{"@module": "pymatgen.core.structure", "@class": "Structure", "charge": 0, "lattice": {"matrix": [[8.08137038, 0.0, 4.948412184295614e-16], [-4.040685189999997, 6.998672046471103, 4.948412184295614e-16], [0.0, 0.0, 9.72063073]], "pbc": [true, true, true], "a": 8.08137038, "b": 8.08137038, "c": 9.72063073, "alpha": 90.0, "beta": 90.0, "gamma": 119.99999999999997, "volume": 549.7878020540468}, "sites": [{"species": [{"element": "Ni", "occu": 1}], "abc": [0.0, 0.0, 0.993503], "xyz": [0.0, 0.0, 9.65747579214719], "label": "Ni", "properties": {"lmm": -0.0005, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.998929, 0.493078, 0.002052], "xyz": [6.0803422602082, 3.4508912153298787, 0.019946734257960737], "label": "Ni", "properties": {"lmm": -0.0, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.840255, 0.172518, 0.668719], "xyz": [6.093320941038479, 1.2073969041131019, 6.50037046113487], "label": "Ni", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.827482, 0.667737, 0.668719], "xyz": [3.989073518068132, 4.673272276294475, 6.50037046113487], "label": "Ni", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.666667, 0.333333, 0.326837], "xyz": [4.0406892306851905, 2.3328883492663524, 3.17706178590101], "label": "Ni", "properties": {"lmm": -0.0005, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.665596, 0.826411, 0.335385], "xyz": [2.0396611108933915, 5.783779564596231, 3.2601537373810507], "label": "Ni", "properties": {"lmm": -0.0, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.506922, 0.505851, 0.002052], "xyz": [2.052639791723671, 3.5402852533794547, 0.0199467342579605], "label": "Ni", "properties": {"lmm": -0.0, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.494149, 0.001071, 0.002052], "xyz": [3.9890735180681296, 0.007495577761770551, 0.019946734257960244], "label": "Ni", "properties": {"lmm": -0.0, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.333333, 0.666667, 0.66017], "xyz": [-4.040685188557621e-06, 4.665783697204751, 6.417268789024101], "label": "Ni", "properties": {"lmm": -0.0005, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.332263, 0.159745, 0.668719], "xyz": [2.0396611108933898, 1.1180028660635264, 6.50037046113487], "label": "Ni", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.173589, 0.839185, 0.335385], "xyz": [-1.9880453982763275, 5.873180601317853, 3.2601537373810503], "label": "Ni", "properties": {"lmm": -0.0, "soc": null, "ecc": null}}, {"species": [{"element": "Ni", "occu": 1}], "abc": [0.160815, 0.334404, 0.335385], "xyz": [-0.05161571261705891, 2.340383927028123, 3.2601537373810503], "label": "Ni", "properties": {"lmm": -0.0, "soc": null, "ecc": null}}, {"species": [{"element": "As", "occu": 1}], "abc": [0.252934, 0.244342, 0.126966], "xyz": [1.0567442349999405, 1.7100695251788425, 1.2341896012651803], "label": "As", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "As", "occu": 1}], "abc": [0.088991, 0.675259, 0.793633], "xyz": [-2.0093398092276282, 4.725916287428031, 7.71461332814209], "label": "As", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "As", "occu": 1}], "abc": [0.324741, 0.413732, 0.793633], "xyz": [0.9525915335425013, 2.8955745831305824, 7.71461332814209], "label": "As", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "As", "occu": 1}], "abc": [0.919601, 0.577675, 0.460299], "xyz": [5.097433465685131, 4.042957874445195, 4.474396604388271], "label": "As", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "As", "occu": 1}], "abc": [0.755658, 0.008592, 0.126966], "xyz": [6.07203461145756, 0.06013259022327973, 1.2341896012651803], "label": "As", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "As", "occu": 1}], "abc": [0.991408, 0.747066, 0.126966], "xyz": [4.993276723542501, 5.2284699310689815, 1.2341896012651807], "label": "As", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "As", "occu": 1}], "abc": [0.586268, 0.911009, 0.793633], "xyz": [1.056748275685132, 6.3758532223835935, 7.714613328142091], "label": "As", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "As", "occu": 1}], "abc": [0.422325, 0.341926, 0.460299], "xyz": [2.0313494214575605, 2.3930279381616786, 4.474396604388271], "label": "As", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "As", "occu": 1}], "abc": [0.658074, 0.080399, 0.460299], "xyz": [4.99327268285731, 0.5626862338642302, 4.474396604388271], "label": "As", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "S", "occu": 1}], "abc": [0.333333, 0.666667, 0.061628], "xyz": [-4.040685188557621e-06, 4.665783697204751, 0.5990630306284405], "label": "S", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "S", "occu": 1}], "abc": [0.078277, 0.424012, 0.53851], "xyz": [-1.0807135795470186, 2.9675209317683056, 5.2346568544123], "label": "S", "properties": {"lmm": -0.0, "soc": null, "ecc": null}}, {"species": [{"element": "S", "occu": 1}], "abc": [0.242655, 0.987599, 0.871843], "xyz": [-2.029591723399907, 6.911881514422816, 8.474863857535391], "label": "S", "properties": {"lmm": -0.0, "soc": null, "ecc": null}}, {"species": [{"element": "S", "occu": 1}], "abc": [0.012401, 0.255056, 0.871843], "xyz": [-0.9303839277382593, 1.7850532974847337, 8.474863857535391], "label": "S", "properties": {"lmm": -0.0, "soc": null, "ecc": null}}, {"species": [{"element": "S", "occu": 1}], "abc": [0.0, 0.0, 0.608952], "xyz": [0.0, 0.0, 5.91939752429496], "label": "S", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "S", "occu": 1}], "abc": [0.0, 0.0, 0.394962], "xyz": [0.0, 0.0, 3.8392797543822597], "label": "S", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "S", "occu": 1}], "abc": [0.744944, 0.757345, 0.871843], "xyz": [2.9599756511381723, 5.300409281034658, 8.474863857535391], "label": "S", "properties": {"lmm": -0.0, "soc": null, "ecc": null}}, {"species": [{"element": "S", "occu": 1}], "abc": [0.909322, 0.320932, 0.205176], "xyz": [6.0517826972852795, 2.246097817218064, 1.9944401306584805], "label": "S", "properties": {"lmm": -0.0, "soc": null, "ecc": null}}, {"species": [{"element": "S", "occu": 1}], "abc": [0.679068, 0.588389, 0.205176], "xyz": [3.1103053029469314, 4.1179416467510865, 1.9944401306584805], "label": "S", "properties": {"lmm": -0.0, "soc": null, "ecc": null}}, {"species": [{"element": "S", "occu": 1}], "abc": [0.666667, 0.333333, 0.942285], "xyz": [4.0406892306851905, 2.3328883492663524, 9.15960452741805], "label": "S", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "S", "occu": 1}], "abc": [0.666667, 0.333333, 0.728295], "xyz": [4.0406892306851905, 2.3328883492663524, 7.079486757505351], "label": "S", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}, {"species": [{"element": "S", "occu": 1}], "abc": [0.411611, 0.090678, 0.205176], "xyz": [2.95997969182336, 0.6346255838299066, 1.9944401306584802], "label": "S", "properties": {"lmm": -0.0, "soc": null, "ecc": null}}, {"species": [{"element": "S", "occu": 1}], "abc": [0.575988, 0.654266, 0.53851], "xyz": [2.011089425914902, 4.578993165156463, 5.234656854412301], "label": "S", "properties": {"lmm": -0.0, "soc": null, "ecc": null}}, {"species": [{"element": "S", "occu": 1}], "abc": [0.345734, 0.921723, 0.53851], "xyz": [-0.9303879684234475, 6.450836994689484, 5.234656854412301], "label": "S", "properties": {"lmm": -0.0, "soc": null, "ecc": null}}, {"species": [{"element": "S", "occu": 1}], "abc": [0.333333, 0.666667, 0.275618], "xyz": [-4.040685188557621e-06, 4.665783697204751, 2.67918080054114], "label": "S", "properties": {"lmm": 0.0, "soc": null, "ecc": null}}]}