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            "structure_string": "Zr2 Cl8 O32\n1.0\n4.323575 7.050971 0.000000\n-4.323575 7.050971 0.000000\n0.000000 4.167374 13.235474\nZr Cl O\n2 8 32\ndirect\n0.650088 0.636331 0.899507 Zr\n0.636331 0.650088 0.399507 Zr\n0.996490 0.255307 0.139582 Cl\n0.209921 0.606539 0.963247 Cl\n0.022123 0.599161 0.316327 Cl\n0.599161 0.022123 0.816327 Cl\n0.606539 0.209921 0.463247 Cl\n0.445977 0.938435 0.241401 Cl\n0.255307 0.996490 0.639582 Cl\n0.938435 0.445977 0.741401 Cl\n0.899325 0.581026 0.261366 O\n0.965669 0.539622 0.639312 O\n0.175317 0.428306 0.337453 O\n0.715176 0.238191 0.966406 O\n0.947675 0.548790 0.817871 O\n0.660928 0.392632 0.414394 O\n0.238191 0.715176 0.466406 O\n0.165875 0.010197 0.743407 O\n0.747994 0.071300 0.767260 O\n0.428306 0.175317 0.837453 O\n0.782077 0.060137 0.482257 O\n0.145668 0.760736 0.545793 O\n0.139968 0.119408 0.565087 O\n0.581026 0.899325 0.761366 O\n0.010197 0.165875 0.243407 O\n0.071300 0.747994 0.267260 O\n0.730217 0.480013 0.773749 O\n0.258758 0.477203 0.056093 O\n0.647850 0.891912 0.917647 O\n0.392632 0.660928 0.914394 O\n0.119408 0.139968 0.065087 O\n0.504404 0.723971 0.525929 O\n0.480013 0.730217 0.273749 O\n0.548790 0.947675 0.317871 O\n0.760736 0.145668 0.045793 O\n0.891912 0.647850 0.417647 O\n0.539622 0.965669 0.139312 O\n0.477203 0.258758 0.556093 O\n0.723971 0.504404 0.025929 O\n0.285323 0.756562 0.633013 O\n0.756562 0.285323 0.133013 O\n0.060137 0.782077 0.982257 O\n",
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            "chemical_system": "Cl-Zr",
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            "density_atomic": 0.03174916468301314,
            "volume": 314.9689165003554,
            "volume_molar": 18.96787150189827,
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            "formula_reduced": "ZrCl4",
            "formula_anonymous": "AB4",
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}