{
    "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt"
    "instance-id" 1
    "space-group" {
        "source-value" "Pca2_1"
    }
    "basis-atom-coordinates" {
        "source-value" [
            [
                0.879634
                0.636268
                0.249239
            ]
            [
                0.120366
                0.136268
                0.750761
            ]
            [
                0.879634
                0.136268
                0.250761
            ]
            [
                0.120366
                0.636268
                0.749239
            ]
            [
                0.937425
                0.605742
                0.13003
            ]
            [
                0.062575
                0.105742
                0.86997
            ]
            [
                0.937425
                0.105742
                0.36997
            ]
            [
                0.062575
                0.605742
                0.63003
            ]
            [
                0.063368
                0.799373
                0.333721
            ]
            [
                0.936632
                0.299373
                0.666279
            ]
            [
                0.063368
                0.299373
                0.166279
            ]
            [
                0.936632
                0.799373
                0.833721
            ]
            [
                0.30833
                0.821819
                0.307177
            ]
            [
                0.69167
                0.321819
                0.692823
            ]
            [
                0.30833
                0.321819
                0.192823
            ]
            [
                0.69167
                0.821819
                0.807177
            ]
            [
                0.256512
                0.611168
                0.092319
            ]
            [
                0.743488
                0.111168
                0.907681
            ]
            [
                0.256512
                0.111168
                0.407681
            ]
            [
                0.743488
                0.611168
                0.592319
            ]
            [
                0.676667
                0.800876
                0.044083
            ]
            [
                0.323333
                0.300876
                0.955917
            ]
            [
                0.676667
                0.300876
                0.455917
            ]
            [
                0.323333
                0.800876
                0.544083
            ]
            [
                0.591498
                0.623447
                0.075938
            ]
            [
                0.408502
                0.123447
                0.924062
            ]
            [
                0.591498
                0.123447
                0.424062
            ]
            [
                0.408502
                0.623447
                0.575938
            ]
            [
                0.281005
                0.981985
                0.146227
            ]
            [
                0.718995
                0.481985
                0.853773
            ]
            [
                0.281005
                0.481985
                0.353773
            ]
            [
                0.718995
                0.981985
                0.646227
            ]
            [
                0.527325
                0.002666
                0.128535
            ]
            [
                0.472675
                0.502666
                0.871465
            ]
            [
                0.527325
                0.502666
                0.371465
            ]
            [
                0.472675
                0.002666
                0.628535
            ]
            [
                0.140727
                0.711989
                0.208929
            ]
            [
                0.859273
                0.211989
                0.791071
            ]
            [
                0.140727
                0.211989
                0.291071
            ]
            [
                0.859273
                0.711989
                0.708929
            ]
            [
                0.424533
                0.79304
                0.11748
            ]
            [
                0.575467
                0.29304
                0.88252
            ]
            [
                0.424533
                0.29304
                0.38252
            ]
            [
                0.575467
                0.79304
                0.61748
            ]
            [
                0.976771
                0.641843
                0.195615
            ]
            [
                0.023229
                0.141843
                0.804385
            ]
            [
                0.976771
                0.141843
                0.304385
            ]
            [
                0.023229
                0.641843
                0.695615
            ]
            [
                0.175451
                0.783496
                0.288297
            ]
            [
                0.824549
                0.283496
                0.711703
            ]
            [
                0.175451
                0.283496
                0.211703
            ]
            [
                0.824549
                0.783496
                0.788297
            ]
            [
                0.276294
                0.698896
                0.138701
            ]
            [
                0.723706
                0.198896
                0.861299
            ]
            [
                0.276294
                0.198896
                0.361299
            ]
            [
                0.723706
                0.698896
                0.638701
            ]
            [
                0.572047
                0.735023
                0.072355
            ]
            [
                0.427953
                0.235023
                0.927645
            ]
            [
                0.572047
                0.235023
                0.427645
            ]
            [
                0.427953
                0.735023
                0.572355
            ]
            [
                0.413354
                0.935037
                0.139221
            ]
            [
                0.586646
                0.435037
                0.860779
            ]
            [
                0.413354
                0.435037
                0.360779
            ]
            [
                0.586646
                0.935037
                0.639221
            ]
            [
                0.043816
                0.022506
                0.543847
            ]
            [
                0.956184
                0.522506
                0.456153
            ]
            [
                0.043816
                0.522506
                0.956153
            ]
            [
                0.956184
                0.022506
                0.043847
            ]
            [
                0.341056
                0.821099
                0.860658
            ]
            [
                0.658944
                0.321099
                0.139342
            ]
            [
                0.341056
                0.321099
                0.639342
            ]
            [
                0.658944
                0.821099
                0.360658
            ]
            [
                0.018247
                0.971974
                0.625257
            ]
            [
                0.981753
                0.471974
                0.374743
            ]
            [
                0.018247
                0.471974
                0.874743
            ]
            [
                0.981753
                0.971974
                0.125257
            ]
            [
                0.925132
                0.108918
                0.507133
            ]
            [
                0.074868
                0.608918
                0.492867
            ]
            [
                0.925132
                0.608918
                0.992867
            ]
            [
                0.074868
                0.108918
                0.007133
            ]
            [
                0.19507
                0.984753
                0.497841
            ]
            [
                0.80493
                0.484753
                0.502159
            ]
            [
                0.19507
                0.484753
                0.002159
            ]
            [
                0.80493
                0.984753
                0.997841
            ]
            [
                0.470177
                0.918117
                0.872036
            ]
            [
                0.529823
                0.418117
                0.127964
            ]
            [
                0.470177
                0.418117
                0.627964
            ]
            [
                0.529823
                0.918117
                0.372036
            ]
            [
                0.177957
                0.838223
                0.896806
            ]
            [
                0.822043
                0.338223
                0.103194
            ]
            [
                0.177957
                0.338223
                0.603194
            ]
            [
                0.822043
                0.838223
                0.396806
            ]
            [
                0.379168
                0.706841
                0.812485
            ]
            [
                0.620832
                0.206841
                0.187515
            ]
            [
                0.379168
                0.206841
                0.687515
            ]
            [
                0.620832
                0.706841
                0.312485
            ]
        ]
    }
    "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"
            "H"
            "H"
            "H"
            "H"
            "C"
            "C"
            "C"
            "C"
            "C"
            "C"
            "C"
            "C"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "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" 6.9895862
        "source-unit" "angstrom"
    }
    "b" {
        "source-value" 9.10706881
        "source-unit" "angstrom"
    }
    "c" {
        "source-value" 14.23136015
        "source-unit" "angstrom"
    }
}