{
    "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt"
    "instance-id" 1
    "space-group" {
        "source-value" "C2/c"
    }
    "basis-atom-coordinates" {
        "source-value" [
            [
                0.5
                0.559915
                0.75
            ]
            [
                0
                0.940085
                0.25
            ]
            [
                0
                0.059915
                0.75
            ]
            [
                0.5
                0.440085
                0.25
            ]
            [
                0.60002
                0.875222
                0.769102
            ]
            [
                0.10002
                0.624778
                0.269102
            ]
            [
                0.89998
                0.624778
                0.230898
            ]
            [
                0.39998
                0.875222
                0.730898
            ]
            [
                0.10002
                0.375222
                0.769102
            ]
            [
                0.60002
                0.124778
                0.269102
            ]
            [
                0.39998
                0.124778
                0.230898
            ]
            [
                0.89998
                0.375222
                0.730898
            ]
            [
                0.794441
                0.453071
                0.609012
            ]
            [
                0.705559
                0.046929
                0.390988
            ]
            [
                0.861132
                0.562769
                0.332067
            ]
            [
                0.861132
                0.437231
                0.832067
            ]
            [
                0.638868
                0.937231
                0.667933
            ]
            [
                0.705559
                0.953071
                0.890988
            ]
            [
                0.638868
                0.062769
                0.167933
            ]
            [
                0.794441
                0.546929
                0.109012
            ]
            [
                0.294441
                0.953071
                0.609012
            ]
            [
                0.205559
                0.546929
                0.390988
            ]
            [
                0.361132
                0.062769
                0.332067
            ]
            [
                0.361132
                0.937231
                0.832067
            ]
            [
                0.138868
                0.437231
                0.667933
            ]
            [
                0.205559
                0.453071
                0.890988
            ]
            [
                0.138868
                0.562769
                0.167933
            ]
            [
                0.294441
                0.046929
                0.109012
            ]
            [
                0.100613
                0.812731
                0.273629
            ]
            [
                0.600613
                0.687269
                0.773629
            ]
            [
                0.899387
                0.812731
                0.226371
            ]
            [
                0.5
                0.967428
                0.75
            ]
            [
                0.399387
                0.687269
                0.726371
            ]
            [
                0
                0.532572
                0.25
            ]
            [
                0.600613
                0.312731
                0.273629
            ]
            [
                0.100613
                0.187269
                0.773629
            ]
            [
                0.399387
                0.312731
                0.226371
            ]
            [
                0
                0.467428
                0.75
            ]
            [
                0.899387
                0.187269
                0.726371
            ]
            [
                0.5
                0.032572
                0.25
            ]
            [
                0.030703
                0.082942
                0.382265
            ]
            [
                0.530703
                0.417058
                0.882265
            ]
            [
                0.469297
                0.417058
                0.617735
            ]
            [
                0.969297
                0.082942
                0.117735
            ]
            [
                0.530703
                0.582942
                0.382265
            ]
            [
                0.030703
                0.917058
                0.882265
            ]
            [
                0.969297
                0.917058
                0.617735
            ]
            [
                0.469297
                0.582942
                0.117735
            ]
            [
                0.635654
                0.094592
                0.656737
            ]
            [
                0.793999
                0.883655
                0.910457
            ]
            [
                0.635654
                0.905408
                0.156737
            ]
            [
                0.926008
                0.372005
                0.921305
            ]
            [
                0.317119
                0.92192
                0.531543
            ]
            [
                0.716119
                0.109864
                0.886123
            ]
            [
                0.706001
                0.383655
                0.589543
            ]
            [
                0.767033
                0.612732
                0.309238
            ]
            [
                0.783881
                0.390136
                0.113877
            ]
            [
                0.716119
                0.890136
                0.386123
            ]
            [
                0.793999
                0.116345
                0.410457
            ]
            [
                0.706001
                0.616345
                0.089543
            ]
            [
                0.182881
                0.57808
                0.468457
            ]
            [
                0.864346
                0.405408
                0.343263
            ]
            [
                0.783881
                0.609864
                0.613877
            ]
            [
                0.682881
                0.92192
                0.968457
            ]
            [
                0.732967
                0.112732
                0.190762
            ]
            [
                0.864346
                0.594592
                0.843263
            ]
            [
                0.573992
                0.872005
                0.578695
            ]
            [
                0.767033
                0.387268
                0.809238
            ]
            [
                0.732967
                0.887268
                0.690762
            ]
            [
                0.817119
                0.57808
                0.031543
            ]
            [
                0.926008
                0.627995
                0.421305
            ]
            [
                0.573992
                0.127995
                0.078695
            ]
            [
                0.135654
                0.594592
                0.656737
            ]
            [
                0.293999
                0.383655
                0.910457
            ]
            [
                0.135654
                0.405408
                0.156737
            ]
            [
                0.426008
                0.872005
                0.921305
            ]
            [
                0.817119
                0.42192
                0.531543
            ]
            [
                0.216119
                0.609864
                0.886123
            ]
            [
                0.206001
                0.883655
                0.589543
            ]
            [
                0.267033
                0.112732
                0.309238
            ]
            [
                0.283881
                0.890136
                0.113877
            ]
            [
                0.216119
                0.390136
                0.386123
            ]
            [
                0.293999
                0.616345
                0.410457
            ]
            [
                0.206001
                0.116345
                0.089543
            ]
            [
                0.682881
                0.07808
                0.468457
            ]
            [
                0.364346
                0.905408
                0.343263
            ]
            [
                0.283881
                0.109864
                0.613877
            ]
            [
                0.182881
                0.42192
                0.968457
            ]
            [
                0.232967
                0.612732
                0.190762
            ]
            [
                0.364346
                0.094592
                0.843263
            ]
            [
                0.073992
                0.372005
                0.578695
            ]
            [
                0.267033
                0.887268
                0.809238
            ]
            [
                0.232967
                0.387268
                0.690762
            ]
            [
                0.317119
                0.07808
                0.031543
            ]
            [
                0.426008
                0.127995
                0.421305
            ]
            [
                0.073992
                0.627995
                0.078695
            ]
        ]
    }
    "species" {
        "source-value" [
            "V"
            "V"
            "V"
            "V"
            "P"
            "P"
            "P"
            "P"
            "P"
            "P"
            "P"
            "P"
            "C"
            "C"
            "C"
            "C"
            "C"
            "C"
            "C"
            "C"
            "C"
            "C"
            "C"
            "C"
            "C"
            "C"
            "C"
            "C"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "Cl"
            "Cl"
            "Cl"
            "Cl"
            "Cl"
            "Cl"
            "Cl"
            "Cl"
            "F"
            "F"
            "F"
            "F"
            "F"
            "F"
            "F"
            "F"
            "F"
            "F"
            "F"
            "F"
            "F"
            "F"
            "F"
            "F"
            "F"
            "F"
            "F"
            "F"
            "F"
            "F"
            "F"
            "F"
            "F"
            "F"
            "F"
            "F"
            "F"
            "F"
            "F"
            "F"
            "F"
            "F"
            "F"
            "F"
            "F"
            "F"
            "F"
            "F"
            "F"
            "F"
            "F"
            "F"
            "F"
            "F"
            "F"
            "F"
        ]
    }
    "cauchy-stress" {
        "source-value" [
            0
            0
            0
            0
            0
            0
        ]
        "source-unit" "GPa"
    }
    "temperature" {
        "source-value" 0
        "source-unit" "K"
    }
    "a" {
        "source-value" 14.89078089
        "source-unit" "angstrom"
    }
    "b" {
        "source-value" 8.54639932
        "source-unit" "angstrom"
    }
    "c" {
        "source-value" 14.78752634
        "source-unit" "angstrom"
    }
    "beta" {
        "source-value" 116.58703115
        "source-unit" "degree"
    }
}