\n0.820069 0.095832 0.910020 N\n0.179931 0.595832 0.589980 N\n0.346065 0.249909 0.922958 N\n0.653935 0.749909 0.577042 N\n0.653935 0.750091 0.077042 N\n0.346065 0.250091 0.422958 N\n",
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"formula_full": "Sr4 Re4 N8",
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"updated_at": "2021-11-28T01:35:19.632000Z",
"spacegroup": 64
},
{
"id": "mp-1208656",
"created_at": "2022-09-04T14:45:07.895470Z",
"structure_string": "Sr4 Re4 O8\n1.0\n-3.120250 3.120250 6.112571\n3.120250 -3.120250 6.112571\n3.120250 3.120250 -6.112571\nSr Re O\n4 4 8\ndirect\n0.875000 0.625000 0.250000 Sr\n0.375000 0.625000 0.750000 Sr\n0.375000 0.625000 0.250000 Sr\n0.375000 0.125000 0.750000 Sr\n0.375000 0.125000 0.250000 Re\n0.875000 0.125000 0.750000 Re\n0.875000 0.125000 0.250000 Re\n0.875000 0.625000 0.750000 Re\n0.174502 0.373183 0.198682 O\n0.174502 0.975820 0.801318 O\n0.123183 0.424502 0.698682 O\n0.575498 0.876817 0.301318 O\n0.725820 0.424502 0.301318 O\n0.575498 0.274180 0.698682 O\n0.626817 0.825498 0.801318 O\n0.024180 0.825498 0.198682 O\n",
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"formula_full": "Sr4 Re4 O8",
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{
"id": "mp-745984",
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"structure_string": "Sr4 Re8 H32 C6 N12 O42\n1.0\n0.000000 9.900504 17.482810\n3.920362 0.000000 17.482810\n3.920362 9.900504 0.000000\nSr Re H C N O\n4 8 32 6 12 42\ndirect\n0.734705 0.257506 0.468361 Sr\n0.781639 0.710572 0.515295 Sr\n0.992494 0.515295 0.710572 Sr\n0.539428 0.468361 0.257506 Sr\n0.521128 0.793096 0.501567 Re\n0.162513 0.290106 0.972742 Re\n0.277258 0.675360 0.087487 Re\n0.748433 0.065791 0.728872 Re\n0.456904 0.728872 0.065791 Re\n0.959894 0.087487 0.675360 Re\n0.574640 0.972742 0.290106 Re\n0.184209 0.501567 0.793096 Re\n0.098916 0.966051 0.916197 H\n0.320667 0.795127 0.700177 H\n0.775663 0.961480 0.292549 H\n0.117406 0.121633 0.038378 H\n0.662611 0.496258 0.507684 H\n0.775848 0.032714 0.395976 H\n0.594684 0.037029 0.594271 H\n0.080943 0.066045 0.141122 H\n0.108878 0.538110 0.169057 H\n0.655729 0.475984 0.655316 H\n0.854024 0.454538 0.474152 H\n0.742316 0.916553 0.587389 H\n0.211622 0.527417 0.132594 H\n0.957451 0.279692 0.474337 H\n0.549823 0.065970 0.929333 H\n0.333803 0.231165 0.151084 H\n0.283949 0.151084 0.231165 H\n0.454873 0.929333 0.065970 H\n0.288520 0.474337 0.279692 H\n0.128367 0.132594 0.527417 H\n0.753742 0.587389 0.916553 H\n0.217286 0.474152 0.454538 H\n0.212971 0.655316 0.475984 H\n0.183955 0.169057 0.538110 H\n0.711890 0.141122 0.066045 H\n0.774016 0.594271 0.037029 H\n0.795462 0.395976 0.032714 H\n0.333447 0.507684 0.496258 H\n0.722583 0.038378 0.121633 H\n0.970308 0.292549 0.961480 H\n0.184030 0.700177 0.795127 H\n0.018835 0.916197 0.966051 H\n0.921912 0.236174 0.100425 C\n0.149575 0.508512 0.328088 C\n0.526605 0.973395 0.973395 C\n0.013826 0.328088 0.508512 C\n0.741488 0.100425 0.236174 C\n0.276605 0.723395 0.723395 C\n0.226782 0.838689 0.784584 N\n0.763547 0.027705 0.316220 N\n0.059348 0.122979 0.081486 N\n0.168514 0.513813 0.190652 N\n0.933780 0.357472 0.486453 N\n0.465416 0.100056 0.023218 N\n0.411311 0.023218 0.100056 N\n0.222295 0.486453 0.357472 N\n0.127021 0.190652 0.513813 N\n0.736187 0.081486 0.122979 N\n0.892528 0.316220 0.027705 N\n0.149944 0.784584 0.838689 N\n0.828872 0.259983 0.178046 O\n0.991990 0.679034 0.036071 O\n0.513974 0.701144 0.521357 O\n0.646579 0.868210 0.385714 O\n0.360075 0.286361 0.740125 O\n0.065739 0.289600 0.072368 O\n0.658746 0.698653 0.522865 O\n0.407108 0.060086 0.803993 O\n0.071926 0.429925 0.153748 O\n0.721655 0.406790 0.527576 O\n0.722424 0.906021 0.528345 O\n0.096252 0.905599 0.178074 O\n0.446007 0.521187 0.842892 O\n0.727135 0.130264 0.591254 O\n0.177632 0.677707 0.184261 O\n0.509875 0.636561 0.889925 O\n0.864286 0.150503 0.603421 O\n0.728643 0.986475 0.736026 O\n0.213929 0.957094 0.258010 O\n0.071954 0.516901 0.421128 O\n0.690151 0.809849 0.809849 O\n0.990017 0.421128 0.516901 O\n0.570966 0.258010 0.957094 O\n0.548856 0.736026 0.986475 O\n0.381790 0.603421 0.150503 O\n0.963639 0.889925 0.636561 O\n0.960400 0.184261 0.677707 O\n0.551347 0.591254 0.130264 O\n0.189914 0.842892 0.521187 O\n0.820075 0.178074 0.905599 O\n0.843210 0.528345 0.906021 O\n0.343979 0.527576 0.406790 O\n0.344401 0.153748 0.429925 O\n0.728813 0.803993 0.060086 O\n0.119736 0.522865 0.698653 O\n0.572293 0.072368 0.289600 O\n0.613439 0.740125 0.286361 O\n0.099497 0.385714 0.868210 O\n0.263525 0.521357 0.701144 O\n0.292906 0.036071 0.679034 O\n0.733099 0.178046 0.259983 O\n0.440151 0.559849 0.559849 O\n",
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"formula_full": "Sr4 Re8 H32 C6 N12 O42",
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{
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"structure_string": "Sr4 Re8 H32 C6 N12 O42\n1.0\n9.844026 17.389125 0.023732\n-0.009823 17.399954 3.918063\n9.860987 -0.004209 3.912294\nSr Re H C N O\n4 8 32 6 12 42\ndirect\n0.255627 0.735875 0.541729 Sr\n0.466479 0.541733 0.734147 Sr\n0.707362 0.785339 0.995375 Sr\n0.512956 0.995193 0.785083 Sr\n0.674848 0.276717 0.959519 Re\n0.087591 0.958436 0.277602 Re\n0.288112 0.164143 0.575830 Re\n0.972054 0.574367 0.165749 Re\n0.067150 0.747590 0.455181 Re\n0.732512 0.453596 0.744597 Re\n0.796351 0.518943 0.183059 Re\n0.502827 0.183940 0.518151 Re\n0.921125 0.014345 0.096544 H\n0.966854 0.099925 0.014908 H\n0.153421 0.282411 0.332199 H\n0.233827 0.331196 0.284810 H\n0.703348 0.180745 0.318358 H\n0.797824 0.319504 0.183335 H\n0.930207 0.453132 0.545402 H\n0.069672 0.546897 0.456069 H\n0.033608 0.726740 0.120671 H\n0.121956 0.117845 0.719635 H\n0.128246 0.133670 0.212749 H\n0.523061 0.216745 0.133432 H\n0.135932 0.716508 0.086662 H\n0.059766 0.087227 0.715187 H\n0.164462 0.190861 0.113449 H\n0.533932 0.113123 0.188248 H\n0.958471 0.778313 0.971067 H\n0.296832 0.967597 0.770948 H\n0.279708 0.957237 0.291564 H\n0.476428 0.288839 0.954550 H\n0.024167 0.784809 0.800510 H\n0.389787 0.801982 0.783085 H\n0.455072 0.854262 0.218652 H\n0.473190 0.220293 0.853396 H\n0.470759 0.659066 0.215721 H\n0.651288 0.217970 0.658085 H\n0.032596 0.599714 0.780775 H\n0.593278 0.776685 0.594774 H\n0.497363 0.660717 0.331251 H\n0.503481 0.337944 0.665315 H\n0.914270 0.745026 0.757786 H\n0.581534 0.758505 0.745602 H\n0.725067 0.275374 0.273822 C\n0.973745 0.526142 0.527510 C\n0.102101 0.739492 0.919860 C\n0.235806 0.922713 0.739936 C\n0.329066 0.012871 0.148582 C\n0.508968 0.150684 0.013039 C\n0.789262 0.145690 0.225310 N\n0.837713 0.228677 0.146018 N\n0.022875 0.411720 0.463138 N\n0.102985 0.462714 0.413505 N\n0.084714 0.732047 0.056724 N\n0.125786 0.057398 0.729906 N\n0.196377 0.121358 0.159635 N\n0.515433 0.167876 0.126467 N\n0.029284 0.761242 0.889828 N\n0.318058 0.891659 0.760470 N\n0.354776 0.937084 0.226879 N\n0.486601 0.224035 0.933053 N\n0.517450 0.448291 0.191404 O\n0.841613 0.189648 0.443919 O\n0.056417 0.409915 0.731985 O\n0.802116 0.731063 0.411318 O\n0.606509 0.377913 0.859525 O\n0.146024 0.867512 0.387132 O\n0.384262 0.101082 0.647692 O\n0.865752 0.648863 0.103237 O\n0.904488 0.097153 0.822603 O\n0.180946 0.814927 0.096579 O\n0.426816 0.075490 0.345336 O\n0.150990 0.344390 0.077001 O\n0.681518 0.172817 0.957499 O\n0.186779 0.956810 0.175827 O\n0.288256 0.066428 0.572918 O\n0.076267 0.567375 0.065428 O\n0.128332 0.728958 0.553687 O\n0.592561 0.550107 0.725067 O\n0.697800 0.659428 0.121293 O\n0.525872 0.118985 0.655911 O\n0.890647 0.963139 0.506495 O\n0.642724 0.503528 0.959133 O\n0.748831 0.607662 0.355270 O\n0.286850 0.358621 0.611760 O\n0.262162 0.568529 0.211457 O\n0.961827 0.209855 0.564743 O\n0.039958 0.291194 0.986442 O\n0.681174 0.990414 0.289330 O\n0.988893 0.726156 0.546089 O\n0.738821 0.546802 0.726489 O\n0.704869 0.510666 0.264725 O\n0.519370 0.267025 0.510553 O\n0.560498 0.439457 0.437820 O\n0.809427 0.690110 0.691607 O\n0.179537 0.731584 0.827428 O\n0.255675 0.832865 0.736165 O\n0.423249 0.988099 0.069922 O\n0.518057 0.072205 0.988336 O\n0.403453 0.725192 0.345773 O\n0.521540 0.349536 0.727035 O\n0.901165 0.728511 0.850207 O\n0.522383 0.848216 0.725516 O\n",
"nsites": 104,
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"elements": [
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"formula_full": "Sr4 Re8 H32 C6 N12 O42",
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"spacegroup": 1
},
{
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{
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}