{
    "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt"
    "instance-id" 1
    "space-group" {
        "source-value" "Pcmn"
    }
    "basis-atom-coordinates" {
        "source-value" [
            [
                0.737382
                0.75
                0.254246
            ]
            [
                0.253365
                0.75
                0.745155
            ]
            [
                0.237382
                0.25
                0.245754
            ]
            [
                0.246635
                0.75
                0.245155
            ]
            [
                0.262618
                0.25
                0.745754
            ]
            [
                0.762618
                0.75
                0.754246
            ]
            [
                0.753365
                0.25
                0.754845
            ]
            [
                0.746635
                0.25
                0.254845
            ]
            [
                0.261991
                0.75
                0.575765
            ]
            [
                0.761991
                0.25
                0.924235
            ]
            [
                0.276121
                0.75
                0.430549
            ]
            [
                0.257368
                0.25
                0.068153
            ]
            [
                0.715974
                0.75
                0.073334
            ]
            [
                0.742632
                0.75
                0.931847
            ]
            [
                0.284026
                0.25
                0.926666
            ]
            [
                0.238009
                0.75
                0.075765
            ]
            [
                0.784026
                0.75
                0.573334
            ]
            [
                0.757368
                0.75
                0.431847
            ]
            [
                0.723879
                0.25
                0.569451
            ]
            [
                0.215974
                0.25
                0.426666
            ]
            [
                0.242632
                0.25
                0.568153
            ]
            [
                0.776121
                0.25
                0.069451
            ]
            [
                0.223879
                0.75
                0.930549
            ]
            [
                0.738009
                0.25
                0.424235
            ]
            [
                0.5
                0.5
                0.5
            ]
            [
                0.488894
                0.497091
                0.360602
            ]
            [
                0.496719
                0.004122
                0.139514
            ]
            [
                0.511106
                0.502909
                0.639398
            ]
            [
                0.5
                0.5
                0
            ]
            [
                0.988894
                0.502909
                0.139398
            ]
            [
                0.011106
                0.497091
                0.860602
            ]
            [
                0.503281
                0.995878
                0.860486
            ]
            [
                0.011106
                0.002909
                0.860602
            ]
            [
                0
                0
                0.5
            ]
            [
                0.511106
                0.997091
                0.639398
            ]
            [
                0
                0.5
                0.5
            ]
            [
                0
                0.5
                0
            ]
            [
                0.996719
                0.995878
                0.360486
            ]
            [
                0.003281
                0.495878
                0.639514
            ]
            [
                0.488894
                0.002909
                0.360602
            ]
            [
                0.988894
                0.997091
                0.139398
            ]
            [
                0.503281
                0.504122
                0.860486
            ]
            [
                0.5
                0
                0
            ]
            [
                0
                0
                0
            ]
            [
                0.496719
                0.495878
                0.139514
            ]
            [
                0.996719
                0.504122
                0.360486
            ]
            [
                0.003281
                0.004122
                0.639514
            ]
            [
                0.5
                0
                0.5
            ]
            [
                0.982684
                0.026782
                0.696825
            ]
            [
                0.257418
                0.988904
                0.882893
            ]
            [
                0.742582
                0.488904
                0.117107
            ]
            [
                0.257042
                0.983005
                0.633072
            ]
            [
                0.749798
                0.560181
                0.511056
            ]
            [
                0.45247
                0.547487
                0.061065
            ]
            [
                0.071256
                0.75
                0.009092
            ]
            [
                0.968797
                0.54792
                0.938286
            ]
            [
                0.021939
                0.25
                0.882831
            ]
            [
                0.04753
                0.952513
                0.561065
            ]
            [
                0.250202
                0.439819
                0.488944
            ]
            [
                0.04753
                0.547487
                0.561065
            ]
            [
                0.517316
                0.026782
                0.196825
            ]
            [
                0.465494
                0.026643
                0.303348
            ]
            [
                0.996744
                0.25
                0.134524
            ]
            [
                0.257418
                0.511096
                0.882893
            ]
            [
                0.95247
                0.452513
                0.438935
            ]
            [
                0.742958
                0.483005
                0.366928
            ]
            [
                0.017817
                0.25
                0.618593
            ]
            [
                0.484645
                0.25
                0.866424
            ]
            [
                0.249798
                0.439819
                0.988944
            ]
            [
                0.017316
                0.973218
                0.303175
            ]
            [
                0.928744
                0.25
                0.990908
            ]
            [
                0.034506
                0.473357
                0.803348
            ]
            [
                0.54753
                0.047487
                0.938935
            ]
            [
                0.531203
                0.95208
                0.438286
            ]
            [
                0.478061
                0.25
                0.382831
            ]
            [
                0.965494
                0.973357
                0.196652
            ]
            [
                0.95247
                0.047487
                0.438935
            ]
            [
                0.757042
                0.016995
                0.866928
            ]
            [
                0.034506
                0.026643
                0.803348
            ]
            [
                0.750202
                0.939819
                0.011056
            ]
            [
                0.503256
                0.25
                0.634524
            ]
            [
                0.496744
                0.75
                0.365476
            ]
            [
                0.482183
                0.25
                0.118593
            ]
            [
                0.742582
                0.011096
                0.117107
            ]
            [
                0.757042
                0.483005
                0.866928
            ]
            [
                0.54753
                0.452513
                0.938935
            ]
            [
                0.457674
                0.75
                0.983307
            ]
            [
                0.465494
                0.473357
                0.303348
            ]
            [
                0.542326
                0.25
                0.016693
            ]
            [
                0.003256
                0.75
                0.865476
            ]
            [
                0.984645
                0.75
                0.633576
            ]
            [
                0.242958
                0.983005
                0.133072
            ]
            [
                0.017316
                0.526782
                0.303175
            ]
            [
                0.757418
                0.488904
                0.617107
            ]
            [
                0.015355
                0.25
                0.366424
            ]
            [
                0.978061
                0.75
                0.117169
            ]
            [
                0.534506
                0.526643
                0.696652
            ]
            [
                0.982183
                0.75
                0.381407
            ]
            [
                0.242582
                0.511096
                0.382893
            ]
            [
                0.482684
                0.526782
                0.803175
            ]
            [
                0.031203
                0.04792
                0.061714
            ]
            [
                0.749798
                0.939819
                0.511056
            ]
            [
                0.468797
                0.04792
                0.561714
            ]
            [
                0.249798
                0.060181
                0.988944
            ]
            [
                0.515355
                0.75
                0.133576
            ]
            [
                0.742958
                0.016995
                0.366928
            ]
            [
                0.257042
                0.516995
                0.633072
            ]
            [
                0.468797
                0.45208
                0.561714
            ]
            [
                0.042326
                0.75
                0.483307
            ]
            [
                0.482684
                0.973218
                0.803175
            ]
            [
                0.242958
                0.516995
                0.133072
            ]
            [
                0.521939
                0.75
                0.617169
            ]
            [
                0.757418
                0.011096
                0.617107
            ]
            [
                0.957674
                0.25
                0.516693
            ]
            [
                0.982684
                0.473218
                0.696825
            ]
            [
                0.250202
                0.060181
                0.488944
            ]
            [
                0.571256
                0.25
                0.490908
            ]
            [
                0.517316
                0.473218
                0.196825
            ]
            [
                0.968797
                0.95208
                0.938286
            ]
            [
                0.531203
                0.54792
                0.438286
            ]
            [
                0.517817
                0.75
                0.881407
            ]
            [
                0.750202
                0.560181
                0.011056
            ]
            [
                0.534506
                0.973357
                0.696652
            ]
            [
                0.45247
                0.952513
                0.061065
            ]
            [
                0.242582
                0.988904
                0.382893
            ]
            [
                0.965494
                0.526643
                0.196652
            ]
            [
                0.428744
                0.75
                0.509092
            ]
            [
                0.031203
                0.45208
                0.061714
            ]
        ]
    }
    "species" {
        "source-value" [
            "Cs"
            "Cs"
            "Cs"
            "Cs"
            "Cs"
            "Cs"
            "Cs"
            "Cs"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Nb"
            "Nb"
            "Nb"
            "Nb"
            "Nb"
            "Nb"
            "Nb"
            "Nb"
            "Nb"
            "Nb"
            "Nb"
            "Nb"
            "Nb"
            "Nb"
            "Nb"
            "Nb"
            "Nb"
            "Nb"
            "Nb"
            "Nb"
            "Nb"
            "Nb"
            "Nb"
            "Nb"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "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" 7.82522482
        "source-unit" "angstrom"
    }
    "b" {
        "source-value" 7.83452282
        "source-unit" "angstrom"
    }
    "c" {
        "source-value" 31.03140601
        "source-unit" "angstrom"
    }
}