{
    "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt"
    "instance-id" 1
    "space-group" {
        "source-value" "Pccn"
    }
    "basis-atom-coordinates" {
        "source-value" [
            [
                0.25
                0.598317
                0.25
            ]
            [
                0.75
                0.901683
                0.75
            ]
            [
                0.75
                0.401683
                0.75
            ]
            [
                0.25
                0.098317
                0.25
            ]
            [
                0.224315
                0.408982
                0.091755
            ]
            [
                0.275685
                0.408982
                0.408245
            ]
            [
                0.775685
                0.091018
                0.591755
            ]
            [
                0.724315
                0.091018
                0.908245
            ]
            [
                0.775685
                0.591018
                0.908245
            ]
            [
                0.724315
                0.591018
                0.591755
            ]
            [
                0.224315
                0.908982
                0.408245
            ]
            [
                0.275685
                0.908982
                0.091755
            ]
            [
                0.426889
                0.417145
                0.181786
            ]
            [
                0.073111
                0.417145
                0.318214
            ]
            [
                0.573111
                0.082855
                0.681786
            ]
            [
                0.926889
                0.082855
                0.818214
            ]
            [
                0.573111
                0.582855
                0.818214
            ]
            [
                0.926889
                0.582855
                0.681786
            ]
            [
                0.426889
                0.917145
                0.318214
            ]
            [
                0.073111
                0.917145
                0.181786
            ]
            [
                0.25
                0.491849
                0.25
            ]
            [
                0.75
                0.008151
                0.75
            ]
            [
                0.75
                0.508151
                0.75
            ]
            [
                0.25
                0.991849
                0.25
            ]
            [
                0.472125
                0.27709
                0.205754
            ]
            [
                0.027875
                0.27709
                0.294246
            ]
            [
                0.527875
                0.22291
                0.705754
            ]
            [
                0.972125
                0.22291
                0.794246
            ]
            [
                0.527875
                0.72291
                0.794246
            ]
            [
                0.972125
                0.72291
                0.705754
            ]
            [
                0.472125
                0.77709
                0.294246
            ]
            [
                0.027875
                0.77709
                0.205754
            ]
            [
                0.609035
                0.515682
                0.161731
            ]
            [
                0.890965
                0.515682
                0.338269
            ]
            [
                0.390965
                0.984318
                0.661731
            ]
            [
                0.109035
                0.984318
                0.838269
            ]
            [
                0.390965
                0.484318
                0.838269
            ]
            [
                0.109035
                0.484318
                0.661731
            ]
            [
                0.609035
                0.015682
                0.338269
            ]
            [
                0.890965
                0.015682
                0.161731
            ]
            [
                0.035662
                0.326808
                0.106984
            ]
            [
                0.464338
                0.326808
                0.393016
            ]
            [
                0.964338
                0.173192
                0.606984
            ]
            [
                0.535662
                0.173192
                0.893016
            ]
            [
                0.964338
                0.673192
                0.893016
            ]
            [
                0.535662
                0.673192
                0.606984
            ]
            [
                0.035662
                0.826808
                0.393016
            ]
            [
                0.464338
                0.826808
                0.106984
            ]
            [
                0.148137
                0.537513
                0.073189
            ]
            [
                0.351863
                0.537513
                0.426811
            ]
            [
                0.851863
                0.962487
                0.573189
            ]
            [
                0.648137
                0.962487
                0.926811
            ]
            [
                0.851863
                0.462487
                0.926811
            ]
            [
                0.648137
                0.462487
                0.573189
            ]
            [
                0.148137
                0.037513
                0.426811
            ]
            [
                0.351863
                0.037513
                0.073189
            ]
            [
                0.351914
                0.356698
                0.029735
            ]
            [
                0.148086
                0.356698
                0.470265
            ]
            [
                0.648086
                0.143302
                0.529735
            ]
            [
                0.851914
                0.143302
                0.970265
            ]
            [
                0.648086
                0.643302
                0.970265
            ]
            [
                0.851914
                0.643302
                0.529735
            ]
            [
                0.351914
                0.856698
                0.470265
            ]
            [
                0.148086
                0.856698
                0.029735
            ]
        ]
    }
    "species" {
        "source-value" [
            "H"
            "H"
            "H"
            "H"
            "C"
            "C"
            "C"
            "C"
            "C"
            "C"
            "C"
            "C"
            "S"
            "S"
            "S"
            "S"
            "S"
            "S"
            "S"
            "S"
            "N"
            "N"
            "N"
            "N"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "O"
            "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" 5.59100161
        "source-unit" "angstrom"
    }
    "b" {
        "source-value" 9.66387329
        "source-unit" "angstrom"
    }
    "c" {
        "source-value" 16.57507642
        "source-unit" "angstrom"
    }
}