{
    "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt"
    "instance-id" 1
    "space-group" {
        "source-value" "F2dd"
    }
    "basis-atom-coordinates" {
        "source-value" [
            [
                0.258531
                0.06123
                0.69302
            ]
            [
                0.258531
                0.93877
                0.30698
            ]
            [
                0.508531
                0.68877
                0.44302
            ]
            [
                0.508531
                0.31123
                0.55698
            ]
            [
                0.258531
                0.56123
                0.19302
            ]
            [
                0.258531
                0.43877
                0.80698
            ]
            [
                0.508531
                0.18877
                0.94302
            ]
            [
                0.508531
                0.81123
                0.05698
            ]
            [
                0.758531
                0.56123
                0.69302
            ]
            [
                0.758531
                0.43877
                0.30698
            ]
            [
                0.008531
                0.18877
                0.44302
            ]
            [
                0.008531
                0.81123
                0.55698
            ]
            [
                0.758531
                0.06123
                0.19302
            ]
            [
                0.758531
                0.93877
                0.80698
            ]
            [
                0.008531
                0.68877
                0.94302
            ]
            [
                0.008531
                0.31123
                0.05698
            ]
            [
                0.497781
                0
                0.5
            ]
            [
                0.747781
                0.75
                0.25
            ]
            [
                0.536706
                0.884509
                0.599291
            ]
            [
                0.536706
                0.115491
                0.400709
            ]
            [
                0.786706
                0.865491
                0.349291
            ]
            [
                0.286706
                0.634509
                0.650709
            ]
            [
                0.497781
                0.5
                0
            ]
            [
                0.747781
                0.25
                0.75
            ]
            [
                0.536706
                0.384509
                0.099291
            ]
            [
                0.536706
                0.615491
                0.900709
            ]
            [
                0.786706
                0.365491
                0.849291
            ]
            [
                0.286706
                0.134509
                0.150709
            ]
            [
                0.997781
                0.5
                0.5
            ]
            [
                0.247781
                0.25
                0.25
            ]
            [
                0.036706
                0.384509
                0.599291
            ]
            [
                0.036706
                0.615491
                0.400709
            ]
            [
                0.286706
                0.365491
                0.349291
            ]
            [
                0.786706
                0.134509
                0.650709
            ]
            [
                0.997781
                0
                0
            ]
            [
                0.247781
                0.75
                0.75
            ]
            [
                0.036706
                0.884509
                0.099291
            ]
            [
                0.036706
                0.115491
                0.900709
            ]
            [
                0.286706
                0.865491
                0.849291
            ]
            [
                0.786706
                0.634509
                0.150709
            ]
            [
                0.646187
                0.25
                0.25
            ]
            [
                0.896187
                0
                0.5
            ]
            [
                0.646187
                0.75
                0.75
            ]
            [
                0.896187
                0.5
                0
            ]
            [
                0.146187
                0.75
                0.25
            ]
            [
                0.396187
                0.5
                0.5
            ]
            [
                0.146187
                0.25
                0.75
            ]
            [
                0.396187
                0
                0
            ]
            [
                0.243726
                0.188294
                0.714387
            ]
            [
                0.743726
                0.311706
                0.285613
            ]
            [
                0.493726
                0.561706
                0.464387
            ]
            [
                0.493726
                0.438294
                0.535613
            ]
            [
                0.55708
                0.791034
                0.69633
            ]
            [
                0.55708
                0.208966
                0.30367
            ]
            [
                0.80708
                0.958966
                0.44633
            ]
            [
                0.80708
                0.041034
                0.55367
            ]
            [
                0.243726
                0.688294
                0.214387
            ]
            [
                0.743726
                0.811706
                0.785613
            ]
            [
                0.493726
                0.061706
                0.964387
            ]
            [
                0.493726
                0.938294
                0.035613
            ]
            [
                0.55708
                0.291034
                0.19633
            ]
            [
                0.55708
                0.708966
                0.80367
            ]
            [
                0.80708
                0.458966
                0.94633
            ]
            [
                0.80708
                0.541034
                0.05367
            ]
            [
                0.743726
                0.688294
                0.714387
            ]
            [
                0.243726
                0.811706
                0.285613
            ]
            [
                0.993726
                0.061706
                0.464387
            ]
            [
                0.993726
                0.938294
                0.535613
            ]
            [
                0.05708
                0.291034
                0.69633
            ]
            [
                0.05708
                0.708966
                0.30367
            ]
            [
                0.30708
                0.458966
                0.44633
            ]
            [
                0.30708
                0.541034
                0.55367
            ]
            [
                0.743726
                0.188294
                0.214387
            ]
            [
                0.243726
                0.311706
                0.785613
            ]
            [
                0.993726
                0.561706
                0.964387
            ]
            [
                0.993726
                0.438294
                0.035613
            ]
            [
                0.05708
                0.791034
                0.19633
            ]
            [
                0.05708
                0.208966
                0.80367
            ]
            [
                0.30708
                0.958966
                0.94633
            ]
            [
                0.30708
                0.041034
                0.05367
            ]
            [
                0.270536
                0.943431
                0.682167
            ]
            [
                0.270536
                0.056569
                0.317833
            ]
            [
                0.520536
                0.806569
                0.432167
            ]
            [
                0.520536
                0.193431
                0.567833
            ]
            [
                0.457752
                0.075499
                0.69487
            ]
            [
                0.457752
                0.924501
                0.30513
            ]
            [
                0.707752
                0.674501
                0.44487
            ]
            [
                0.207752
                0.825499
                0.55513
            ]
            [
                0.056217
                0.063317
                0.687701
            ]
            [
                0.056217
                0.936683
                0.312299
            ]
            [
                0.806217
                0.186683
                0.437701
            ]
            [
                0.306217
                0.313317
                0.562299
            ]
            [
                0.264688
                0.076499
                0.591639
            ]
            [
                0.264688
                0.923501
                0.408361
            ]
            [
                0.514688
                0.673501
                0.341639
            ]
            [
                0.514688
                0.326499
                0.658361
            ]
            [
                0.748679
                0.043301
                0.295101
            ]
            [
                0.748679
                0.956699
                0.704899
            ]
            [
                0.498679
                0.706699
                0.545101
            ]
            [
                0.498679
                0.293301
                0.454899
            ]
            [
                0.270536
                0.443431
                0.182167
            ]
            [
                0.270536
                0.556569
                0.817833
            ]
            [
                0.520536
                0.306569
                0.932167
            ]
            [
                0.520536
                0.693431
                0.067833
            ]
            [
                0.457752
                0.575499
                0.19487
            ]
            [
                0.457752
                0.424501
                0.80513
            ]
            [
                0.707752
                0.174501
                0.94487
            ]
            [
                0.207752
                0.325499
                0.05513
            ]
            [
                0.056217
                0.563317
                0.187701
            ]
            [
                0.056217
                0.436683
                0.812299
            ]
            [
                0.806217
                0.686683
                0.937701
            ]
            [
                0.306217
                0.813317
                0.062299
            ]
            [
                0.264688
                0.576499
                0.091639
            ]
            [
                0.264688
                0.423501
                0.908361
            ]
            [
                0.514688
                0.173501
                0.841639
            ]
            [
                0.514688
                0.826499
                0.158361
            ]
            [
                0.748679
                0.543301
                0.795101
            ]
            [
                0.748679
                0.456699
                0.204899
            ]
            [
                0.498679
                0.206699
                0.045101
            ]
            [
                0.498679
                0.793301
                0.954899
            ]
            [
                0.770536
                0.443431
                0.682167
            ]
            [
                0.770536
                0.556569
                0.317833
            ]
            [
                0.020536
                0.306569
                0.432167
            ]
            [
                0.020536
                0.693431
                0.567833
            ]
            [
                0.957752
                0.575499
                0.69487
            ]
            [
                0.957752
                0.424501
                0.30513
            ]
            [
                0.207752
                0.174501
                0.44487
            ]
            [
                0.707752
                0.325499
                0.55513
            ]
            [
                0.556217
                0.563317
                0.687701
            ]
            [
                0.556217
                0.436683
                0.312299
            ]
            [
                0.306217
                0.686683
                0.437701
            ]
            [
                0.806217
                0.813317
                0.562299
            ]
            [
                0.764688
                0.576499
                0.591639
            ]
            [
                0.764688
                0.423501
                0.408361
            ]
            [
                0.014688
                0.173501
                0.341639
            ]
            [
                0.014688
                0.826499
                0.658361
            ]
            [
                0.248679
                0.543301
                0.295101
            ]
            [
                0.248679
                0.456699
                0.704899
            ]
            [
                0.998679
                0.206699
                0.545101
            ]
            [
                0.998679
                0.793301
                0.454899
            ]
            [
                0.770536
                0.943431
                0.182167
            ]
            [
                0.770536
                0.056569
                0.817833
            ]
            [
                0.020536
                0.806569
                0.932167
            ]
            [
                0.020536
                0.193431
                0.067833
            ]
            [
                0.957752
                0.075499
                0.19487
            ]
            [
                0.957752
                0.924501
                0.80513
            ]
            [
                0.207752
                0.674501
                0.94487
            ]
            [
                0.707752
                0.825499
                0.05513
            ]
            [
                0.556217
                0.063317
                0.187701
            ]
            [
                0.556217
                0.936683
                0.812299
            ]
            [
                0.306217
                0.186683
                0.937701
            ]
            [
                0.806217
                0.313317
                0.062299
            ]
            [
                0.764688
                0.076499
                0.091639
            ]
            [
                0.764688
                0.923501
                0.908361
            ]
            [
                0.014688
                0.673501
                0.841639
            ]
            [
                0.014688
                0.326499
                0.158361
            ]
            [
                0.248679
                0.043301
                0.795101
            ]
            [
                0.248679
                0.956699
                0.204899
            ]
            [
                0.998679
                0.706699
                0.045101
            ]
            [
                0.998679
                0.293301
                0.954899
            ]
        ]
    }
    "species" {
        "source-value" [
            "Ta"
            "Ta"
            "Ta"
            "Ta"
            "Ta"
            "Ta"
            "Ta"
            "Ta"
            "Ta"
            "Ta"
            "Ta"
            "Ta"
            "Ta"
            "Ta"
            "Ta"
            "Ta"
            "Hg"
            "Hg"
            "Hg"
            "Hg"
            "Hg"
            "Hg"
            "Hg"
            "Hg"
            "Hg"
            "Hg"
            "Hg"
            "Hg"
            "Hg"
            "Hg"
            "Hg"
            "Hg"
            "Hg"
            "Hg"
            "Hg"
            "Hg"
            "Hg"
            "Hg"
            "Hg"
            "Hg"
            "S"
            "S"
            "S"
            "S"
            "S"
            "S"
            "S"
            "S"
            "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"
            "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"
            "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" 9.4992734301
        "source-unit" "angstrom"
    }
    "b" {
        "source-value" 16.005851963
        "source-unit" "angstrom"
    }
    "c" {
        "source-value" 18.7048283619
        "source-unit" "angstrom"
    }
}