{"@module": "pymatgen.core.structure", "@class": "Structure", "charge": 0, "lattice": {"matrix": [[7.45812504, 0.0, 4.566784478938363e-16], [-3.7290625199999976, 6.458925749240834, 4.566784478938363e-16], [0.0, 0.0, 36.56800761]], "pbc": [true, true, true], "a": 7.45812504, "b": 7.45812504, "c": 36.56800761, "alpha": 90.0, "beta": 90.0, "gamma": 119.99999999999997, "volume": 1761.5348959033959}, "sites": [{"species": [{"element": "Nb", "occu": 1}], "abc": [0.666667, 0.333333, 0.958183], "xyz": [3.729066249062521, 2.152973096771695, 35.03884323577263], "label": "Nb", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "Nb", "occu": 1}], "abc": [0.333333, 0.666667, 0.791966], "xyz": [-3.7290625184794645e-06, 4.305952652469139, 28.960618714861262], "label": "Nb", "properties": {"lmm": -0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Nb", "occu": 1}], "abc": [0.0, 0.0, 0.8747], "xyz": [0.0, 0.0, 31.986036256467003], "label": "Nb", "properties": {"lmm": -0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Nb", "occu": 1}], "abc": [0.666667, 0.333333, 0.708484], "xyz": [3.729066249062521, 2.152973096771695, 25.90784830356324], "label": "Nb", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "Nb", "occu": 1}], "abc": [0.0, 0.0, 0.0], "xyz": [0.0, 0.0, 0.0], "label": "Nb", "properties": {"lmm": -0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Nb", "occu": 1}], "abc": [0.333333, 0.666667, 0.291516], "xyz": [-3.7290625184794645e-06, 4.305952652469139, 10.66015930643676], "label": "Nb", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "Nb", "occu": 1}], "abc": [0.0, 0.0, 0.1253], "xyz": [0.0, 0.0, 4.5819713535330004], "label": "Nb", "properties": {"lmm": -0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Nb", "occu": 1}], "abc": [0.666667, 0.333333, 0.208034], "xyz": [3.729066249062521, 2.152973096771695, 7.607388895138741], "label": "Nb", "properties": {"lmm": -0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Nb", "occu": 1}], "abc": [0.333333, 0.666667, 0.041817], "xyz": [-3.7290625184794645e-06, 4.305952652469139, 1.5291643742273706], "label": "Nb", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "Nb", "occu": 1}], "abc": [0.666667, 0.333333, 0.333333], "xyz": [3.729066249062521, 2.152973096771695, 12.189323680664131], "label": "Nb", "properties": {"lmm": -0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Nb", "occu": 1}], "abc": [0.0, 0.0, 0.624849], "xyz": [0.0, 0.0, 22.84948298710089], "label": "Nb", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "Nb", "occu": 1}], "abc": [0.666667, 0.333333, 0.458633], "xyz": [3.729066249062521, 2.152973096771695, 16.77129503419713], "label": "Nb", "properties": {"lmm": -0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Nb", "occu": 1}], "abc": [0.333333, 0.666667, 0.541367], "xyz": [-3.7290625184794645e-06, 4.305952652469139, 19.79671257580287], "label": "Nb", "properties": {"lmm": -0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Nb", "occu": 1}], "abc": [0.0, 0.0, 0.375151], "xyz": [0.0, 0.0, 13.71852462289911], "label": "Nb", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "Nb", "occu": 1}], "abc": [0.333333, 0.666667, 0.666667], "xyz": [-3.7290625184794645e-06, 4.305952652469139, 24.37868392933587], "label": "Nb", "properties": {"lmm": -0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.026647, 0.513323, 0.935821], "xyz": [-1.7154769020130787, 3.3155151423775524, 34.22110944959781], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.692021, 0.84601, 0.769317], "xyz": [2.006354965760641, 5.464315773115238, 28.132389910502372], "label": "Ni", "properties": {"lmm": -0.0005, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.486677, 0.973353, 0.935821], "xyz": [3.7290625222752952e-06, 6.2868147548008135, 34.22110944959781], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.15399, 0.307979, 0.769317], "xyz": [3.7290625205424835e-06, 1.9892134933254426, 28.132389910502372], "label": "Ni", "properties": {"lmm": -0.0005, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.333333, 0.666667, 0.859086], "xyz": [-3.7290625184794645e-06, 4.305952652469139, 31.415063385644462], "label": "Ni", "properties": {"lmm": -0.0005, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.0, 0.0, 0.69236], "xyz": [0.0, 0.0, 25.3182257488596], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.486677, 0.513323, 0.935821], "xyz": [1.7154843601381213, 3.3155151423775524, 34.22110944959781], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.15399, 0.84601, 0.769317], "xyz": [-2.0063475076355983, 5.464315773115238, 28.132389910502372], "label": "Ni", "properties": {"lmm": -0.0005, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.641312, 0.820656, 0.89735], "xyz": [1.7227075542393615, 5.300556169668986, 32.814301628833505], "label": "Ni", "properties": {"lmm": -0.0005, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.306686, 0.153343, 0.730845], "xyz": [1.7154769020130805, 0.9904310511658372, 26.72554552173045], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.179344, 0.358688, 0.89735], "xyz": [7.501083908201167e-16, 2.316739159143696, 32.814301628833505], "label": "Ni", "properties": {"lmm": -0.0005, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.846657, 0.693314, 0.730845], "xyz": [3.729062520000001, 4.478063646909159, 26.72554552173045], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.333333, 0.666667, 0.974307], "xyz": [-3.7290625184794645e-06, 4.305952652469139, 35.62846579047628], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.0, 0.0, 0.80758], "xyz": [0.0, 0.0, 29.5315915856838], "label": "Ni", "properties": {"lmm": -0.0005, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.179344, 0.820656, 0.89735], "xyz": [-1.7227075542393584, 5.300556169668986, 32.814301628833505], "label": "Ni", "properties": {"lmm": -0.0005, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.846657, 0.153343, 0.730845], "xyz": [5.74264813798692, 0.9904310511658372, 26.72554552173045], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.34349, 0.34349, 0.0], "xyz": [1.280895684994801, 2.218576405606734, 3.1372896013410765e-16], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.00756, 0.674226, 0.833333], "xyz": [-2.4578474813071183, 4.3547756722076505, 30.473327485664132], "label": "Ni", "properties": {"lmm": 0.0021, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.34349, 0.0, 0.0], "xyz": [2.5617913699896, 0.0, 1.5686448006705382e-16], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.00756, 0.333333, 0.833333], "xyz": [-1.1866361716767593, 2.152973096771695, 30.473327485664132], "label": "Ni", "properties": {"lmm": 0.0021, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.231284, 0.115642, 0.942065], "xyz": [1.29370874381352, 0.7469230914937085, 34.44944008911465], "label": "Ni", "properties": {"lmm": -0.0001, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.892192, 0.446096, 0.777234], "xyz": [4.990559621765761, 2.881300941033339, 28.42189882675074], "label": "Ni", "properties": {"lmm": 0.0011, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.65651, 0.65651, 0.0], "xyz": [2.448166835005202, 4.2403493436341, 5.99627935653565e-16], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.325774, 0.99244, 0.833333], "xyz": [-1.2712075805678376, 6.410096270576573, 30.473327485664132], "label": "Ni", "properties": {"lmm": 0.0021, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.884358, 0.768716, 0.942065], "xyz": [3.729062520000001, 4.965079566253416, 34.44944008911465], "label": "Ni", "properties": {"lmm": -0.0001, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.553904, 0.107808, 0.777234], "xyz": [3.72906252, 0.6963238671741558, 28.42189882675074], "label": "Ni", "properties": {"lmm": 0.0011, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.0, 0.65651, 0.0], "xyz": [-2.4481668350051984, 4.2403493436341, 2.998139678267825e-16], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.666667, 0.99244, 0.833333], "xyz": [1.2712150386928827, 6.410096270576573, 30.473327485664132], "label": "Ni", "properties": {"lmm": 0.0021, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.779429, 0.220571, 0.889433], "xyz": [4.990555892703241, 1.4246517114358, 32.52479271258513], "label": "Ni", "properties": {"lmm": 0.0011, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.448975, 0.551025, 0.724601], "xyz": [1.2937050147510014, 3.5590295609754303, 26.497214882213616], "label": "Ni", "properties": {"lmm": -0.0001, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.779429, 0.558858, 0.889433], "xyz": [3.729062520000001, 3.6096223263692337, 32.52479271258513], "label": "Ni", "properties": {"lmm": 0.0011, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.448975, 0.897951, 0.724601], "xyz": [-3.729062518115035e-06, 5.799798835456556, 26.497214882213616], "label": "Ni", "properties": {"lmm": -0.0001, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.441142, 0.220571, 0.889433], "xyz": [2.4675691472967602, 1.4246517114358, 32.52479271258513], "label": "Ni", "properties": {"lmm": 0.0011, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.102049, 0.551025, 0.724601], "xyz": [-1.2937124728760385, 3.5590295609754303, 26.497214882213612], "label": "Ni", "properties": {"lmm": -0.0001, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.884358, 0.115642, 0.942065], "xyz": [6.16441629618648, 0.7469230914937085, 34.44944008911465], "label": "Ni", "properties": {"lmm": -0.0001, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.553904, 0.446096, 0.777234], "xyz": [2.4675654182342406, 2.881300941033339, 28.42189882675074], "label": "Ni", "properties": {"lmm": 0.0011, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.65651, 0.0, 0.0], "xyz": [4.8963336700104, 0.0, 2.998139678267825e-16], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.325774, 0.333333, 0.833333], "xyz": [1.1866436298018008, 2.152973096771695, 30.473327485664132], "label": "Ni", "properties": {"lmm": 0.0021, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.666667, 0.674226, 0.833333], "xyz": [2.4578549394321616, 4.3547756722076505, 30.473327485664132], "label": "Ni", "properties": {"lmm": 0.0021, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.0, 0.34349, 0.0], "xyz": [-1.2808956849947992, 2.218576405606734, 1.5686448006705382e-16], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.666667, 0.333333, 0.833333], "xyz": [3.729066249062521, 2.152973096771695, 30.473327485664132], "label": "Ni", "properties": {"lmm": 0.0096, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.693314, 0.846657, 0.269155], "xyz": [2.013585617986922, 5.468494698074997, 9.842462088269551], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.358688, 0.179344, 0.10265], "xyz": [2.0063549657606403, 1.158369579571848, 3.7537059811665006], "label": "Ni", "properties": {"lmm": -0.0005, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.153343, 0.306686, 0.269155], "xyz": [7.606587890063566e-16, 1.9808621023316744, 9.84246208826955], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.820656, 0.641312, 0.10265], "xyz": [3.729062520000001, 4.142186590097137, 3.753705981166501], "label": "Ni", "properties": {"lmm": -0.0005, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.0, 0.0, 0.19242], "xyz": [0.0, 0.0, 7.036416024316201], "label": "Ni", "properties": {"lmm": -0.0005, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.666667, 0.333333, 0.025693], "xyz": [3.729066249062521, 2.152973096771695, 0.9395418195237305], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.153343, 0.846657, 0.269155], "xyz": [-2.013585617986918, 5.468494698074997, 9.842462088269551], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.820656, 0.179344, 0.10265], "xyz": [5.45177007423936, 1.158369579571848, 3.753705981166501], "label": "Ni", "properties": {"lmm": -0.0005, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.307979, 0.15399, 0.230683], "xyz": [1.7227075542393602, 0.9946099761255959, 8.43561769949763], "label": "Ni", "properties": {"lmm": -0.0005, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.973353, 0.486677, 0.064179], "xyz": [5.444539422013081, 3.143410606863281, 2.346898160402191], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.84601, 0.692021, 0.230683], "xyz": [3.7290587909374815, 4.469712255915391, 8.435617699497632], "label": "Ni", "properties": {"lmm": -0.0005, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.513323, 0.026647, 0.064179], "xyz": [3.7290587909374797, 0.1721109944400205, 2.3468981604021906], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.0, 0.0, 0.30764], "xyz": [0.0, 0.0, 11.249781861140402], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.666667, 0.333333, 0.140914], "xyz": [3.729066249062521, 2.152973096771695, 5.152944224355541], "label": "Ni", "properties": {"lmm": -0.0005, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.84601, 0.15399, 0.230683], "xyz": [5.7354100276356, 0.9946099761255959, 8.43561769949763], "label": "Ni", "properties": {"lmm": -0.0005, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.513323, 0.486677, 0.064179], "xyz": [2.0135781598618805, 3.143410606863281, 2.3468981604021906], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.010156, 0.676823, 0.333333], "xyz": [-2.448170564067718, 4.3715495023784285, 12.189323680664131], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.674226, 0.00756, 0.166667], "xyz": [5.00027010056784, 0.048829478664260705, 6.094680124335871], "label": "Ni", "properties": {"lmm": 0.0021, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.010156, 0.333333, 0.333333], "xyz": [-1.1672748790729193, 2.152973096771695, 12.189323680664131], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.674226, 0.666667, 0.166667], "xyz": [2.5424188901982014, 4.305952652469139, 6.094680124335872], "label": "Ni", "properties": {"lmm": 0.0021, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.897951, 0.448975, 0.275399], "xyz": [5.022774992876041, 2.8998961882654033, 10.070792727786392], "label": "Ni", "properties": {"lmm": -0.0001, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.558858, 0.779429, 0.110567], "xyz": [1.2614933727032416, 5.034274037805034, 4.043214897414871], "label": "Ni", "properties": {"lmm": 0.0011, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.323177, 0.989844, 0.333333], "xyz": [-1.2808956849947974, 6.393328899331544, 12.189323680664131], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.99244, 0.325774, 0.166667], "xyz": [6.186910001307121, 2.1041500770331836, 6.094680124335872], "label": "Ni", "properties": {"lmm": 0.0021, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.551025, 0.102049, 0.275399], "xyz": [3.72906624906252, 0.6591269137842778, 10.07079272778639], "label": "Ni", "properties": {"lmm": -0.0001, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.220571, 0.441142, 0.110567], "xyz": [1.00430263148624e-15, 2.8493034228716, 4.04321489741487], "label": "Ni", "properties": {"lmm": 0.0011, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.666667, 0.989844, 0.333333], "xyz": [1.2808956849948028, 6.393328899331544, 12.189323680664131], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.333333, 0.325774, 0.166667], "xyz": [1.2712075805678407, 2.1041500770331836, 6.094680124335871], "label": "Ni", "properties": {"lmm": 0.0021, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.446096, 0.553904, 0.222766], "xyz": [1.2614971017657612, 3.5776248082074944, 8.146108783249261], "label": "Ni", "properties": {"lmm": 0.0011, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.115642, 0.884358, 0.057935], "xyz": [-2.435353776186478, 5.712002657747125, 2.1185675208853505], "label": "Ni", "properties": {"lmm": -0.0001, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.446096, 0.892192, 0.222766], "xyz": [2.0158293548499275e-15, 5.762601882066678, 8.146108783249261], "label": "Ni", "properties": {"lmm": 0.0011, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.115642, 0.231284, 0.057935], "xyz": [4.604118832712345e-16, 1.493846182987417, 2.1185675208853505], "label": "Ni", "properties": {"lmm": -0.0001, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.107808, 0.553904, 0.222766], "xyz": [-1.2614971017657586, 3.5776248082074944, 8.146108783249261], "label": "Ni", "properties": {"lmm": 0.0011, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.768716, 0.884358, 0.057935], "xyz": [2.435353776186482, 5.712002657747125, 2.118567520885351], "label": "Ni", "properties": {"lmm": -0.0001, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.551025, 0.448975, 0.275399], "xyz": [2.4353575052490006, 2.8998961882654033, 10.070792727786392], "label": "Ni", "properties": {"lmm": -0.0001, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.220571, 0.779429, 0.110567], "xyz": [-1.2614933727032385, 5.034274037805034, 4.04321489741487], "label": "Ni", "properties": {"lmm": 0.0011, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.323177, 0.333333, 0.333333], "xyz": [1.1672748790729208, 2.152973096771695, 12.189323680664131], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.99244, 0.666667, 0.166667], "xyz": [4.915698691676761, 4.305952652469139, 6.094680124335872], "label": "Ni", "properties": {"lmm": 0.0021, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.333333, 0.00756, 0.166667], "xyz": [2.45784748130712, 0.048829478664260705, 6.094680124335871], "label": "Ni", "properties": {"lmm": 0.0021, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.666667, 0.676823, 0.333333], "xyz": [2.448170564067722, 4.3715495023784285, 12.189323680664131], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.333333, 0.666667, 0.166667], "xyz": [-3.7290625184794645e-06, 4.305952652469139, 6.094680124335871], "label": "Ni", "properties": {"lmm": 0.0096, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.35998, 0.17999, 0.602488], "xyz": [2.0135818889244006, 1.1625420456058577, 22.031785768933684], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.025354, 0.512677, 0.435983], "xyz": [-1.722711283301879, 3.311342676343543, 15.943029661830632], "label": "Ni", "properties": {"lmm": -0.0005, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.82001, 0.64002, 0.602488], "xyz": [3.729062520000001, 4.133841658029119, 22.031785768933684], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.487323, 0.974646, 0.435983], "xyz": [2.0630190420175152e-15, 6.295166145794582, 15.943029661830632], "label": "Ni", "properties": {"lmm": -0.0005, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.666667, 0.333333, 0.525753], "xyz": [3.729066249062521, 2.152973096771695, 19.22573970498033], "label": "Ni", "properties": {"lmm": -0.0005, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.333333, 0.666667, 0.359027], "xyz": [-3.7290625184794645e-06, 4.305952652469139, 13.12890206819547], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.82001, 0.17999, 0.602488], "xyz": [5.4445431510755995, 1.1625420456058577, 22.031785768933684], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.487323, 0.512677, 0.435983], "xyz": [1.7227112833018807, 3.311342676343543, 15.943029661830632], "label": "Ni", "properties": {"lmm": -0.0005, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.974646, 0.487323, 0.564017], "xyz": [5.45177380330188, 3.147583072897291, 20.62497794816937], "label": "Ni", "properties": {"lmm": -0.0005, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.64002, 0.82001, 0.397512], "xyz": [1.7154806310756023, 5.296383703634976, 14.53622184106632], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.512677, 0.025354, 0.564017], "xyz": [3.7290625200000003, 0.1637596034462521, 20.62497794816937], "label": "Ni", "properties": {"lmm": -0.0005, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.17999, 0.35998, 0.397512], "xyz": [8.821459280831335e-16, 2.3250840912117154, 14.53622184106632], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.666667, 0.333333, 0.640973], "xyz": [3.729066249062521, 2.152973096771695, 23.439105541804533], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.333333, 0.666667, 0.474247], "xyz": [-3.7290625184794645e-06, 4.305952652469139, 17.34226790501967], "label": "Ni", "properties": {"lmm": -0.0005, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.512677, 0.487323, 0.564017], "xyz": [2.0063512366981215, 3.147583072897291, 20.62497794816937], "label": "Ni", "properties": {"lmm": -0.0005, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.17999, 0.82001, 0.397512], "xyz": [-1.715480631075598, 5.296383703634976, 14.53622184106632], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.676823, 0.010156, 0.666667], "xyz": [5.0099582049948, 0.0655968499092899, 24.37868392933587], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.340893, 0.340893, 0.5], "xyz": [1.2712113096303606, 2.2018025754359556, 18.284003805], "label": "Ni", "properties": {"lmm": 0.0021, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.676823, 0.666667, 0.666667], "xyz": [2.5617876409270814, 4.305952652469139, 24.37868392933587], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.340893, 0.0, 0.5], "xyz": [2.5424226192607198, 0.0, 18.284003805], "label": "Ni", "properties": {"lmm": 0.0021, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.564617, 0.782309, 0.608732], "xyz": [1.293705014751002, 5.052875743962847, 22.260116408450525], "label": "Ni", "properties": {"lmm": -0.0001, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.225525, 0.112762, 0.4439], "xyz": [1.2614971017657601, 0.7283213853358949, 16.232538578079], "label": "Ni", "properties": {"lmm": 0.0011, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.989844, 0.323177, 0.666667], "xyz": [6.17723308406772, 2.0873762468624046, 24.37868392933587], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.659107, 0.659107, 0.5], "xyz": [2.457851210369641, 4.257123173804878, 18.284003805], "label": "Ni", "properties": {"lmm": 0.0021, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.217691, 0.435383, 0.608732], "xyz": [-3.7290625190508987e-06, 2.812106469481722, 22.260116408450525], "label": "Ni", "properties": {"lmm": -0.0001, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.887238, 0.774475, 0.4439], "xyz": [3.729066249062521, 5.002276519643295, 16.232538578079], "label": "Ni", "properties": {"lmm": 0.0011, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.333333, 0.323177, 0.666667], "xyz": [1.2808919559322807, 2.0873762468624046, 24.37868392933587], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.0, 0.659107, 0.5], "xyz": [-2.4578512103696384, 4.257123173804878, 18.284003805], "label": "Ni", "properties": {"lmm": 0.0021, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.112762, 0.887238, 0.5561], "xyz": [-2.4675728763592777, 5.730604363904939, 20.335469031921004], "label": "Ni", "properties": {"lmm": 0.0011, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.782309, 0.217691, 0.391268], "xyz": [5.02277499287604, 1.4060500052779863, 14.30789120154948], "label": "Ni", "properties": {"lmm": -0.0001, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.112762, 0.225525, 0.5561], "xyz": [-3.7290625194912873e-06, 1.456649229597539, 20.335469031921004], "label": "Ni", "properties": {"lmm": 0.0011, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.782309, 0.564617, 0.391268], "xyz": [3.729066249062521, 3.646819279759112, 14.30789120154948], "label": "Ni", "properties": {"lmm": -0.0001, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.774475, 0.887238, 0.5561], "xyz": [2.4675654182342424, 5.730604363904939, 20.335469031921004], "label": "Ni", "properties": {"lmm": 0.0011, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.435383, 0.217691, 0.391268], "xyz": [2.4353575052490006, 1.4060500052779863, 14.30789120154948], "label": "Ni", "properties": {"lmm": -0.0001, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.217691, 0.782309, 0.608732], "xyz": [-1.2937124728760383, 5.052875743962847, 22.260116408450525], "label": "Ni", "properties": {"lmm": -0.0001, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.887238, 0.112762, 0.4439], "xyz": [6.196635396359279, 0.7283213853358949, 16.232538578079], "label": "Ni", "properties": {"lmm": 0.0011, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.989844, 0.666667, 0.666667], "xyz": [4.89633739907292, 4.305952652469139, 24.37868392933587], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.659107, 0.0, 0.5], "xyz": [4.915702420739279, 0.0, 18.284003805], "label": "Ni", "properties": {"lmm": 0.0021, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.0, 0.340893, 0.5], "xyz": [-1.2712113096303592, 2.2018025754359556, 18.284003805], "label": "Ni", "properties": {"lmm": 0.0021, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.333333, 0.010156, 0.666667], "xyz": [2.4481668350052, 0.0655968499092899, 24.37868392933587], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.0, 0.0, 0.5], "xyz": [0.0, 0.0, 18.284003805], "label": "Ni", "properties": {"lmm": 0.0098, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.024286, 0.512143, 0.877999], "xyz": [-1.7286852414589189, 3.307893609993448, 32.10667411357239], "label": "B", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.688761, 0.844381, 0.711171], "xyz": [1.9881161209753209, 5.453794183069725, 26.006106540011313], "label": "B", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.177714, 0.822286, 0.955496], "xyz": [-1.740942669962158, 5.311084218640248, 34.940584999324564], "label": "B", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.845476, 0.154524, 0.788667], "xyz": [5.72943606947856, 0.9980590424756905, 28.839980857755872], "label": "B", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.177714, 0.355428, 0.955496], "xyz": [7.538880282366734e-16, 2.295683061201171, 34.940584999324564], "label": "B", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.845476, 0.690953, 0.788667], "xyz": [3.7290587909374815, 4.462814123215202, 28.839980857755872], "label": "B", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.644572, 0.822286, 0.955496], "xyz": [1.7409426699621622, 5.311084218640248, 34.940584999324564], "label": "B", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.309047, 0.154524, 0.788667], "xyz": [1.7286815123964006, 0.9980590424756905, 28.839980857755872], "label": "B", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.487857, 0.975714, 0.877999], "xyz": [2.1813713863411976e-15, 6.302064278494771, 32.10667411357239], "label": "B", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.155619, 0.311239, 0.711171], "xyz": [-3.7290625192333526e-06, 2.0102695912679676, 26.006106540011313], "label": "B", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.487857, 0.512143, 0.877999], "xyz": [1.7286852414589209, 3.307893609993448, 32.10667411357239], "label": "B", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.155619, 0.844381, 0.711171], "xyz": [-1.9881235791003582, 5.453794183069725, 26.006106540011313], "label": "B", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.690953, 0.845476, 0.211333], "xyz": [2.000381007603602, 5.4608667067651435, 7.728026752244131], "label": "B", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.355428, 0.177714, 0.044504], "xyz": [1.9881198500378403, 1.1478415306005856, 1.6274226106754404], "label": "B", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.844381, 0.155619, 0.288829], "xyz": [5.717186099100361, 1.0051315661711093, 10.561901069988691], "label": "B", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.512143, 0.487857, 0.122001], "xyz": [2.000377278541081, 3.1510321392473855, 4.461333496427611], "label": "B", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.844381, 0.688761, 0.288829], "xyz": [3.729066249062522, 4.448656157972866, 10.561901069988691], "label": "B", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.512143, 0.024286, 0.122001], "xyz": [3.72906252, 0.15686147074606288, 4.461333496427611], "label": "B", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.311239, 0.155619, 0.288829], "xyz": [1.74094639902468, 1.0051315661711093, 10.561901069988691], "label": "B", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.975714, 0.487857, 0.122001], "xyz": [5.45774776145892, 3.1510321392473855, 4.461333496427611], "label": "B", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.154524, 0.309047, 0.211333], "xyz": [3.729062520675876e-06, 1.996111626025632, 7.728026752244131], "label": "B", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.822286, 0.644572, 0.044504], "xyz": [3.7290625200000007, 4.163242688039663, 1.6274226106754408], "label": "B", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.154524, 0.845476, 0.211333], "xyz": [-2.000373549478558, 5.4608667067651435, 7.728026752244131], "label": "B", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.822286, 0.177714, 0.044504], "xyz": [5.47000518996216, 1.1478415306005856, 1.6274226106754406], "label": "B", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.35762, 0.17881, 0.544666], "xyz": [2.0003810076036004, 1.1549205132217535, 19.91735043290826], "label": "B", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.022095, 0.511047, 0.377838], "xyz": [-1.740938940899639, 3.3008146273722807, 13.816782859347182], "label": "B", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.511047, 0.488953, 0.622162], "xyz": [1.9881161209753213, 3.1581111218685534, 22.75122475065282], "label": "B", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.17881, 0.82119, 0.455334], "xyz": [-1.728681512396398, 5.30400523601908, 16.65065717709174], "label": "B", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.511047, 0.022095, 0.622162], "xyz": [3.72905879093748, 0.14270996442947623, 22.75122475065282], "label": "B", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.17881, 0.35762, 0.455334], "xyz": [8.387605999949699e-16, 2.309841026443507, 16.65065717709174], "label": "B", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.977905, 0.488953, 0.622162], "xyz": [5.470001460899641, 3.1581111218685534, 22.75122475065282], "label": "B", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.64238, 0.82119, 0.455334], "xyz": [1.7286815123964019, 5.30400523601908, 16.65065717709174], "label": "B", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.82119, 0.64238, 0.544666], "xyz": [3.7290625200000016, 4.149084722797326, 19.91735043290826], "label": "B", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.488953, 0.977905, 0.377838], "xyz": [3.729062522181509e-06, 6.316215784811358, 13.816782859347182], "label": "B", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.82119, 0.17881, 0.544666], "xyz": [5.4577440323964, 1.1549205132217535, 19.91735043290826], "label": "B", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "B", "occu": 1}], "abc": [0.488953, 0.511047, 0.377838], "xyz": [1.740946399024681, 3.3008146273722807, 13.816782859347182], "label": "B", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}]}