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{
"id": "mp-695945",
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"structure_string": "Na8 H16 Ru4 C20 N24 O12\n1.0\n6.329654 0.000000 0.000000\n0.000000 12.133511 0.000000\n0.000000 0.000000 15.887447\nNa H Ru C N O\n8 16 4 20 24 12\ndirect\n0.000000 0.500000 0.746451 Na\n0.500000 0.000000 0.753549 Na\n0.000000 0.500000 0.253549 Na\n0.500000 0.000000 0.246451 Na\n0.500000 0.500000 0.877189 Na\n0.000000 0.000000 0.622811 Na\n0.500000 0.500000 0.122811 Na\n0.000000 0.000000 0.377189 Na\n0.678944 0.300321 0.787033 H\n0.321056 0.699679 0.787033 H\n0.178944 0.199679 0.712967 H\n0.821056 0.800321 0.712967 H\n0.321056 0.699679 0.212967 H\n0.678944 0.300321 0.212967 H\n0.821056 0.800321 0.287033 H\n0.178944 0.199679 0.287033 H\n0.560951 0.382091 0.728120 H\n0.439049 0.617909 0.728120 H\n0.060951 0.117909 0.771880 H\n0.939049 0.882091 0.771880 H\n0.439049 0.617909 0.271880 H\n0.560951 0.382091 0.271880 H\n0.939049 0.882091 0.228120 H\n0.060951 0.117909 0.228120 H\n0.998230 0.219149 0.000000 Ru\n0.001770 0.780851 0.000000 Ru\n0.498230 0.280851 0.500000 Ru\n0.501770 0.719149 0.500000 Ru\n0.741557 0.320700 0.000000 C\n0.258443 0.679300 0.000000 C\n0.241557 0.179300 0.500000 C\n0.758443 0.820700 0.500000 C\n0.111185 0.323370 0.091202 C\n0.888815 0.676630 0.091202 C\n0.611185 0.176630 0.408798 C\n0.388815 0.823370 0.408798 C\n0.888815 0.676630 0.908798 C\n0.111185 0.323370 0.908798 C\n0.388815 0.823370 0.591202 C\n0.611185 0.176630 0.591202 C\n0.839461 0.133735 0.907790 C\n0.160539 0.866265 0.907790 C\n0.339461 0.366265 0.592210 C\n0.660539 0.633735 0.592210 C\n0.160539 0.866265 0.092210 C\n0.839461 0.133735 0.092210 C\n0.660539 0.633735 0.407790 C\n0.339461 0.366265 0.407790 C\n0.233350 0.137802 0.000000 N\n0.766650 0.862198 0.000000 N\n0.733350 0.362198 0.500000 N\n0.266650 0.637802 0.500000 N\n0.594067 0.379030 0.000000 N\n0.405933 0.620970 0.000000 N\n0.094067 0.120970 0.500000 N\n0.905933 0.879030 0.500000 N\n0.170165 0.383518 0.144088 N\n0.829835 0.616482 0.144088 N\n0.670165 0.116482 0.355912 N\n0.329835 0.883518 0.355912 N\n0.829835 0.616482 0.855912 N\n0.170165 0.383518 0.855912 N\n0.329835 0.883518 0.644088 N\n0.670165 0.116482 0.644088 N\n0.744332 0.090042 0.853675 N\n0.255668 0.909958 0.853675 N\n0.244331 0.409958 0.646325 N\n0.755668 0.590042 0.646325 N\n0.255668 0.909958 0.146325 N\n0.744332 0.090042 0.146325 N\n0.755668 0.590042 0.353675 N\n0.244331 0.409958 0.353675 N\n0.393538 0.092617 0.000000 O\n0.606462 0.907383 0.000000 O\n0.893538 0.407383 0.500000 O\n0.106462 0.592617 0.500000 O\n0.673730 0.377807 0.770265 O\n0.326270 0.622193 0.770265 O\n0.173730 0.122193 0.729735 O\n0.826270 0.877807 0.729735 O\n0.326270 0.622193 0.229735 O\n0.673730 0.377807 0.229735 O\n0.826270 0.877807 0.270265 O\n0.173730 0.122193 0.270265 O\n",
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"formula_full": "Na8 H16 Ru4 C20 N24 O12",
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"spacegroup": 58
},
{
"id": "mp-699477",
"created_at": "2022-09-04T14:39:26.167902Z",
"structure_string": "Na4 H24 Ru4 N4 Cl16 O16\n1.0\n15.321118 0.000000 0.000000\n0.000000 8.324806 0.000000\n0.000000 6.534146 11.902289\nNa H Ru N Cl O\n4 24 4 4 16 16\ndirect\n0.101729 0.905225 0.884833 Na\n0.398271 0.905225 0.384833 Na\n0.898271 0.094775 0.115167 Na\n0.601729 0.094775 0.615167 Na\n0.310981 0.768191 0.719830 H\n0.189019 0.768191 0.219830 H\n0.689019 0.231809 0.280170 H\n0.810981 0.231809 0.780170 H\n0.699512 0.229153 0.902778 H\n0.800488 0.229153 0.402778 H\n0.300488 0.770847 0.097222 H\n0.199512 0.770847 0.597222 H\n0.703640 0.145324 0.895994 H\n0.796360 0.145324 0.395994 H\n0.296360 0.854676 0.104006 H\n0.203640 0.854676 0.604006 H\n0.965463 0.535836 0.793252 H\n0.534537 0.535836 0.293252 H\n0.034537 0.464164 0.206748 H\n0.465463 0.464164 0.706748 H\n0.746166 0.782609 0.784207 H\n0.753834 0.782609 0.284207 H\n0.253834 0.217391 0.215793 H\n0.246166 0.217391 0.715793 H\n0.500921 0.973751 0.983890 H\n0.999079 0.973751 0.483890 H\n0.499079 0.026249 0.016110 H\n0.000921 0.026249 0.516110 H\n0.886476 0.350829 0.701032 Ru\n0.613524 0.350829 0.201032 Ru\n0.113524 0.649171 0.298968 Ru\n0.386476 0.649171 0.798968 Ru\n0.968934 0.182487 0.697052 N\n0.531066 0.182487 0.197052 N\n0.031066 0.817513 0.302948 N\n0.468934 0.817513 0.802948 N\n0.937430 0.265694 0.892021 Cl\n0.562570 0.265694 0.392021 Cl\n0.062570 0.734306 0.107979 Cl\n0.437430 0.734306 0.607979 Cl\n0.765118 0.951861 0.717196 Cl\n0.734882 0.951861 0.217196 Cl\n0.234882 0.048139 0.282804 Cl\n0.265118 0.048139 0.782804 Cl\n0.796830 0.416732 0.550846 Cl\n0.703170 0.416732 0.050846 Cl\n0.203170 0.583268 0.449154 Cl\n0.296830 0.583268 0.949154 Cl\n0.959248 0.667532 0.687092 Cl\n0.540752 0.667532 0.187092 Cl\n0.040752 0.332468 0.312908 Cl\n0.459248 0.332468 0.812908 Cl\n0.149583 0.217953 0.915168 O\n0.350417 0.217953 0.415168 O\n0.850417 0.782047 0.084832 O\n0.649583 0.782047 0.584832 O\n0.013179 0.262776 0.608841 O\n0.486821 0.262776 0.108841 O\n0.986821 0.737224 0.391159 O\n0.513179 0.737224 0.891159 O\n0.125692 0.296664 0.968327 O\n0.374308 0.296664 0.468327 O\n0.874308 0.703336 0.031673 O\n0.625692 0.703336 0.531673 O\n0.515061 0.020854 0.272730 O\n0.984939 0.020854 0.772730 O\n0.484939 0.979146 0.727270 O\n0.015061 0.979146 0.227270 O\n",
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"formula_full": "Na4 H24 Ru4 N4 Cl16 O16",
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{
"id": "mp-720279",
"created_at": "2022-09-04T14:41:05.724664Z",
"structure_string": "Na8 H40 Ru2 S8 N4 O36\n1.0\n6.588526 0.000000 0.000000\n0.000000 9.772265 0.000000\n0.000000 3.668046 16.001699\nNa H Ru S N O\n8 40 2 8 4 36\ndirect\n0.098753 0.966369 0.730820 Na\n0.598753 0.033631 0.769180 Na\n0.901247 0.033631 0.269180 Na\n0.401247 0.966369 0.230820 Na\n0.809906 0.395500 0.801828 Na\n0.309906 0.604500 0.698172 Na\n0.190094 0.604500 0.198172 Na\n0.690094 0.395500 0.301828 Na\n0.859908 0.082044 0.545624 H\n0.359908 0.917956 0.954376 H\n0.140092 0.917956 0.454376 H\n0.640092 0.082044 0.045624 H\n0.783408 0.209935 0.468130 H\n0.283408 0.790065 0.031870 H\n0.216592 0.790065 0.531870 H\n0.716592 0.209935 0.968130 H\n0.871549 0.058757 0.448462 H\n0.371549 0.941243 0.051538 H\n0.128451 0.941243 0.551538 H\n0.628451 0.058757 0.948462 H\n0.672554 0.694973 0.547400 H\n0.172554 0.305027 0.952600 H\n0.327446 0.305027 0.452600 H\n0.827446 0.694973 0.047400 H\n0.862378 0.662720 0.705418 H\n0.362378 0.337280 0.794582 H\n0.137622 0.337280 0.294582 H\n0.637622 0.662720 0.205418 H\n0.955246 0.676301 0.792089 H\n0.455246 0.323699 0.707911 H\n0.044754 0.323699 0.207911 H\n0.544754 0.676301 0.292089 H\n0.008179 0.289672 0.590234 H\n0.508179 0.710328 0.909766 H\n0.991821 0.710328 0.409766 H\n0.491821 0.289672 0.090234 H\n0.932047 0.350104 0.661359 H\n0.432047 0.649896 0.838641 H\n0.067953 0.649896 0.338641 H\n0.567953 0.350104 0.161359 H\n0.891792 0.398692 0.976978 H\n0.391792 0.601308 0.523022 H\n0.108208 0.601308 0.023022 H\n0.608208 0.398692 0.476978 H\n0.686025 0.478704 0.949512 H\n0.186025 0.521296 0.550488 H\n0.313975 0.521296 0.050488 H\n0.813975 0.478704 0.449512 H\n0.500000 0.000000 0.500000 Ru\n0.000000 0.000000 0.000000 Ru\n0.597259 0.864772 0.633629 S\n0.097259 0.135228 0.866371 S\n0.402741 0.135228 0.366371 S\n0.902741 0.864772 0.133629 S\n0.630405 0.840969 0.425892 S\n0.130405 0.159031 0.074108 S\n0.369595 0.159031 0.574108 S\n0.869595 0.840969 0.925892 S\n0.787757 0.102090 0.488898 N\n0.287757 0.897910 0.011102 N\n0.212243 0.897910 0.511102 N\n0.712243 0.102090 0.988898 N\n0.772754 0.930839 0.669054 O\n0.272754 0.069161 0.830946 O\n0.227246 0.069161 0.330946 O\n0.727246 0.930839 0.169054 O\n0.423360 0.844089 0.696568 O\n0.923360 0.155911 0.803432 O\n0.576640 0.155911 0.303432 O\n0.076640 0.844089 0.196568 O\n0.665637 0.712909 0.632905 O\n0.165637 0.287091 0.867095 O\n0.334363 0.287091 0.367095 O\n0.834363 0.712909 0.132905 O\n0.649212 0.685427 0.485240 O\n0.149212 0.314573 0.014760 O\n0.350788 0.314573 0.514760 O\n0.850788 0.685427 0.985240 O\n0.510241 0.811889 0.354892 O\n0.010241 0.188111 0.145108 O\n0.489759 0.188111 0.645108 O\n0.989759 0.811889 0.854892 O\n0.845374 0.878143 0.398250 O\n0.345374 0.121857 0.101750 O\n0.154626 0.121857 0.601750 O\n0.654626 0.878143 0.898250 O\n0.964130 0.619963 0.748895 O\n0.464130 0.380037 0.751105 O\n0.035870 0.380037 0.251105 O\n0.535870 0.619963 0.248895 O\n0.946254 0.375992 0.600776 O\n0.446254 0.624008 0.899224 O\n0.053746 0.624008 0.399224 O\n0.553746 0.375992 0.100776 O\n0.777409 0.406379 0.937747 O\n0.277409 0.593621 0.562253 O\n0.222591 0.593621 0.062253 O\n0.722591 0.406379 0.437747 O\n",
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{
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"structure_string": "Na4 In4 B4 P8 H4 O36\n1.0\n17.067686 0.000000 0.000000\n0.000000 5.257783 0.000000\n0.000000 4.795447 7.897595\nNa In B P H O\n4 4 4 8 4 36\ndirect\n0.661169 0.983217 0.661275 Na\n0.838831 0.983217 0.161275 Na\n0.338831 0.016783 0.338725 Na\n0.161169 0.016783 0.838725 Na\n0.655795 0.484312 0.193914 In\n0.844205 0.484312 0.693914 In\n0.344205 0.515688 0.806086 In\n0.155795 0.515688 0.306086 In\n0.528600 0.341249 0.748921 B\n0.971400 0.341249 0.248921 B\n0.471400 0.658751 0.251079 B\n0.028600 0.658751 0.751079 B\n0.669966 0.231733 0.918339 P\n0.830034 0.231733 0.418339 P\n0.330034 0.768267 0.081661 P\n0.169966 0.768267 0.581661 P\n0.587621 0.744384 0.427023 P\n0.912379 0.744384 0.927023 P\n0.412379 0.255616 0.572977 P\n0.087621 0.255616 0.072977 P\n0.496672 0.546099 0.078699 H\n0.003328 0.546099 0.578699 H\n0.503328 0.453901 0.921301 H\n0.996672 0.453901 0.421301 H\n0.651318 0.474105 0.962341 O\n0.848682 0.474105 0.462341 O\n0.348682 0.525895 0.037659 O\n0.151318 0.525895 0.537659 O\n0.592106 0.147368 0.858844 O\n0.907894 0.147368 0.358844 O\n0.407894 0.852632 0.141156 O\n0.092106 0.852632 0.641156 O\n0.526861 0.590105 0.151785 O\n0.973139 0.590105 0.651785 O\n0.473139 0.409895 0.848215 O\n0.026861 0.409895 0.348215 O\n0.511900 0.828600 0.313153 O\n0.988100 0.828600 0.813153 O\n0.488100 0.171400 0.686847 O\n0.011900 0.171400 0.186847 O\n0.561209 0.630308 0.613684 O\n0.938791 0.630308 0.113684 O\n0.438791 0.369692 0.386316 O\n0.061209 0.369692 0.886316 O\n0.724867 0.355164 0.764951 O\n0.775133 0.355164 0.264951 O\n0.275133 0.644836 0.235049 O\n0.224867 0.644836 0.735049 O\n0.699613 0.940939 0.073461 O\n0.800387 0.940939 0.573461 O\n0.300387 0.059061 0.926539 O\n0.199613 0.059061 0.426539 O\n0.633333 0.500216 0.420614 O\n0.866667 0.500216 0.920614 O\n0.366667 0.499784 0.579386 O\n0.133333 0.499784 0.079386 O\n0.633393 0.025337 0.375793 O\n0.866607 0.025337 0.875793 O\n0.366607 0.974663 0.624207 O\n0.133393 0.974663 0.124207 O\n",
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},
{
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{
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{
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}