{"@module": "pymatgen.core.structure", "@class": "Structure", "charge": 0, "lattice": {"matrix": [[15.91781651, 0.0, 9.746851519193196e-16], [3.5942153866758674e-15, 22.35038097, 1.3685661257317207e-15], [0.0, 0.0, 9.17678558]], "pbc": [true, true, true], "a": 15.91781651, "b": 22.35038097, "c": 9.17678558, "alpha": 90.0, "beta": 90.0, "gamma": 89.99999999999999, "volume": 3264.818244424088}, "sites": [{"species": [{"element": "Cr", "occu": 1}], "abc": [0.5, 0.726484, 0.43684], "xyz": [7.9589082550000025, 16.23719416860948, 4.008787012767201], "label": "Cr", "properties": {"lmm": 0.0017, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.5, 0.273516, 0.56316], "xyz": [7.958908255000001, 6.11318680139052, 5.167998567232801], "label": "Cr", "properties": {"lmm": 0.0017, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.5, 0.726484, 0.06316], "xyz": [7.9589082550000025, 16.23719416860948, 0.5796057772328015], "label": "Cr", "properties": {"lmm": 0.0017, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.5, 0.273516, 0.93684], "xyz": [7.958908255000001, 6.11318680139052, 8.5971798027672], "label": "Cr", "properties": {"lmm": 0.0017, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.5, 0.87707, 0.436265], "xyz": [7.958908255000003, 19.6028486373579, 4.003510361058702], "label": "Cr", "properties": {"lmm": -0.0007, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.5, 0.12293, 0.563735], "xyz": [7.958908255, 2.7475323326420997, 5.173275218941301], "label": "Cr", "properties": {"lmm": -0.0007, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.5, 0.87707, 0.063735], "xyz": [7.958908255000003, 19.6028486373579, 0.5848824289413017], "label": "Cr", "properties": {"lmm": -0.0008, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.5, 0.12293, 0.936265], "xyz": [7.958908255, 2.7475323326420997, 8.591903151058702], "label": "Cr", "properties": {"lmm": -0.0008, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.310922, 0.928799, 0.562126], "xyz": [4.949199344922223, 20.75901149455503, 5.158509770943082], "label": "Cr", "properties": {"lmm": 0.0027, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.310922, 0.071201, 0.437874], "xyz": [4.94919934492222, 1.59136947544497, 4.01827580905692], "label": "Cr", "properties": {"lmm": 0.0027, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.310922, 0.928799, 0.937874], "xyz": [4.949199344922223, 20.75901149455503, 8.606668599056922], "label": "Cr", "properties": {"lmm": 0.0025, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.310922, 0.071201, 0.062126], "xyz": [4.94919934492222, 1.59136947544497, 0.5701169809430805], "label": "Cr", "properties": {"lmm": 0.0025, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.689078, 0.071201, 0.437874], "xyz": [10.968617165077779, 1.59136947544497, 4.018275809056921], "label": "Cr", "properties": {"lmm": 0.0027, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.689078, 0.928799, 0.562126], "xyz": [10.968617165077783, 20.75901149455503, 5.158509770943082], "label": "Cr", "properties": {"lmm": 0.0027, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.689078, 0.071201, 0.062126], "xyz": [10.968617165077779, 1.59136947544497, 0.5701169809430808], "label": "Cr", "properties": {"lmm": 0.0025, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.689078, 0.928799, 0.937874], "xyz": [10.968617165077783, 20.75901149455503, 8.606668599056922], "label": "Cr", "properties": {"lmm": 0.0025, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.806237, 0.189031, 0.562188], "xyz": [12.83353262957287, 4.22491486514007, 5.159078731649042], "label": "Cr", "properties": {"lmm": 0.0042, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.806237, 0.810969, 0.437812], "xyz": [12.833532629572874, 18.12546610485993, 4.017706848350962], "label": "Cr", "properties": {"lmm": 0.0042, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.806237, 0.189031, 0.937812], "xyz": [12.83353262957287, 4.22491486514007, 8.606099638350962], "label": "Cr", "properties": {"lmm": 0.0044, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.806237, 0.810969, 0.062188], "xyz": [12.833532629572874, 18.12546610485993, 0.570685941649042], "label": "Cr", "properties": {"lmm": 0.0044, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.193763, 0.810969, 0.437812], "xyz": [3.084283880427133, 18.12546610485993, 4.0177068483509615], "label": "Cr", "properties": {"lmm": 0.0042, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.193763, 0.189031, 0.562188], "xyz": [3.084283880427131, 4.22491486514007, 5.159078731649041], "label": "Cr", "properties": {"lmm": 0.0042, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.193763, 0.810969, 0.062188], "xyz": [3.084283880427133, 18.12546610485993, 0.5706859416490413], "label": "Cr", "properties": {"lmm": 0.0044, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.193763, 0.189031, 0.937812], "xyz": [3.084283880427131, 4.22491486514007, 8.60609963835096], "label": "Cr", "properties": {"lmm": 0.0044, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.0, 0.226484, 0.43684], "xyz": [8.140322776358971e-16, 5.06200368360948, 4.0087870127672005], "label": "Cr", "properties": {"lmm": 0.0017, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.0, 0.773516, 0.56316], "xyz": [2.78018310903997e-15, 17.28837728639052, 5.167998567232801], "label": "Cr", "properties": {"lmm": 0.0017, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.0, 0.226484, 0.06316], "xyz": [8.140322776358971e-16, 5.06200368360948, 0.5796057772328003], "label": "Cr", "properties": {"lmm": 0.002, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.0, 0.773516, 0.93684], "xyz": [2.78018310903997e-15, 17.28837728639052, 8.597179802767203], "label": "Cr", "properties": {"lmm": 0.002, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.0, 0.37707, 0.436265], "xyz": [1.3552707958538694e-15, 8.4276581523579, 4.003510361058701], "label": "Cr", "properties": {"lmm": 0.0007, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.0, 0.62293, 0.563735], "xyz": [2.2389445908219982e-15, 13.9227228176421, 5.173275218941301], "label": "Cr", "properties": {"lmm": 0.0007, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.0, 0.37707, 0.063735], "xyz": [1.3552707958538694e-15, 8.4276581523579, 0.5848824289413006], "label": "Cr", "properties": {"lmm": 0.0008, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.0, 0.62293, 0.936265], "xyz": [2.2389445908219982e-15, 13.9227228176421, 8.591903151058702], "label": "Cr", "properties": {"lmm": 0.0008, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.810922, 0.428799, 0.562126], "xyz": [12.908107599922221, 9.58382100955503, 5.158509770943082], "label": "Cr", "properties": {"lmm": 0.0031, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.810922, 0.571201, 0.437874], "xyz": [12.908107599922221, 12.766559960444969, 4.018275809056922], "label": "Cr", "properties": {"lmm": 0.0031, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.810922, 0.428799, 0.937874], "xyz": [12.908107599922221, 9.58382100955503, 8.606668599056922], "label": "Cr", "properties": {"lmm": 0.0034, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.810922, 0.571201, 0.062126], "xyz": [12.908107599922221, 12.766559960444969, 0.5701169809430816], "label": "Cr", "properties": {"lmm": 0.0034, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.189078, 0.571201, 0.437874], "xyz": [3.0097089100777823, 12.766559960444969, 4.018275809056921], "label": "Cr", "properties": {"lmm": 0.0031, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.189078, 0.428799, 0.562126], "xyz": [3.0097089100777814, 9.58382100955503, 5.158509770943081], "label": "Cr", "properties": {"lmm": 0.0031, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.189078, 0.571201, 0.062126], "xyz": [3.0097089100777823, 12.766559960444969, 0.570116980943081], "label": "Cr", "properties": {"lmm": 0.0034, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.189078, 0.428799, 0.937874], "xyz": [3.0097089100777814, 9.58382100955503, 8.60666859905692], "label": "Cr", "properties": {"lmm": 0.0034, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.306237, 0.689031, 0.562188], "xyz": [4.874624374572872, 15.400105350140068, 5.159078731649042], "label": "Cr", "properties": {"lmm": 0.0048, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.306237, 0.310969, 0.437812], "xyz": [4.87462437457287, 6.95027561985993, 4.017706848350961], "label": "Cr", "properties": {"lmm": 0.0048, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.306237, 0.689031, 0.937812], "xyz": [4.874624374572872, 15.400105350140068, 8.606099638350962], "label": "Cr", "properties": {"lmm": 0.0046, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.306237, 0.310969, 0.062188], "xyz": [4.87462437457287, 6.95027561985993, 0.5706859416490407], "label": "Cr", "properties": {"lmm": 0.0046, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.693763, 0.310969, 0.437812], "xyz": [11.043192135427132, 6.95027561985993, 4.0177068483509615], "label": "Cr", "properties": {"lmm": 0.0048, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.693763, 0.689031, 0.562188], "xyz": [11.043192135427132, 15.400105350140068, 5.159078731649042], "label": "Cr", "properties": {"lmm": 0.0048, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.693763, 0.310969, 0.062188], "xyz": [11.043192135427132, 6.95027561985993, 0.5706859416490412], "label": "Cr", "properties": {"lmm": 0.0046, "soc": null, "ecc": null}}, {"species": [{"element": "Cr", "occu": 1}], "abc": [0.693763, 0.689031, 0.937812], "xyz": [11.043192135427132, 15.400105350140068, 8.606099638350962], "label": "Cr", "properties": {"lmm": 0.0046, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.5, 0.719049, 0.25], "xyz": [7.9589082550000025, 16.071019086097532, 2.2941963950000015], "label": "N", "properties": {"lmm": -0.0019, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.5, 0.280951, 0.75], "xyz": [7.958908255000001, 6.27936188390247, 6.882589185000001], "label": "N", "properties": {"lmm": -0.0019, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.5, 0.885966, 0.25], "xyz": [7.958908255000003, 19.801677626467022, 2.294196395000002], "label": "N", "properties": {"lmm": 0.0001, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.5, 0.114034, 0.75], "xyz": [7.958908255, 2.54870334353298, 6.882589185000001], "label": "N", "properties": {"lmm": 0.0001, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.309868, 0.928706, 0.75], "xyz": [4.932421966320683, 20.75693290912482, 6.882589185000002], "label": "N", "properties": {"lmm": -0.0027, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.309868, 0.071294, 0.25], "xyz": [4.932421966320679, 1.59344806087518, 2.2941963950000006], "label": "N", "properties": {"lmm": -0.0027, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.690132, 0.071294, 0.25], "xyz": [10.98539454367932, 1.59344806087518, 2.294196395000001], "label": "N", "properties": {"lmm": -0.0027, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.690132, 0.928706, 0.75], "xyz": [10.985394543679323, 20.75693290912482, 6.882589185000002], "label": "N", "properties": {"lmm": -0.0027, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.803243, 0.19011, 0.75], "xyz": [12.78587468694193, 4.2490309262067, 6.882589185000001], "label": "N", "properties": {"lmm": -0.0039, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.803243, 0.80989, 0.25], "xyz": [12.785874686941934, 18.1013500437933, 2.294196395000002], "label": "N", "properties": {"lmm": -0.0039, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.196757, 0.80989, 0.25], "xyz": [3.1319418230580727, 18.1013500437933, 2.2941963950000015], "label": "N", "properties": {"lmm": -0.0039, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.196757, 0.19011, 0.75], "xyz": [3.1319418230580705, 4.2490309262067, 6.882589185000001], "label": "N", "properties": {"lmm": -0.0039, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.5, 0.801799, 0.476229], "xyz": [7.9589082550000025, 17.920513111365032, 4.370251419977822], "label": "N", "properties": {"lmm": 0.0008, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.5, 0.198201, 0.523771], "xyz": [7.958908255000001, 4.42986785863497, 4.806534160022181], "label": "N", "properties": {"lmm": 0.0008, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.5, 0.801799, 0.023771], "xyz": [7.9589082550000025, 17.920513111365032, 0.2181413700221816], "label": "N", "properties": {"lmm": 0.001, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.5, 0.198201, 0.976229], "xyz": [7.958908255000001, 4.42986785863497, 8.958644209977821], "label": "N", "properties": {"lmm": 0.001, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.41038, 0.910004, 0.504876], "xyz": [6.532353539373804, 20.33893608422388, 4.6331387964880815], "label": "N", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.41038, 0.089996, 0.495124], "xyz": [6.5323535393738, 2.01144488577612, 4.543646783511921], "label": "N", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.41038, 0.910004, 0.995124], "xyz": [6.532353539373804, 20.33893608422388, 9.132039573511923], "label": "N", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.41038, 0.089996, 0.004876], "xyz": [6.5323535393738, 2.01144488577612, 0.044746006488080525], "label": "N", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.58962, 0.089996, 0.495124], "xyz": [9.3854629706262, 2.01144488577612, 4.543646783511921], "label": "N", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.58962, 0.910004, 0.504876], "xyz": [9.385462970626204, 20.33893608422388, 4.633138796488082], "label": "N", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.58962, 0.089996, 0.004876], "xyz": [9.3854629706262, 2.01144488577612, 0.044746006488080706], "label": "N", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.58962, 0.910004, 0.995124], "xyz": [9.385462970626204, 20.33893608422388, 9.132039573511923], "label": "N", "properties": {"lmm": -0.0003, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.287956, 0.0, 0.5], "xyz": [4.58363077095356, 0.0, 4.58839279], "label": "N", "properties": {"lmm": -0.0016, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.287956, 0.0, 0.0], "xyz": [4.58363077095356, 0.0, 2.806664376060796e-16], "label": "N", "properties": {"lmm": -0.0014, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.712044, 0.0, 0.5], "xyz": [11.33418573904644, 0.0, 4.588392790000001], "label": "N", "properties": {"lmm": -0.0016, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.712044, 0.0, 0.0], "xyz": [11.33418573904644, 0.0, 6.9401871431324e-16], "label": "N", "properties": {"lmm": -0.0014, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.23974, 0.876557, 0.498228], "xyz": [3.816137330107403, 19.59138289192029, 4.5721315259522415], "label": "N", "properties": {"lmm": -0.0017, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.23974, 0.123443, 0.501772], "xyz": [3.8161373301074004, 2.75899807807971, 4.604654054047761], "label": "N", "properties": {"lmm": -0.0017, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.23974, 0.876557, 0.001772], "xyz": [3.816137330107403, 19.59138289192029, 0.016261264047761435], "label": "N", "properties": {"lmm": -0.0017, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.23974, 0.123443, 0.998228], "xyz": [3.8161373301074004, 2.75899807807971, 9.160524315952241], "label": "N", "properties": {"lmm": -0.0017, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.76026, 0.123443, 0.501772], "xyz": [12.101679179892601, 2.75899807807971, 4.604654054047761], "label": "N", "properties": {"lmm": -0.0017, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.76026, 0.876557, 0.498228], "xyz": [12.101679179892605, 19.59138289192029, 4.572131525952242], "label": "N", "properties": {"lmm": -0.0017, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.76026, 0.123443, 0.998228], "xyz": [12.101679179892601, 2.75899807807971, 9.160524315952241], "label": "N", "properties": {"lmm": -0.0017, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.76026, 0.876557, 0.001772], "xyz": [12.101679179892605, 19.59138289192029, 0.01626126404776194], "label": "N", "properties": {"lmm": -0.0017, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.75, 0.25, 0.5], "xyz": [11.938362382500001, 5.5875952425, 4.588392790000001], "label": "N", "properties": {"lmm": -0.0016, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.75, 0.75, 0.5], "xyz": [11.938362382500003, 16.7627857275, 4.588392790000002], "label": "N", "properties": {"lmm": -0.0016, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.75, 0.25, 0.0], "xyz": [11.938362382500001, 5.5875952425, 1.07315539537242e-15], "label": "N", "properties": {"lmm": -0.0018, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.75, 0.75, 0.0], "xyz": [11.938362382500003, 16.7627857275, 1.7574384582382802e-15], "label": "N", "properties": {"lmm": -0.0018, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.409451, 0.694238, 0.505393], "xyz": [6.517565887836013, 15.51648378385086, 4.637883194632941], "label": "N", "properties": {"lmm": -0.0019, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.409451, 0.305762, 0.494607], "xyz": [6.517565887836011, 6.833897186149139, 4.538902385367061], "label": "N", "properties": {"lmm": -0.0019, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.409451, 0.694238, 0.994607], "xyz": [6.517565887836013, 15.51648378385086, 9.127295175367061], "label": "N", "properties": {"lmm": -0.0018, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.409451, 0.305762, 0.005393], "xyz": [6.517565887836011, 6.833897186149139, 0.049490404632940826], "label": "N", "properties": {"lmm": -0.0018, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.590549, 0.305762, 0.494607], "xyz": [9.400250622163991, 6.833897186149139, 4.538902385367061], "label": "N", "properties": {"lmm": -0.0019, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.590549, 0.694238, 0.505393], "xyz": [9.400250622163991, 15.51648378385086, 4.637883194632941], "label": "N", "properties": {"lmm": -0.0019, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.590549, 0.305762, 0.005393], "xyz": [9.400250622163991, 6.833897186149139, 0.049490404632941], "label": "N", "properties": {"lmm": -0.0018, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.590549, 0.694238, 0.994607], "xyz": [9.400250622163991, 15.51648378385086, 9.127295175367061], "label": "N", "properties": {"lmm": -0.0018, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.0, 0.219049, 0.25], "xyz": [7.87309286235962e-16, 4.89582860109753, 2.2941963950000006], "label": "N", "properties": {"lmm": -0.002, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.0, 0.780951, 0.75], "xyz": [2.806906100439905e-15, 17.45455236890247, 6.882589185000001], "label": "N", "properties": {"lmm": -0.002, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.0, 0.385966, 0.25], "xyz": [1.3872449359337377e-15, 8.626487141467019, 2.2941963950000006], "label": "N", "properties": {"lmm": -0.0007, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.0, 0.614034, 0.75], "xyz": [2.2069704507421295e-15, 13.72389382853298, 6.882589185000001], "label": "N", "properties": {"lmm": -0.0007, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.809868, 0.428706, 0.75], "xyz": [12.891330221320683, 9.581742424124819, 6.882589185000002], "label": "N", "properties": {"lmm": -0.0031, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.809868, 0.571294, 0.25], "xyz": [12.891330221320683, 12.768638545875179, 2.294196395000002], "label": "N", "properties": {"lmm": -0.0031, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.190132, 0.571294, 0.25], "xyz": [3.026486288679322, 12.768638545875179, 2.294196395000001], "label": "N", "properties": {"lmm": -0.0031, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.190132, 0.428706, 0.75], "xyz": [3.026486288679321, 9.581742424124819, 6.882589185000001], "label": "N", "properties": {"lmm": -0.0031, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.303243, 0.69011, 0.75], "xyz": [4.8269664319419325, 15.4242214112067, 6.882589185000001], "label": "N", "properties": {"lmm": -0.0042, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.303243, 0.30989, 0.25], "xyz": [4.826966431941931, 6.9261595587933, 2.294196395000001], "label": "N", "properties": {"lmm": -0.0042, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.696757, 0.30989, 0.25], "xyz": [11.090850078058072, 6.9261595587933, 2.294196395000001], "label": "N", "properties": {"lmm": -0.0042, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.696757, 0.69011, 0.75], "xyz": [11.090850078058072, 15.4242214112067, 6.882589185000002], "label": "N", "properties": {"lmm": -0.0042, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.0, 0.301799, 0.476229], "xyz": [1.08473060948339e-15, 6.74532262636503, 4.370251419977821], "label": "N", "properties": {"lmm": 0.0005, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.0, 0.698201, 0.523771], "xyz": [2.509484777192477e-15, 15.605058343634969, 4.806534160022181], "label": "N", "properties": {"lmm": 0.0005, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.0, 0.301799, 0.023771], "xyz": [1.08473060948339e-15, 6.74532262636503, 0.21814137002218043], "label": "N", "properties": {"lmm": 0.0005, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.0, 0.698201, 0.976229], "xyz": [2.509484777192477e-15, 15.605058343634969, 8.958644209977821], "label": "N", "properties": {"lmm": 0.0005, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.91038, 0.410004, 0.504876], "xyz": [14.4912617943738, 9.16374559922388, 4.6331387964880815], "label": "N", "properties": {"lmm": -0.0009, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.91038, 0.589996, 0.495124], "xyz": [14.4912617943738, 13.18663537077612, 4.543646783511922], "label": "N", "properties": {"lmm": -0.0009, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.91038, 0.410004, 0.995124], "xyz": [14.4912617943738, 9.16374559922388, 9.132039573511921], "label": "N", "properties": {"lmm": -0.001, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.91038, 0.589996, 0.004876], "xyz": [14.4912617943738, 13.18663537077612, 0.0447460064880817], "label": "N", "properties": {"lmm": -0.001, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.08962, 0.589996, 0.495124], "xyz": [1.4265547156262022, 13.18663537077612, 4.543646783511921], "label": "N", "properties": {"lmm": -0.0009, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.08962, 0.410004, 0.504876], "xyz": [1.4265547156262015, 9.16374559922388, 4.633138796488081], "label": "N", "properties": {"lmm": -0.0009, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.08962, 0.589996, 0.004876], "xyz": [1.4265547156262022, 13.18663537077612, 0.0447460064880809], "label": "N", "properties": {"lmm": -0.001, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.08962, 0.410004, 0.995124], "xyz": [1.4265547156262015, 9.16374559922388, 9.132039573511921], "label": "N", "properties": {"lmm": -0.001, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.787956, 0.5, 0.5], "xyz": [12.54253902595356, 11.175190485, 4.588392790000002], "label": "N", "properties": {"lmm": -0.0015, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.787956, 0.5, 0.0], "xyz": [12.54253902595356, 11.175190485, 1.4522920764315997e-15], "label": "N", "properties": {"lmm": -0.0019, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.212044, 0.5, 0.5], "xyz": [3.3752774840464417, 11.175190485, 4.588392790000001], "label": "N", "properties": {"lmm": -0.0015, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.212044, 0.5, 0.0], "xyz": [3.3752774840464417, 11.175190485, 8.909592012194406e-16], "label": "N", "properties": {"lmm": -0.0019, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.73974, 0.376557, 0.498228], "xyz": [11.775045585107401, 8.41619240692029, 4.5721315259522415], "label": "N", "properties": {"lmm": -0.002, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.73974, 0.623443, 0.501772], "xyz": [11.775045585107401, 13.93418856307971, 4.604654054047762], "label": "N", "properties": {"lmm": -0.002, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.73974, 0.376557, 0.001772], "xyz": [11.775045585107401, 8.41619240692029, 0.016261264047761237], "label": "N", "properties": {"lmm": -0.002, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.73974, 0.623443, 0.998228], "xyz": [11.775045585107401, 13.93418856307971, 9.160524315952243], "label": "N", "properties": {"lmm": -0.002, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.26026, 0.623443, 0.501772], "xyz": [4.142770924892602, 13.93418856307971, 4.604654054047761], "label": "N", "properties": {"lmm": -0.002, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.26026, 0.376557, 0.498228], "xyz": [4.142770924892601, 8.41619240692029, 4.5721315259522415], "label": "N", "properties": {"lmm": -0.002, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.26026, 0.623443, 0.998228], "xyz": [4.142770924892602, 13.93418856307971, 9.160524315952241], "label": "N", "properties": {"lmm": -0.002, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.26026, 0.376557, 0.001772], "xyz": [4.142770924892601, 8.41619240692029, 0.01626126404776077], "label": "N", "properties": {"lmm": -0.002, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.25, 0.75, 0.5], "xyz": [3.9794541275000026, 16.7627857275, 4.588392790000001], "label": "N", "properties": {"lmm": -0.0016, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.25, 0.25, 0.5], "xyz": [3.979454127500001, 5.5875952425, 4.588392790000001], "label": "N", "properties": {"lmm": -0.0016, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.25, 0.75, 0.0], "xyz": [3.9794541275000026, 16.7627857275, 1.2700958822786204e-15], "label": "N", "properties": {"lmm": -0.0018, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.25, 0.25, 0.0], "xyz": [3.979454127500001, 5.5875952425, 5.858128194127601e-16], "label": "N", "properties": {"lmm": -0.0018, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.909451, 0.194238, 0.505393], "xyz": [14.47647414283601, 4.34129329885086, 4.637883194632941], "label": "N", "properties": {"lmm": -0.0017, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.909451, 0.805762, 0.494607], "xyz": [14.476474142836013, 18.00908767114914, 4.538902385367063], "label": "N", "properties": {"lmm": -0.0017, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.909451, 0.194238, 0.994607], "xyz": [14.47647414283601, 4.34129329885086, 9.127295175367061], "label": "N", "properties": {"lmm": -0.0019, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.909451, 0.805762, 0.005393], "xyz": [14.476474142836013, 18.00908767114914, 0.04949040463294199], "label": "N", "properties": {"lmm": -0.0019, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.090549, 0.805762, 0.494607], "xyz": [1.4413423671639929, 18.00908767114914, 4.538902385367062], "label": "N", "properties": {"lmm": -0.0017, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.090549, 0.194238, 0.505393], "xyz": [1.4413423671639907, 4.34129329885086, 4.63788319463294], "label": "N", "properties": {"lmm": -0.0017, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.090549, 0.805762, 0.005393], "xyz": [1.4413423671639929, 18.00908767114914, 0.049490404632941194], "label": "N", "properties": {"lmm": -0.0019, "soc": null, "ecc": null}}, {"species": [{"element": "N", "occu": 1}], "abc": [0.090549, 0.194238, 0.994607], "xyz": [1.4413423671639907, 4.34129329885086, 9.127295175367061], "label": "N", "properties": {"lmm": -0.0019, "soc": null, "ecc": null}}]}