{
    "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt"
    "instance-id" 1
    "space-group" {
        "source-value" "Cmce"
    }
    "basis-atom-coordinates" {
        "source-value" [
            [
                0.37895
                0
                0.614379
            ]
            [
                0.62105
                0
                0.385621
            ]
            [
                0.12105
                0
                0.114379
            ]
            [
                0.87895
                0
                0.885621
            ]
            [
                0.87895
                0.5
                0.614379
            ]
            [
                0.12105
                0.5
                0.385621
            ]
            [
                0.62105
                0.5
                0.114379
            ]
            [
                0.37895
                0.5
                0.885621
            ]
            [
                0.798126
                0.980319
                0.724215
            ]
            [
                0.201874
                0.980319
                0.275785
            ]
            [
                0.701874
                0.980319
                0.224215
            ]
            [
                0.298126
                0.980319
                0.775785
            ]
            [
                0.201874
                0.019681
                0.275785
            ]
            [
                0.798126
                0.019681
                0.724215
            ]
            [
                0.298126
                0.019681
                0.775785
            ]
            [
                0.701874
                0.019681
                0.224215
            ]
            [
                0.880165
                0.371963
                0.00921
            ]
            [
                0.119835
                0.371963
                0.99079
            ]
            [
                0.119835
                0.871963
                0.50921
            ]
            [
                0.880165
                0.871963
                0.49079
            ]
            [
                0.119835
                0.628037
                0.99079
            ]
            [
                0.880165
                0.628037
                0.00921
            ]
            [
                0.880165
                0.128037
                0.49079
            ]
            [
                0.119835
                0.128037
                0.50921
            ]
            [
                0.969082
                0.370985
                0.564395
            ]
            [
                0.030918
                0.370985
                0.435605
            ]
            [
                0.030918
                0.870985
                0.064395
            ]
            [
                0.969082
                0.870985
                0.935605
            ]
            [
                0.030918
                0.629015
                0.435605
            ]
            [
                0.969082
                0.629015
                0.564395
            ]
            [
                0.969082
                0.129015
                0.935605
            ]
            [
                0.030918
                0.129015
                0.064395
            ]
            [
                0.138812
                0.831141
                0.915986
            ]
            [
                0.861188
                0.831141
                0.084014
            ]
            [
                0.861188
                0.331141
                0.415986
            ]
            [
                0.138812
                0.331141
                0.584014
            ]
            [
                0.861188
                0.168859
                0.084014
            ]
            [
                0.138812
                0.168859
                0.915986
            ]
            [
                0.138812
                0.668859
                0.584014
            ]
            [
                0.861188
                0.668859
                0.415986
            ]
            [
                0.05479
                0.761289
                0.884283
            ]
            [
                0.94521
                0.761289
                0.115717
            ]
            [
                0.94521
                0.261289
                0.384283
            ]
            [
                0.05479
                0.261289
                0.615717
            ]
            [
                0.94521
                0.238711
                0.115717
            ]
            [
                0.05479
                0.238711
                0.884283
            ]
            [
                0.05479
                0.738711
                0.615717
            ]
            [
                0.94521
                0.738711
                0.384283
            ]
            [
                0.882562
                0.264277
                0.518515
            ]
            [
                0.117438
                0.264277
                0.481485
            ]
            [
                0.117438
                0.764277
                0.018515
            ]
            [
                0.882562
                0.764277
                0.981485
            ]
            [
                0.117438
                0.735723
                0.481485
            ]
            [
                0.882562
                0.735723
                0.518515
            ]
            [
                0.882562
                0.235723
                0.981485
            ]
            [
                0.117438
                0.235723
                0.018515
            ]
            [
                0.298126
                0.480319
                0.724215
            ]
            [
                0.701874
                0.480319
                0.275785
            ]
            [
                0.201874
                0.480319
                0.224215
            ]
            [
                0.798126
                0.480319
                0.775785
            ]
            [
                0.701874
                0.519681
                0.275785
            ]
            [
                0.298126
                0.519681
                0.724215
            ]
            [
                0.798126
                0.519681
                0.775785
            ]
            [
                0.201874
                0.519681
                0.224215
            ]
            [
                0.380165
                0.871963
                0.00921
            ]
            [
                0.619835
                0.871963
                0.99079
            ]
            [
                0.619835
                0.371963
                0.50921
            ]
            [
                0.380165
                0.371963
                0.49079
            ]
            [
                0.619835
                0.128037
                0.99079
            ]
            [
                0.380165
                0.128037
                0.00921
            ]
            [
                0.380165
                0.628037
                0.49079
            ]
            [
                0.619835
                0.628037
                0.50921
            ]
            [
                0.469082
                0.870985
                0.564395
            ]
            [
                0.530918
                0.870985
                0.435605
            ]
            [
                0.530918
                0.370985
                0.064395
            ]
            [
                0.469082
                0.370985
                0.935605
            ]
            [
                0.530918
                0.129015
                0.435605
            ]
            [
                0.469082
                0.129015
                0.564395
            ]
            [
                0.469082
                0.629015
                0.935605
            ]
            [
                0.530918
                0.629015
                0.064395
            ]
            [
                0.638812
                0.331141
                0.915986
            ]
            [
                0.361188
                0.331141
                0.084014
            ]
            [
                0.361188
                0.831141
                0.415986
            ]
            [
                0.638812
                0.831141
                0.584014
            ]
            [
                0.361188
                0.668859
                0.084014
            ]
            [
                0.638812
                0.668859
                0.915986
            ]
            [
                0.638812
                0.168859
                0.584014
            ]
            [
                0.361188
                0.168859
                0.415986
            ]
            [
                0.55479
                0.261289
                0.884283
            ]
            [
                0.44521
                0.261289
                0.115717
            ]
            [
                0.44521
                0.761289
                0.384283
            ]
            [
                0.55479
                0.761289
                0.615717
            ]
            [
                0.44521
                0.738711
                0.115717
            ]
            [
                0.55479
                0.738711
                0.884283
            ]
            [
                0.55479
                0.238711
                0.615717
            ]
            [
                0.44521
                0.238711
                0.384283
            ]
            [
                0.382562
                0.764277
                0.518515
            ]
            [
                0.617438
                0.764277
                0.481485
            ]
            [
                0.617438
                0.264277
                0.018515
            ]
            [
                0.382562
                0.264277
                0.981485
            ]
            [
                0.617438
                0.235723
                0.481485
            ]
            [
                0.382562
                0.235723
                0.518515
            ]
            [
                0.382562
                0.735723
                0.981485
            ]
            [
                0.617438
                0.735723
                0.018515
            ]
            [
                0.08304
                0.795754
                0.951437
            ]
            [
                0.91696
                0.795754
                0.048563
            ]
            [
                0.91696
                0.295754
                0.451437
            ]
            [
                0.08304
                0.295754
                0.548563
            ]
            [
                0.91696
                0.204246
                0.048563
            ]
            [
                0.08304
                0.204246
                0.951437
            ]
            [
                0.08304
                0.704246
                0.548563
            ]
            [
                0.91696
                0.704246
                0.451437
            ]
            [
                0.58304
                0.295754
                0.951437
            ]
            [
                0.41696
                0.295754
                0.048563
            ]
            [
                0.41696
                0.795754
                0.451437
            ]
            [
                0.58304
                0.795754
                0.548563
            ]
            [
                0.41696
                0.704246
                0.048563
            ]
            [
                0.58304
                0.704246
                0.951437
            ]
            [
                0.58304
                0.204246
                0.548563
            ]
            [
                0.41696
                0.204246
                0.451437
            ]
            [
                0
                0.337119
                0.5
            ]
            [
                0
                0.837119
                0
            ]
            [
                0
                0.662881
                0.5
            ]
            [
                0
                0.162881
                0
            ]
            [
                0.5
                0.837119
                0.5
            ]
            [
                0.5
                0.337119
                0
            ]
            [
                0.5
                0.162881
                0.5
            ]
            [
                0.5
                0.662881
                0
            ]
            [
                0.14687
                0
                0.93076
            ]
            [
                0.85313
                0
                0.06924
            ]
            [
                0.35313
                0
                0.43076
            ]
            [
                0.64687
                0
                0.56924
            ]
            [
                0.888321
                0.375067
                0.900541
            ]
            [
                0.111679
                0.375067
                0.099459
            ]
            [
                0.111679
                0.875067
                0.400541
            ]
            [
                0.888321
                0.875067
                0.599459
            ]
            [
                0.111679
                0.624933
                0.099459
            ]
            [
                0.888321
                0.624933
                0.900541
            ]
            [
                0.888321
                0.124933
                0.599459
            ]
            [
                0.111679
                0.124933
                0.400541
            ]
            [
                0.64687
                0.5
                0.93076
            ]
            [
                0.35313
                0.5
                0.06924
            ]
            [
                0.85313
                0.5
                0.43076
            ]
            [
                0.14687
                0.5
                0.56924
            ]
            [
                0.388321
                0.875067
                0.900541
            ]
            [
                0.611679
                0.875067
                0.099459
            ]
            [
                0.611679
                0.375067
                0.400541
            ]
            [
                0.388321
                0.375067
                0.599459
            ]
            [
                0.611679
                0.124933
                0.099459
            ]
            [
                0.388321
                0.124933
                0.900541
            ]
            [
                0.388321
                0.624933
                0.599459
            ]
            [
                0.611679
                0.624933
                0.400541
            ]
            [
                0.088897
                0.918281
                0.154024
            ]
            [
                0.911103
                0.918281
                0.845976
            ]
            [
                0.411103
                0.918281
                0.654024
            ]
            [
                0.588897
                0.918281
                0.345976
            ]
            [
                0.911103
                0.081719
                0.845976
            ]
            [
                0.088897
                0.081719
                0.154024
            ]
            [
                0.588897
                0.081719
                0.345976
            ]
            [
                0.411103
                0.081719
                0.654024
            ]
            [
                0.588897
                0.418281
                0.154024
            ]
            [
                0.411103
                0.418281
                0.845976
            ]
            [
                0.911103
                0.418281
                0.654024
            ]
            [
                0.088897
                0.418281
                0.345976
            ]
            [
                0.411103
                0.581719
                0.845976
            ]
            [
                0.588897
                0.581719
                0.154024
            ]
            [
                0.088897
                0.581719
                0.345976
            ]
            [
                0.911103
                0.581719
                0.654024
            ]
        ]
    }
    "species" {
        "source-value" [
            "Mn"
            "Mn"
            "Mn"
            "Mn"
            "Mn"
            "Mn"
            "Mn"
            "Mn"
            "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"
            "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"
            "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"
            "C"
            "C"
            "C"
            "C"
            "C"
            "C"
            "C"
            "C"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "Cl"
            "Cl"
            "Cl"
            "Cl"
            "Cl"
            "Cl"
            "Cl"
            "Cl"
            "Cl"
            "Cl"
            "Cl"
            "Cl"
            "Cl"
            "Cl"
            "Cl"
            "Cl"
            "Cl"
            "Cl"
            "Cl"
            "Cl"
            "Cl"
            "Cl"
            "Cl"
            "Cl"
            "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" 13.40141386
        "source-unit" "angstrom"
    }
    "b" {
        "source-value" 19.27271524
        "source-unit" "angstrom"
    }
    "c" {
        "source-value" 11.79853687
        "source-unit" "angstrom"
    }
}