{"@module": "pymatgen.core.structure", "@class": "Structure", "charge": 0, "lattice": {"matrix": [[8.42907182, 0.0, 5.161317912073078e-16], [-4.214535909999998, 7.299790326443535, 5.161317912073078e-16], [0.0, 0.0, 9.05972832]], "pbc": [true, true, true], "a": 8.42907182, "b": 8.42907182, "c": 9.05972832, "alpha": 90.0, "beta": 90.0, "gamma": 119.99999999999999, "volume": 557.4492232142169}, "sites": [{"species": [{"element": "Zr", "occu": 1}], "abc": [0.0, 0.0, 0.330372], "xyz": [0.0, 0.0, 2.99308056453504], "label": "Zr", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "Zr", "occu": 1}], "abc": [0.0, 0.0, 0.669628], "xyz": [0.0, 0.0, 6.06664775546496], "label": "Zr", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "Zr", "occu": 1}], "abc": [0.0, 0.0, 0.0], "xyz": [0.0, 0.0, 0.0], "label": "Zr", "properties": {"lmm": -0.0001, "soc": null, "ecc": null}}, {"species": [{"element": "Zr", "occu": 1}], "abc": [0.666667, 0.333333, 0.663705], "xyz": [4.214540124535911, 2.433261008884403, 6.0129869846256], "label": "Zr", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "Zr", "occu": 1}], "abc": [0.666667, 0.333333, 0.002961], "xyz": [4.214540124535911, 2.433261008884403, 0.026825855555520514], "label": "Zr", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "Zr", "occu": 1}], "abc": [0.666667, 0.333333, 0.333333], "xyz": [4.214540124535911, 2.433261008884403, 3.0199064200905603], "label": "Zr", "properties": {"lmm": -0.0001, "soc": null, "ecc": null}}, {"species": [{"element": "Zr", "occu": 1}], "abc": [0.333333, 0.666667, 0.997039], "xyz": [-4.21453590843937e-06, 4.866529317559133, 9.032902464444481], "label": "Zr", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "Zr", "occu": 1}], "abc": [0.333333, 0.666667, 0.336295], "xyz": [-4.21453590843937e-06, 4.866529317559133, 3.0467413353744006], "label": "Zr", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "Zr", "occu": 1}], "abc": [0.333333, 0.666667, 0.666667], "xyz": [-4.21453590843937e-06, 4.866529317559133, 6.03982189990944], "label": "Zr", "properties": {"lmm": -0.0001, "soc": null, "ecc": null}}, {"species": [{"element": "Co", "occu": 1}], "abc": [0.165932, 0.331864, 0.528822], "xyz": [8.46942722282371e-16, 2.422537616894857, 4.79098364963904], "label": "Co", "properties": {"lmm": -0.0001, "soc": null, "ecc": null}}, {"species": [{"element": "Co", "occu": 1}], "abc": [0.834068, 0.668136, 0.471178], "xyz": [4.214535910000002, 4.877252709548677, 4.26874467036096], "label": "Co", "properties": {"lmm": -0.0001, "soc": null, "ecc": null}}, {"species": [{"element": "Co", "occu": 1}], "abc": [0.834068, 0.165932, 0.471178], "xyz": [6.331092702145641, 1.2112688084474286, 4.26874467036096], "label": "Co", "properties": {"lmm": -0.0001, "soc": null, "ecc": null}}, {"species": [{"element": "Co", "occu": 1}], "abc": [0.668136, 0.834068, 0.528822], "xyz": [2.1165567921456416, 6.0885215179961065, 4.790983649639041], "label": "Co", "properties": {"lmm": -0.0001, "soc": null, "ecc": null}}, {"species": [{"element": "Co", "occu": 1}], "abc": [0.165932, 0.834068, 0.528822], "xyz": [-2.116556792145638, 6.0885215179961065, 4.79098364963904], "label": "Co", "properties": {"lmm": -0.0001, "soc": null, "ecc": null}}, {"species": [{"element": "Co", "occu": 1}], "abc": [0.166667, 0.333333, 0.833333], "xyz": [4.214535911103905e-06, 2.433261008884403, 7.54977058009056], "label": "Co", "properties": {"lmm": 0.0006, "soc": null, "ecc": null}}, {"species": [{"element": "Co", "occu": 1}], "abc": [0.331864, 0.165932, 0.471178], "xyz": [2.0979791178543605, 1.2112688084474286, 4.2687446703609595], "label": "Co", "properties": {"lmm": -0.0001, "soc": null, "ecc": null}}, {"species": [{"element": "Co", "occu": 1}], "abc": [0.166667, 0.833333, 0.833333], "xyz": [-2.107263740464088, 6.08315617210617, 7.54977058009056], "label": "Co", "properties": {"lmm": 0.0006, "soc": null, "ecc": null}}, {"species": [{"element": "Co", "occu": 1}], "abc": [0.666667, 0.833333, 0.833333], "xyz": [2.107272169535912, 6.08315617210617, 7.54977058009056], "label": "Co", "properties": {"lmm": 0.0006, "soc": null, "ecc": null}}, {"species": [{"element": "Co", "occu": 1}], "abc": [0.832598, 0.665197, 0.862155], "xyz": [4.214531695464092, 4.8557986257792605, 7.8108900697296], "label": "Co", "properties": {"lmm": -0.0001, "soc": null, "ecc": null}}, {"species": [{"element": "Co", "occu": 1}], "abc": [0.500735, 0.00147, 0.804512], "xyz": [4.214535910000001, 0.010730691779871996, 7.28866015017984], "label": "Co", "properties": {"lmm": -0.0001, "soc": null, "ecc": null}}, {"species": [{"element": "Co", "occu": 1}], "abc": [0.500735, 0.499265, 0.804512], "xyz": [2.116561006681552, 3.6445298173318315, 7.28866015017984], "label": "Co", "properties": {"lmm": -0.0001, "soc": null, "ecc": null}}, {"species": [{"element": "Co", "occu": 1}], "abc": [0.334803, 0.167402, 0.862155], "xyz": [2.116556792145641, 1.2219995002273005, 7.8108900697295995], "label": "Co", "properties": {"lmm": -0.0001, "soc": null, "ecc": null}}, {"species": [{"element": "Co", "occu": 1}], "abc": [0.832598, 0.167402, 0.862155], "xyz": [6.312506598782541, 1.2219995002273005, 7.8108900697296], "label": "Co", "properties": {"lmm": -0.0001, "soc": null, "ecc": null}}, {"species": [{"element": "Co", "occu": 1}], "abc": [0.833333, 0.666667, 0.166667], "xyz": [4.214531695464093, 4.866529317559133, 1.5099577399094408], "label": "Co", "properties": {"lmm": 0.0006, "soc": null, "ecc": null}}, {"species": [{"element": "Co", "occu": 1}], "abc": [0.99853, 0.499265, 0.804512], "xyz": [6.312510813318452, 3.6445298173318315, 7.28866015017984], "label": "Co", "properties": {"lmm": -0.0001, "soc": null, "ecc": null}}, {"species": [{"element": "Co", "occu": 1}], "abc": [0.833333, 0.166667, 0.166667], "xyz": [6.321799650464091, 1.2166341543373647, 1.5099577399094406], "label": "Co", "properties": {"lmm": 0.0006, "soc": null, "ecc": null}}, {"species": [{"element": "Co", "occu": 1}], "abc": [0.333333, 0.166667, 0.166667], "xyz": [2.1072637404640906, 1.2166341543373647, 1.5099577399094404], "label": "Co", "properties": {"lmm": 0.0006, "soc": null, "ecc": null}}, {"species": [{"element": "Co", "occu": 1}], "abc": [0.499265, 0.99853, 0.195488], "xyz": [2.7388978026234413e-15, 7.289059634663663, 1.7710681698201607], "label": "Co", "properties": {"lmm": -0.0001, "soc": null, "ecc": null}}, {"species": [{"element": "Co", "occu": 1}], "abc": [0.167402, 0.334803, 0.137845], "xyz": [4.2145359107955885e-06, 2.443991700664275, 1.2488382502704], "label": "Co", "properties": {"lmm": -0.0001, "soc": null, "ecc": null}}, {"species": [{"element": "Co", "occu": 1}], "abc": [0.167402, 0.832598, 0.137845], "xyz": [-2.097970688782538, 6.077790826216234, 1.2488382502704005], "label": "Co", "properties": {"lmm": -0.0001, "soc": null, "ecc": null}}, {"species": [{"element": "Co", "occu": 1}], "abc": [0.00147, 0.500735, 0.195488], "xyz": [-2.097974903318449, 3.6552605091117036, 1.7710681698201602], "label": "Co", "properties": {"lmm": -0.0001, "soc": null, "ecc": null}}, {"species": [{"element": "Co", "occu": 1}], "abc": [0.499265, 0.500735, 0.195488], "xyz": [2.0979749033184514, 3.6552605091117036, 1.7710681698201605], "label": "Co", "properties": {"lmm": -0.0001, "soc": null, "ecc": null}}, {"species": [{"element": "Co", "occu": 1}], "abc": [0.5, 0.0, 0.5], "xyz": [4.21453591, 0.0, 4.52986416], "label": "Co", "properties": {"lmm": 0.0006, "soc": null, "ecc": null}}, {"species": [{"element": "Co", "occu": 1}], "abc": [0.665197, 0.832598, 0.137845], "xyz": [2.0979791178543628, 6.077790826216234, 1.2488382502704007], "label": "Co", "properties": {"lmm": -0.0001, "soc": null, "ecc": null}}, {"species": [{"element": "Co", "occu": 1}], "abc": [0.5, 0.5, 0.5], "xyz": [2.1072679550000015, 3.6498951632217675, 4.529864160000001], "label": "Co", "properties": {"lmm": 0.0006, "soc": null, "ecc": null}}, {"species": [{"element": "Co", "occu": 1}], "abc": [0.0, 0.5, 0.5], "xyz": [-2.107267954999999, 3.6498951632217675, 4.52986416], "label": "Co", "properties": {"lmm": 0.0006, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.712065, 0.666667, 0.666667], "xyz": [3.192355013996332, 4.866529317559133, 6.03982189990944], "label": "B", "properties": {"lmm": -0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.666667, 0.954602, 0.333333], "xyz": [1.5961796142661226, 6.968394445203651, 3.0199064200905608], "label": "B", "properties": {"lmm": -0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.333333, 0.045398, 0.666667], "xyz": [2.6183562957338804, 0.3313958812398836, 6.03982189990944], "label": "B", "properties": {"lmm": -0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.287935, 0.333333, 0.333333], "xyz": [1.0221808960036711, 2.433261008884403, 3.0199064200905603], "label": "B", "properties": {"lmm": -0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.954602, 0.287935, 0.666667], "xyz": [6.832896420269791, 2.101865127644519, 6.03982189990944], "label": "B", "properties": {"lmm": -0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.045398, 0.712065, 0.333333], "xyz": [-2.618360510269788, 5.197925198799015, 3.0199064200905603], "label": "B", "properties": {"lmm": -0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.378732, 0.0, 0.0], "xyz": [3.1923592285322404, 0.0, 1.954756255475261e-16], "label": "B", "properties": {"lmm": -0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.333333, 0.287935, 0.666667], "xyz": [1.5961753997302108, 2.101865127644519, 6.03982189990944], "label": "B", "properties": {"lmm": -0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.0, 0.378732, 0.0], "xyz": [-1.596179614266119, 2.764664189914613, 1.954756255475261e-16], "label": "B", "properties": {"lmm": -0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.954602, 0.666667, 0.666667], "xyz": [5.236716806003672, 4.866529317559133, 6.039821899909441], "label": "B", "properties": {"lmm": -0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.621268, 0.621268, 0.0], "xyz": [2.618356295733882, 4.535126136528922, 6.413123313195634e-16], "label": "B", "properties": {"lmm": -0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.712065, 0.045398, 0.666667], "xyz": [5.81071552426612, 0.3313958812398836, 6.03982189990944], "label": "B", "properties": {"lmm": -0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.045398, 0.333333, 0.333333], "xyz": [-1.0221808960036691, 2.433261008884403, 3.01990642009056], "label": "B", "properties": {"lmm": -0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.0, 0.621268, 0.0], "xyz": [-2.6183562957338786, 4.535126136528922, 3.206561656597817e-16], "label": "B", "properties": {"lmm": -0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.666667, 0.712065, 0.333333], "xyz": [2.618360510269792, 5.197925198799015, 3.0199064200905603], "label": "B", "properties": {"lmm": -0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.621268, 0.0, 0.0], "xyz": [5.236712591467761, 0.0, 3.206561656597817e-16], "label": "B", "properties": {"lmm": -0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.287935, 0.954602, 0.333333], "xyz": [-1.5961796142661173, 6.968394445203651, 3.0199064200905603], "label": "B", "properties": {"lmm": -0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.378732, 0.378732, 0.0], "xyz": [1.5961796142661213, 2.764664189914613, 3.909512510950522e-16], "label": "B", "properties": {"lmm": -0.0, "soc": null, "ecc": null}}]}