{"@module": "pymatgen.core.structure", "@class": "Structure", "charge": 0, "lattice": {"matrix": [[11.23547726, 0.0, 6.879745631675937e-16], [1.8068025461732796e-15, 11.23547726, 6.879745631675937e-16], [0.0, 0.0, 11.23547726]], "pbc": [true, true, true], "a": 11.23547726, "b": 11.23547726, "c": 11.23547726, "alpha": 90.0, "beta": 90.0, "gamma": 89.99999999999999, "volume": 1418.3211373049865}, "sites": [{"species": [{"element": "Ti", "occu": 1}], "abc": [0.6301, 0.8699, 0.8699], "xyz": [7.079474221526001, 9.773741668473999, 9.773741668474], "label": "Ti", "properties": {"lmm": -0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.8699, 0.6301, 0.8699], "xyz": [9.773741668474, 7.079474221526, 9.773741668474], "label": "Ti", "properties": {"lmm": -0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.6301, 0.6301, 0.6301], "xyz": [7.0794742215260005, 7.079474221526, 7.0794742215260005], "label": "Ti", "properties": {"lmm": -0.0, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.8699, 0.8699, 0.6301], "xyz": [9.773741668474, 9.773741668473999, 7.079474221526001], "label": "Ti", "properties": {"lmm": -0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.75, 0.75, 0.437552], "xyz": [8.426607945000002, 8.426607945, 4.916105546067521], "label": "Ti", "properties": {"lmm": 0.0014, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.25, 0.75, 0.562448], "xyz": [2.8088693150000013, 8.426607945, 6.31937171393248], "label": "Ti", "properties": {"lmm": 0.0014, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.562448, 0.75, 0.25], "xyz": [6.319371713932481, 8.426607945, 2.808869315000001], "label": "Ti", "properties": {"lmm": 0.0014, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.437552, 0.75, 0.75], "xyz": [4.916105546067522, 8.426607945, 8.426607945], "label": "Ti", "properties": {"lmm": 0.0014, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.75, 0.562448, 0.25], "xyz": [8.426607945000002, 6.31937171393248, 2.808869315000001], "label": "Ti", "properties": {"lmm": 0.0014, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.75, 0.437552, 0.75], "xyz": [8.426607945, 4.91610554606752, 8.426607945], "label": "Ti", "properties": {"lmm": 0.0014, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.5, 0.5, 0.814299], "xyz": [5.617738630000001, 5.61773863, 9.14903789734074], "label": "Ti", "properties": {"lmm": -0.0012, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.0, 0.5, 0.685701], "xyz": [9.034012730866398e-16, 5.61773863, 7.70417799265926], "label": "Ti", "properties": {"lmm": -0.001, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.685701, 0.5, 0.0], "xyz": [7.704177992659261, 5.61773863, 8.157321275223792e-16], "label": "Ti", "properties": {"lmm": -0.001, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.814299, 0.5, 0.5], "xyz": [9.149037897340742, 5.61773863, 5.617738630000001], "label": "Ti", "properties": {"lmm": -0.0012, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.5, 0.685701, 0.0], "xyz": [5.617738630000001, 7.70417799265926, 8.157321275223791e-16], "label": "Ti", "properties": {"lmm": -0.001, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.5, 0.814299, 0.5], "xyz": [5.617738630000002, 9.14903789734074, 5.617738630000001], "label": "Ti", "properties": {"lmm": -0.0012, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.6301, 0.3699, 0.3699], "xyz": [7.0794742215260005, 4.156003038474, 4.156003038474001], "label": "Ti", "properties": {"lmm": -0.0, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.8699, 0.1301, 0.3699], "xyz": [9.773741668473999, 1.461735591526, 4.156003038474001], "label": "Ti", "properties": {"lmm": -0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.6301, 0.1301, 0.1301], "xyz": [7.079474221526, 1.461735591526, 1.4617355915260004], "label": "Ti", "properties": {"lmm": -0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.8699, 0.3699, 0.1301], "xyz": [9.773741668473999, 4.156003038474, 1.4617355915260006], "label": "Ti", "properties": {"lmm": -0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.75, 0.25, 0.937552], "xyz": [8.426607945, 2.808869315, 10.533844176067522], "label": "Ti", "properties": {"lmm": 0.0014, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.25, 0.25, 0.062448], "xyz": [2.8088693150000004, 2.808869315, 0.7016330839324803], "label": "Ti", "properties": {"lmm": 0.0014, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.562448, 0.25, 0.75], "xyz": [6.3193717139324805, 2.808869315, 8.426607945], "label": "Ti", "properties": {"lmm": 0.0014, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.437552, 0.25, 0.25], "xyz": [4.916105546067521, 2.808869315, 2.8088693150000004], "label": "Ti", "properties": {"lmm": 0.0014, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.75, 0.062448, 0.75], "xyz": [8.426607945, 0.7016330839324799, 8.426607945], "label": "Ti", "properties": {"lmm": 0.0014, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.75, 0.937552, 0.25], "xyz": [8.426607945000002, 10.53384417606752, 2.8088693150000013], "label": "Ti", "properties": {"lmm": 0.0014, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.5, 0.0, 0.314299], "xyz": [5.61773863, 0.0, 3.5312992673407404], "label": "Ti", "properties": {"lmm": -0.001, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.0, 0.0, 0.185701], "xyz": [0.0, 0.0, 2.08643936265926], "label": "Ti", "properties": {"lmm": -0.0012, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.685701, 0.0, 0.5], "xyz": [7.70417799265926, 0.0, 5.617738630000001], "label": "Ti", "properties": {"lmm": -0.001, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.814299, 0.0, 0.0], "xyz": [9.14903789734074, 0.0, 5.602169988128084e-16], "label": "Ti", "properties": {"lmm": -0.0012, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.5, 0.185701, 0.5], "xyz": [5.61773863, 2.08643936265926, 5.617738630000001], "label": "Ti", "properties": {"lmm": -0.0012, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.5, 0.314299, 0.0], "xyz": [5.617738630000001, 3.53129926734074, 5.602169988128084e-16], "label": "Ti", "properties": {"lmm": -0.001, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.1301, 0.8699, 0.3699], "xyz": [1.4617355915260015, 9.773741668473999, 4.156003038474001], "label": "Ti", "properties": {"lmm": -0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.3699, 0.6301, 0.3699], "xyz": [4.156003038474001, 7.079474221526, 4.156003038474001], "label": "Ti", "properties": {"lmm": -0.0, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.1301, 0.6301, 0.1301], "xyz": [1.461735591526001, 7.079474221526, 1.4617355915260004], "label": "Ti", "properties": {"lmm": -0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.3699, 0.8699, 0.1301], "xyz": [4.156003038474002, 9.773741668473999, 1.4617355915260006], "label": "Ti", "properties": {"lmm": -0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.25, 0.75, 0.937552], "xyz": [2.8088693150000013, 8.426607945, 10.533844176067522], "label": "Ti", "properties": {"lmm": 0.0014, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.75, 0.75, 0.062448], "xyz": [8.426607945000002, 8.426607945, 0.701633083932481], "label": "Ti", "properties": {"lmm": 0.0014, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.062448, 0.75, 0.75], "xyz": [0.7016330839324812, 8.426607945, 8.426607945], "label": "Ti", "properties": {"lmm": 0.0014, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.937552, 0.75, 0.25], "xyz": [10.533844176067522, 8.426607945, 2.8088693150000013], "label": "Ti", "properties": {"lmm": 0.0014, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.25, 0.562448, 0.75], "xyz": [2.808869315000001, 6.31937171393248, 8.426607945], "label": "Ti", "properties": {"lmm": 0.0014, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.25, 0.437552, 0.25], "xyz": [2.808869315000001, 4.91610554606752, 2.8088693150000004], "label": "Ti", "properties": {"lmm": 0.0014, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.0, 0.5, 0.314299], "xyz": [9.034012730866398e-16, 5.61773863, 3.5312992673407404], "label": "Ti", "properties": {"lmm": -0.001, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.5, 0.5, 0.185701], "xyz": [5.617738630000001, 5.61773863, 2.0864393626592608], "label": "Ti", "properties": {"lmm": -0.0012, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.185701, 0.5, 0.5], "xyz": [2.0864393626592608, 5.61773863, 5.617738630000001], "label": "Ti", "properties": {"lmm": -0.0012, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.314299, 0.5, 0.0], "xyz": [3.531299267340741, 5.61773863, 5.602169988128084e-16], "label": "Ti", "properties": {"lmm": -0.001, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.0, 0.685701, 0.5], "xyz": [1.238926312713564e-15, 7.70417799265926, 5.617738630000001], "label": "Ti", "properties": {"lmm": -0.001, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.0, 0.814299, 0.0], "xyz": [1.4712775065463553e-15, 9.14903789734074, 5.602169988128084e-16], "label": "Ti", "properties": {"lmm": -0.0012, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.1301, 0.3699, 0.8699], "xyz": [1.4617355915260006, 4.156003038474, 9.773741668474], "label": "Ti", "properties": {"lmm": -0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.3699, 0.1301, 0.8699], "xyz": [4.156003038474, 1.461735591526, 9.773741668474], "label": "Ti", "properties": {"lmm": -0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.1301, 0.1301, 0.6301], "xyz": [1.4617355915260002, 1.461735591526, 7.079474221526], "label": "Ti", "properties": {"lmm": -0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.3699, 0.3699, 0.6301], "xyz": [4.156003038474001, 4.156003038474, 7.0794742215260005], "label": "Ti", "properties": {"lmm": -0.0, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.25, 0.25, 0.437552], "xyz": [2.8088693150000004, 2.808869315, 4.91610554606752], "label": "Ti", "properties": {"lmm": 0.0014, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.75, 0.25, 0.562448], "xyz": [8.426607945, 2.808869315, 6.31937171393248], "label": "Ti", "properties": {"lmm": 0.0014, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.062448, 0.25, 0.25], "xyz": [0.7016330839324804, 2.808869315, 2.808869315], "label": "Ti", "properties": {"lmm": 0.0014, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.937552, 0.25, 0.75], "xyz": [10.53384417606752, 2.808869315, 8.426607945], "label": "Ti", "properties": {"lmm": 0.0014, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.25, 0.062448, 0.25], "xyz": [2.808869315, 0.7016330839324799, 2.808869315], "label": "Ti", "properties": {"lmm": 0.0014, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.25, 0.937552, 0.75], "xyz": [2.8088693150000017, 10.53384417606752, 8.426607945], "label": "Ti", "properties": {"lmm": 0.0014, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.0, 0.0, 0.814299], "xyz": [0.0, 0.0, 9.14903789734074], "label": "Ti", "properties": {"lmm": -0.0012, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.5, 0.0, 0.685701], "xyz": [5.61773863, 0.0, 7.70417799265926], "label": "Ti", "properties": {"lmm": -0.001, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.185701, 0.0, 0.0], "xyz": [2.08643936265926, 0.0, 1.2775756435478534e-16], "label": "Ti", "properties": {"lmm": -0.0012, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.314299, 0.0, 0.5], "xyz": [3.53129926734074, 0.0, 5.61773863], "label": "Ti", "properties": {"lmm": -0.001, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.0, 0.185701, 0.0], "xyz": [3.355250396269242e-16, 2.08643936265926, 1.2775756435478534e-16], "label": "Ti", "properties": {"lmm": -0.0012, "soc": null, "ecc": null}}, {"species": [{"element": "Ti", "occu": 1}], "abc": [0.0, 0.314299, 0.5], "xyz": [5.678762334597156e-16, 3.53129926734074, 5.61773863], "label": "Ti", "properties": {"lmm": -0.001, "soc": null, "ecc": null}}, {"species": [{"element": "Co", "occu": 1}], "abc": [0.846165, 0.653835, 0.653835], "xyz": [9.507067615707902, 7.3461482742921005, 7.346148274292101], "label": "Co", "properties": {"lmm": 0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Co", "occu": 1}], "abc": [0.653835, 0.846165, 0.653835], "xyz": [7.346148274292102, 9.5070676157079, 7.346148274292101], "label": "Co", "properties": {"lmm": 0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Co", "occu": 1}], "abc": [0.346165, 0.846165, 0.346165], "xyz": [3.8893289857079014, 9.5070676157079, 3.8893289857079005], "label": "Co", "properties": {"lmm": 0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Co", "occu": 1}], "abc": [0.653835, 0.653835, 0.846165], "xyz": [7.346148274292101, 7.3461482742921005, 9.5070676157079], "label": "Co", "properties": {"lmm": 0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Co", "occu": 1}], "abc": [0.846165, 0.153835, 0.153835], "xyz": [9.5070676157079, 1.7284096442921, 1.7284096442921006], "label": "Co", "properties": {"lmm": 0.0005, "soc": null, "ecc": null}}, {"species": [{"element": "Co", "occu": 1}], "abc": [0.653835, 0.346165, 0.153835], "xyz": [7.346148274292101, 3.8893289857079, 1.7284096442921006], "label": "Co", "properties": {"lmm": 0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Co", "occu": 1}], "abc": [0.346165, 0.346165, 0.846165], "xyz": [3.8893289857079005, 3.8893289857079, 9.5070676157079], "label": "Co", "properties": {"lmm": 0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Co", "occu": 1}], "abc": [0.653835, 0.153835, 0.346165], "xyz": [7.3461482742921005, 1.7284096442921, 3.8893289857079005], "label": "Co", "properties": {"lmm": 0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Co", "occu": 1}], "abc": [0.346165, 0.653835, 0.153835], "xyz": [3.8893289857079014, 7.3461482742921005, 1.7284096442921006], "label": "Co", "properties": {"lmm": 0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Co", "occu": 1}], "abc": [0.153835, 0.846165, 0.153835], "xyz": [1.7284096442921015, 9.5070676157079, 1.7284096442921006], "label": "Co", "properties": {"lmm": 0.0005, "soc": null, "ecc": null}}, {"species": [{"element": "Co", "occu": 1}], "abc": [0.846165, 0.846165, 0.846165], "xyz": [9.507067615707902, 9.5070676157079, 9.5070676157079], "label": "Co", "properties": {"lmm": 0.0005, "soc": null, "ecc": null}}, {"species": [{"element": "Co", "occu": 1}], "abc": [0.153835, 0.653835, 0.346165], "xyz": [1.728409644292101, 7.3461482742921005, 3.8893289857079005], "label": "Co", "properties": {"lmm": 0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Co", "occu": 1}], "abc": [0.346165, 0.153835, 0.653835], "xyz": [3.8893289857079005, 1.7284096442921, 7.3461482742921005], "label": "Co", "properties": {"lmm": 0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Co", "occu": 1}], "abc": [0.153835, 0.346165, 0.653835], "xyz": [1.7284096442921006, 3.8893289857079, 7.3461482742921005], "label": "Co", "properties": {"lmm": 0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Co", "occu": 1}], "abc": [0.846165, 0.346165, 0.346165], "xyz": [9.5070676157079, 3.8893289857079, 3.8893289857079005], "label": "Co", "properties": {"lmm": 0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Co", "occu": 1}], "abc": [0.153835, 0.153835, 0.846165], "xyz": [1.7284096442921002, 1.7284096442921, 9.5070676157079], "label": "Co", "properties": {"lmm": 0.0005, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.411287, 0.588713, 0.588713], "xyz": [4.621005735833621, 6.6144715241663805, 6.614471524166381], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.588713, 0.411287, 0.588713], "xyz": [6.614471524166381, 4.62100573583362, 6.614471524166381], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.911287, 0.411287, 0.911287], "xyz": [10.23874436583362, 4.62100573583362, 10.23874436583362], "label": "Ni", "properties": {"lmm": -0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.588713, 0.588713, 0.411287], "xyz": [6.614471524166381, 6.6144715241663805, 4.621005735833621], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.411287, 0.088713, 0.088713], "xyz": [4.62100573583362, 0.99673289416638, 0.9967328941663803], "label": "Ni", "properties": {"lmm": -0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.588713, 0.911287, 0.088713], "xyz": [6.614471524166382, 10.23874436583362, 0.996732894166381], "label": "Ni", "properties": {"lmm": -0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.911287, 0.911287, 0.411287], "xyz": [10.238744365833622, 10.23874436583362, 4.621005735833621], "label": "Ni", "properties": {"lmm": -0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.588713, 0.088713, 0.911287], "xyz": [6.6144715241663805, 0.99673289416638, 10.23874436583362], "label": "Ni", "properties": {"lmm": -0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.911287, 0.588713, 0.088713], "xyz": [10.238744365833622, 6.6144715241663805, 0.996732894166381], "label": "Ni", "properties": {"lmm": -0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.088713, 0.411287, 0.088713], "xyz": [0.9967328941663808, 4.62100573583362, 0.9967328941663803], "label": "Ni", "properties": {"lmm": -0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.411287, 0.411287, 0.411287], "xyz": [4.621005735833621, 4.62100573583362, 4.621005735833621], "label": "Ni", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.088713, 0.588713, 0.911287], "xyz": [0.9967328941663811, 6.6144715241663805, 10.23874436583362], "label": "Ni", "properties": {"lmm": -0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.911287, 0.088713, 0.588713], "xyz": [10.23874436583362, 0.99673289416638, 6.614471524166381], "label": "Ni", "properties": {"lmm": -0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.088713, 0.911287, 0.588713], "xyz": [0.9967328941663817, 10.23874436583362, 6.614471524166381], "label": "Ni", "properties": {"lmm": -0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.411287, 0.911287, 0.911287], "xyz": [4.621005735833622, 10.23874436583362, 10.23874436583362], "label": "Ni", "properties": {"lmm": -0.0002, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.088713, 0.088713, 0.411287], "xyz": [0.9967328941663801, 0.99673289416638, 4.62100573583362], "label": "Ni", "properties": {"lmm": -0.0002, "soc": null, "ecc": null}}]}