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            "structure_string": "Sr4 H48 C16 S16 N8 O32\n1.0\n9.039488 0.000000 0.000000\n0.000000 7.868159 0.000000\n0.000000 6.673831 20.266411\nSr H C S N O\n4 48 16 16 8 32\ndirect\n0.214941 0.794893 0.032604 Sr\n0.714941 0.205107 0.467396 Sr\n0.285059 0.794893 0.532604 Sr\n0.785059 0.205107 0.967396 Sr\n0.791123 0.682851 0.606991 H\n0.748655 0.455026 0.109510 H\n0.572310 0.939534 0.282203 H\n0.870589 0.708985 0.362467 H\n0.524644 0.142691 0.168887 H\n0.556552 0.790729 0.365509 H\n0.960550 0.458208 0.203065 H\n0.594760 0.606409 0.231327 H\n0.475356 0.857309 0.831113 H\n0.595408 0.186101 0.692244 H\n0.661243 0.944593 0.821827 H\n0.338757 0.055407 0.178173 H\n0.405240 0.393591 0.768673 H\n0.251345 0.544974 0.890490 H\n0.039450 0.541792 0.796935 H\n0.927690 0.939534 0.782203 H\n0.629411 0.708985 0.862467 H\n0.161243 0.055407 0.678173 H\n0.918394 0.563029 0.570952 H\n0.370589 0.291015 0.137533 H\n0.460550 0.541792 0.296935 H\n0.975356 0.142691 0.668887 H\n0.418394 0.436971 0.929048 H\n0.095408 0.813899 0.807756 H\n0.081606 0.436971 0.429048 H\n0.904592 0.186101 0.192244 H\n0.838757 0.944593 0.321827 H\n0.943448 0.790729 0.865509 H\n0.448277 0.450953 0.229950 H\n0.751345 0.455026 0.609510 H\n0.072310 0.060466 0.217797 H\n0.708877 0.682851 0.106991 H\n0.539450 0.458208 0.703065 H\n0.551723 0.549047 0.770050 H\n0.948277 0.549047 0.270050 H\n0.024644 0.857309 0.331113 H\n0.427690 0.060466 0.717797 H\n0.581606 0.563029 0.070952 H\n0.404592 0.813899 0.307756 H\n0.129411 0.291015 0.637533 H\n0.208877 0.317149 0.393009 H\n0.056552 0.209271 0.134491 H\n0.905240 0.606409 0.731327 H\n0.051723 0.450953 0.729950 H\n0.443448 0.209271 0.634491 H\n0.094760 0.393591 0.268673 H\n0.291123 0.317149 0.893009 H\n0.248655 0.544974 0.390490 H\n0.976364 0.497946 0.761070 C\n0.197825 0.417399 0.418600 C\n0.476364 0.502054 0.738930 C\n0.503124 0.118696 0.676398 C\n0.496876 0.881304 0.323602 C\n0.413987 0.155294 0.146770 C\n0.697825 0.582601 0.081400 C\n0.802175 0.582601 0.581400 C\n0.996876 0.118696 0.176398 C\n0.302175 0.417399 0.918600 C\n0.913987 0.844706 0.353230 C\n0.086013 0.155294 0.646770 C\n0.523636 0.497946 0.261070 C\n0.003124 0.881304 0.823602 C\n0.586013 0.844706 0.853230 C\n0.023636 0.502054 0.238930 C\n0.357571 0.679182 0.695678 S\n0.291626 0.337343 0.495360 S\n0.081681 0.056795 0.848820 S\n0.642429 0.320818 0.304322 S\n0.918319 0.943205 0.151180 S\n0.708374 0.662657 0.504640 S\n0.418319 0.056795 0.348820 S\n0.791626 0.662657 0.004640 S\n0.567348 0.887678 0.929680 S\n0.142429 0.679182 0.195678 S\n0.932652 0.887678 0.429680 S\n0.581681 0.943205 0.651180 S\n0.208374 0.337343 0.995360 S\n0.067348 0.112322 0.570320 S\n0.857571 0.320818 0.804322 S\n0.432652 0.112322 0.070320 S\n0.948428 0.176873 0.862046 N\n0.051572 0.823127 0.137954 N\n0.551572 0.176873 0.362046 N\n0.726156 0.856785 0.966120 N\n0.773844 0.856785 0.466120 N\n0.448428 0.823127 0.637954 N\n0.226156 0.143215 0.533880 N\n0.273844 0.143215 0.033880 N\n0.959166 0.078962 0.415891 O\n0.246648 0.605281 0.157939 O\n0.459166 0.921038 0.084109 O\n0.793425 0.246604 0.755734 O\n0.540834 0.078962 0.915891 O\n0.351322 0.972029 0.413652 O\n0.047995 0.766046 0.466666 O\n0.681718 0.843032 0.703049 O\n0.148678 0.972029 0.913652 O\n0.946011 0.690661 0.018338 O\n0.746648 0.394719 0.342061 O\n0.753352 0.394719 0.842061 O\n0.234843 0.466206 0.031125 O\n0.446011 0.309339 0.481662 O\n0.765157 0.533794 0.968875 O\n0.053989 0.309339 0.981662 O\n0.040834 0.921038 0.584109 O\n0.553989 0.690661 0.518338 O\n0.734843 0.533794 0.468875 O\n0.648678 0.027971 0.586348 O\n0.851322 0.027971 0.086348 O\n0.265157 0.466206 0.531125 O\n0.952005 0.233954 0.533334 O\n0.452005 0.766046 0.966666 O\n0.206575 0.753396 0.244266 O\n0.181718 0.156968 0.796951 O\n0.318282 0.156968 0.296951 O\n0.253352 0.605281 0.657939 O\n0.818282 0.843032 0.203049 O\n0.547995 0.233954 0.033334 O\n0.706575 0.246604 0.255734 O\n0.293425 0.753396 0.744266 O\n",
            "nsites": 124,
            "nelements": 6,
            "elements": [
                "Sr",
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                "S",
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            "chemical_system": "C-H-N-O-S-Sr",
            "density": 1.9907918333472083,
            "density_atomic": 0.08602563344027074,
            "volume": 1441.4308275462522,
            "volume_molar": 7.000402692973239,
            "formula_full": "Sr4 H48 C16 S16 N8 O32",
            "formula_reduced": "SrH12C4S4(NO4)2",
            "formula_anonymous": "AB2C4D4E8F12",
            "energy": -716.6749182599999,
            "energy_per_atom": -5.779636437580645,
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            "energy_uncorrected": -691.80291826,
            "band_gap": 5.7077,
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            "is_magnetic": false,
            "total_magnetization": 0.0,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:52.021000Z",
            "spacegroup": 14
        },
        {
            "id": "mp-1249637",
            "created_at": "2022-09-04T14:39:30.405733Z",
            "structure_string": "Si56 O112\n1.0\n21.351357 -0.000003 8.042831\n-0.000004 13.604129 0.000004\n-0.006182 0.000004 12.573581\nSi O\n56 112\ndirect\n0.071060 0.114787 0.481942 Si\n0.571060 0.614787 0.481943 Si\n0.928940 0.114787 0.518057 Si\n0.428940 0.614788 0.518057 Si\n0.928941 0.883413 0.518050 Si\n0.428941 0.383413 0.518050 Si\n0.071059 0.883413 0.481950 Si\n0.571059 0.383413 0.481951 Si\n0.159238 0.197367 0.249408 Si\n0.659238 0.697366 0.249408 Si\n0.840762 0.197366 0.750592 Si\n0.340762 0.697366 0.750592 Si\n0.840768 0.800829 0.750592 Si\n0.340768 0.300830 0.750592 Si\n0.159232 0.800829 0.249408 Si\n0.659232 0.300829 0.249408 Si\n0.071785 0.114500 0.732085 Si\n0.571785 0.614500 0.732085 Si\n0.928215 0.114501 0.267915 Si\n0.428215 0.614500 0.267915 Si\n0.928215 0.883704 0.267909 Si\n0.428216 0.383704 0.267910 Si\n0.071785 0.883704 0.732090 Si\n0.571785 0.383704 0.732090 Si\n0.288588 0.111962 0.106769 Si\n0.788588 0.611962 0.106769 Si\n0.711412 0.111962 0.893231 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            "chemical_system": "O-Si",
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            "volume": 3652.8819188293996,
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            "formula_full": "Si56 O112",
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            "updated_at": "2021-11-28T01:34:32.159000Z",
            "spacegroup": 12
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    ]
}