{
    "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt"
    "instance-id" 1
    "space-group" {
        "source-value" "P2_1/c"
    }
    "basis-atom-coordinates" {
        "source-value" [
            [
                0.522567
                0.65635
                0.538903
            ]
            [
                0.500774
                0.386634
                0.325566
            ]
            [
                0.261314
                0.2693
                0.621669
            ]
            [
                0.499226
                0.613366
                0.674434
            ]
            [
                0.655757
                0.572919
                0.349674
            ]
            [
                0.578179
                0.724905
                0.360084
            ]
            [
                0.655757
                0.927081
                0.849674
            ]
            [
                0.340724
                0.393558
                0.308177
            ]
            [
                0.344243
                0.427081
                0.650326
            ]
            [
                0.64785
                0.653978
                0.156945
            ]
            [
                0.35215
                0.153978
                0.343055
            ]
            [
                0.738686
                0.7307
                0.378331
            ]
            [
                0.477433
                0.15635
                0.961097
            ]
            [
                0.64785
                0.846022
                0.656945
            ]
            [
                0.421821
                0.224905
                0.139916
            ]
            [
                0.503037
                0.14906
                0.360474
            ]
            [
                0.35215
                0.346022
                0.843055
            ]
            [
                0.522567
                0.84365
                0.038903
            ]
            [
                0.578179
                0.775095
                0.860084
            ]
            [
                0.421821
                0.275095
                0.639916
            ]
            [
                0.340724
                0.106442
                0.808177
            ]
            [
                0.499226
                0.886634
                0.174434
            ]
            [
                0.344243
                0.072919
                0.150326
            ]
            [
                0.477433
                0.34365
                0.461097
            ]
            [
                0.659276
                0.893558
                0.191823
            ]
            [
                0.496963
                0.64906
                0.139526
            ]
            [
                0.738686
                0.7693
                0.878331
            ]
            [
                0.496963
                0.85094
                0.639526
            ]
            [
                0.500774
                0.113366
                0.825566
            ]
            [
                0.503037
                0.35094
                0.860474
            ]
            [
                0.261314
                0.2307
                0.121669
            ]
            [
                0.659276
                0.606442
                0.691823
            ]
            [
                0.828367
                0.373722
                0.137804
            ]
            [
                0.171633
                0.626278
                0.862196
            ]
            [
                0.828367
                0.126278
                0.637804
            ]
            [
                0.171633
                0.873722
                0.362196
            ]
            [
                0.014077
                0.879895
                0.36891
            ]
            [
                0.913394
                0.365552
                0.321421
            ]
            [
                0.186414
                0.813816
                0.879985
            ]
            [
                0.086606
                0.865552
                0.178579
            ]
            [
                0.434424
                0.158569
                0.855265
            ]
            [
                0.086606
                0.634448
                0.678579
            ]
            [
                0.644069
                0.680456
                0.329392
            ]
            [
                0.014077
                0.620105
                0.86891
            ]
            [
                0.355931
                0.319544
                0.670608
            ]
            [
                0.565576
                0.658569
                0.644735
            ]
            [
                0.813586
                0.186184
                0.120015
            ]
            [
                0.186414
                0.686184
                0.379985
            ]
            [
                0.985923
                0.379895
                0.13109
            ]
            [
                0.813586
                0.313816
                0.620015
            ]
            [
                0.644069
                0.819544
                0.829392
            ]
            [
                0.565576
                0.841431
                0.144735
            ]
            [
                0.985923
                0.120105
                0.63109
            ]
            [
                0.434424
                0.341431
                0.355265
            ]
            [
                0.355931
                0.180456
                0.170608
            ]
            [
                0.913394
                0.134448
                0.821421
            ]
            [
                0.413681
                0.301166
                0.813555
            ]
            [
                0.586319
                0.801166
                0.686445
            ]
            [
                0.413681
                0.198834
                0.313555
            ]
            [
                0.586319
                0.698834
                0.186445
            ]
            [
                0.161988
                0.380399
                0.846577
            ]
            [
                0.619718
                0.121339
                0.634932
            ]
            [
                0.838012
                0.619601
                0.153423
            ]
            [
                0.380282
                0.878661
                0.365068
            ]
            [
                0.711162
                0.109388
                0.400897
            ]
            [
                0.161988
                0.119601
                0.346577
            ]
            [
                0.288838
                0.890612
                0.599103
            ]
            [
                0.838012
                0.880399
                0.653423
            ]
            [
                0.619718
                0.378661
                0.134932
            ]
            [
                0.288838
                0.609388
                0.099103
            ]
            [
                0.380282
                0.621339
                0.865068
            ]
            [
                0.711162
                0.390612
                0.900897
            ]
            [
                0.198896
                0.928468
                0.892912
            ]
            [
                0.919545
                0.613085
                0.875206
            ]
            [
                0.0359
                0.86244
                0.066634
            ]
            [
                0.9641
                0.13756
                0.933366
            ]
            [
                0.0359
                0.63756
                0.566634
            ]
            [
                0.080455
                0.386915
                0.124794
            ]
            [
                0.9641
                0.36244
                0.433366
            ]
            [
                0.919545
                0.886915
                0.375206
            ]
            [
                0.801104
                0.428468
                0.607088
            ]
            [
                0.198896
                0.571532
                0.392912
            ]
            [
                0.080455
                0.113085
                0.624794
            ]
            [
                0.801104
                0.071532
                0.107088
            ]
        ]
    }
    "species" {
        "source-value" [
            "H"
            "H"
            "H"
            "H"
            "H"
            "H"
            "H"
            "H"
            "H"
            "H"
            "H"
            "H"
            "H"
            "H"
            "H"
            "H"
            "H"
            "H"
            "H"
            "H"
            "H"
            "H"
            "H"
            "H"
            "H"
            "H"
            "H"
            "H"
            "H"
            "H"
            "H"
            "H"
            "Ru"
            "Ru"
            "Ru"
            "Ru"
            "C"
            "C"
            "C"
            "C"
            "C"
            "C"
            "C"
            "C"
            "C"
            "C"
            "C"
            "C"
            "C"
            "C"
            "C"
            "C"
            "C"
            "C"
            "C"
            "C"
            "N"
            "N"
            "N"
            "N"
            "Cl"
            "Cl"
            "Cl"
            "Cl"
            "Cl"
            "Cl"
            "Cl"
            "Cl"
            "Cl"
            "Cl"
            "Cl"
            "Cl"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
        ]
    }
    "cauchy-stress" {
        "source-value" [
            0
            0
            0
            0
            0
            0
        ]
        "source-unit" "GPa"
    }
    "temperature" {
        "source-value" 0
        "source-unit" "K"
    }
    "a" {
        "source-value" 11.7663793703
        "source-unit" "angstrom"
    }
    "b" {
        "source-value" 9.99865979
        "source-unit" "angstrom"
    }
    "c" {
        "source-value" 11.7940695229
        "source-unit" "angstrom"
    }
    "beta" {
        "source-value" 119.100019077
        "source-unit" "degree"
    }
}