{
    "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
                0
                0.5
            ]
            [
                0
                0
                0
            ]
            [
                0.5
                0.5
                0.5
            ]
            [
                0.5
                0.5
                0
            ]
            [
                0.157095
                0.635609
                0.914133
            ]
            [
                0.842905
                0.635609
                0.585867
            ]
            [
                0.842905
                0.364391
                0.085867
            ]
            [
                0.157095
                0.364391
                0.414133
            ]
            [
                0.657095
                0.135609
                0.914133
            ]
            [
                0.342905
                0.135609
                0.585867
            ]
            [
                0.342905
                0.864391
                0.085867
            ]
            [
                0.657095
                0.864391
                0.414133
            ]
            [
                0.043962
                0.155706
                0.747899
            ]
            [
                0.956038
                0.155706
                0.752101
            ]
            [
                0.956038
                0.844294
                0.252101
            ]
            [
                0.043962
                0.844294
                0.247899
            ]
            [
                0.91617
                0.267629
                0.907393
            ]
            [
                0.08383
                0.267629
                0.592607
            ]
            [
                0.08383
                0.732371
                0.092607
            ]
            [
                0.91617
                0.732371
                0.407393
            ]
            [
                0.86539
                0.069482
                0.913174
            ]
            [
                0.13461
                0.069482
                0.586826
            ]
            [
                0.13461
                0.930518
                0.086826
            ]
            [
                0.86539
                0.930518
                0.413174
            ]
            [
                0.010259
                0.923374
                0.838079
            ]
            [
                0.989741
                0.923374
                0.661921
            ]
            [
                0.989741
                0.076626
                0.161921
            ]
            [
                0.010259
                0.076626
                0.338079
            ]
            [
                0.980726
                0.721762
                0.876834
            ]
            [
                0.019274
                0.721762
                0.623166
            ]
            [
                0.019274
                0.278238
                0.123166
            ]
            [
                0.980726
                0.278238
                0.376834
            ]
            [
                0.782619
                0.796662
                0.870794
            ]
            [
                0.217381
                0.796662
                0.629206
            ]
            [
                0.217381
                0.203338
                0.129206
            ]
            [
                0.782619
                0.203338
                0.370794
            ]
            [
                0.79193
                0.95913
                0.803895
            ]
            [
                0.20807
                0.95913
                0.696105
            ]
            [
                0.20807
                0.04087
                0.196105
            ]
            [
                0.79193
                0.04087
                0.303895
            ]
            [
                0.543962
                0.655706
                0.747899
            ]
            [
                0.456038
                0.655706
                0.752101
            ]
            [
                0.456038
                0.344294
                0.252101
            ]
            [
                0.543962
                0.344294
                0.247899
            ]
            [
                0.41617
                0.767629
                0.907393
            ]
            [
                0.58383
                0.767629
                0.592607
            ]
            [
                0.58383
                0.232371
                0.092607
            ]
            [
                0.41617
                0.232371
                0.407393
            ]
            [
                0.36539
                0.569482
                0.913174
            ]
            [
                0.63461
                0.569482
                0.586826
            ]
            [
                0.63461
                0.430518
                0.086826
            ]
            [
                0.36539
                0.430518
                0.413174
            ]
            [
                0.510259
                0.423374
                0.838079
            ]
            [
                0.489741
                0.423374
                0.661921
            ]
            [
                0.489741
                0.576626
                0.161921
            ]
            [
                0.510259
                0.576626
                0.338079
            ]
            [
                0.480726
                0.221762
                0.876834
            ]
            [
                0.519274
                0.221762
                0.623166
            ]
            [
                0.519274
                0.778238
                0.123166
            ]
            [
                0.480726
                0.778238
                0.376834
            ]
            [
                0.282619
                0.296662
                0.870794
            ]
            [
                0.717381
                0.296662
                0.629206
            ]
            [
                0.717381
                0.703338
                0.129206
            ]
            [
                0.282619
                0.703338
                0.370794
            ]
            [
                0.29193
                0.45913
                0.803895
            ]
            [
                0.70807
                0.45913
                0.696105
            ]
            [
                0.70807
                0.54087
                0.196105
            ]
            [
                0.29193
                0.54087
                0.303895
            ]
            [
                0.102656
                0.377811
                0.94536
            ]
            [
                0.897344
                0.377811
                0.55464
            ]
            [
                0.897344
                0.622189
                0.05464
            ]
            [
                0.102656
                0.622189
                0.44536
            ]
            [
                0.217362
                0.89308
                0.896213
            ]
            [
                0.782638
                0.89308
                0.603787
            ]
            [
                0.782638
                0.10692
                0.103787
            ]
            [
                0.217362
                0.10692
                0.396213
            ]
            [
                0.602656
                0.877811
                0.94536
            ]
            [
                0.397344
                0.877811
                0.55464
            ]
            [
                0.397344
                0.122189
                0.05464
            ]
            [
                0.602656
                0.122189
                0.44536
            ]
            [
                0.717362
                0.39308
                0.896213
            ]
            [
                0.282638
                0.39308
                0.603787
            ]
            [
                0.282638
                0.60692
                0.103787
            ]
            [
                0.717362
                0.60692
                0.396213
            ]
            [
                0.069795
                0.236402
                0.964104
            ]
            [
                0.930205
                0.236402
                0.535896
            ]
            [
                0.930205
                0.763598
                0.035896
            ]
            [
                0.069795
                0.763598
                0.464104
            ]
            [
                0.751587
                0.538962
                0.885715
            ]
            [
                0.248413
                0.538962
                0.614285
            ]
            [
                0.248413
                0.461038
                0.114285
            ]
            [
                0.751587
                0.461038
                0.385715
            ]
            [
                0.101066
                0.492045
                0.71714
            ]
            [
                0.898934
                0.492045
                0.78286
            ]
            [
                0.898934
                0.507955
                0.28286
            ]
            [
                0.101066
                0.507955
                0.21714
            ]
            [
                0.569795
                0.736402
                0.964104
            ]
            [
                0.430205
                0.736402
                0.535896
            ]
            [
                0.430205
                0.263598
                0.035896
            ]
            [
                0.569795
                0.263598
                0.464104
            ]
            [
                0.251587
                0.038962
                0.885715
            ]
            [
                0.748413
                0.038962
                0.614285
            ]
            [
                0.748413
                0.961038
                0.114285
            ]
            [
                0.251587
                0.961038
                0.385715
            ]
            [
                0.601066
                0.992045
                0.71714
            ]
            [
                0.398934
                0.992045
                0.78286
            ]
            [
                0.398934
                0.007955
                0.28286
            ]
            [
                0.601066
                0.007955
                0.21714
            ]
            [
                0
                0.065403
                0.75
            ]
            [
                0
                0.934597
                0.25
            ]
            [
                0.095645
                0.845335
                0.056087
            ]
            [
                0.904355
                0.845335
                0.443913
            ]
            [
                0.904355
                0.154665
                0.943913
            ]
            [
                0.095645
                0.154665
                0.556087
            ]
            [
                0.014788
                0.83884
                0.8887
            ]
            [
                0.985212
                0.83884
                0.6113
            ]
            [
                0.985212
                0.16116
                0.1113
            ]
            [
                0.014788
                0.16116
                0.3887
            ]
            [
                0.79123
                0.943611
                0.862549
            ]
            [
                0.20877
                0.943611
                0.637451
            ]
            [
                0.20877
                0.056389
                0.137451
            ]
            [
                0.79123
                0.056389
                0.362549
            ]
            [
                0.064251
                0.488982
                0.646864
            ]
            [
                0.935749
                0.488982
                0.853136
            ]
            [
                0.935749
                0.511018
                0.353136
            ]
            [
                0.064251
                0.511018
                0.146864
            ]
            [
                0.120704
                0.326842
                0.751312
            ]
            [
                0.879296
                0.326842
                0.748688
            ]
            [
                0.879296
                0.673158
                0.248688
            ]
            [
                0.120704
                0.673158
                0.251312
            ]
            [
                0.116489
                0.6591
                0.750909
            ]
            [
                0.883511
                0.6591
                0.749091
            ]
            [
                0.883511
                0.3409
                0.249091
            ]
            [
                0.116489
                0.3409
                0.250909
            ]
            [
                0.5
                0.565403
                0.75
            ]
            [
                0.5
                0.434597
                0.25
            ]
            [
                0.595645
                0.345335
                0.056087
            ]
            [
                0.404355
                0.345335
                0.443913
            ]
            [
                0.404355
                0.654665
                0.943913
            ]
            [
                0.595645
                0.654665
                0.556087
            ]
            [
                0.514788
                0.33884
                0.8887
            ]
            [
                0.485212
                0.33884
                0.6113
            ]
            [
                0.485212
                0.66116
                0.1113
            ]
            [
                0.514788
                0.66116
                0.3887
            ]
            [
                0.29123
                0.443611
                0.862549
            ]
            [
                0.70877
                0.443611
                0.637451
            ]
            [
                0.70877
                0.556389
                0.137451
            ]
            [
                0.29123
                0.556389
                0.362549
            ]
            [
                0.564251
                0.988982
                0.646864
            ]
            [
                0.435749
                0.988982
                0.853136
            ]
            [
                0.435749
                0.011018
                0.353136
            ]
            [
                0.564251
                0.011018
                0.146864
            ]
            [
                0.620704
                0.826842
                0.751312
            ]
            [
                0.379296
                0.826842
                0.748688
            ]
            [
                0.379296
                0.173158
                0.248688
            ]
            [
                0.620704
                0.173158
                0.251312
            ]
            [
                0.616489
                0.1591
                0.750909
            ]
            [
                0.383511
                0.1591
                0.749091
            ]
            [
                0.383511
                0.8409
                0.249091
            ]
            [
                0.616489
                0.8409
                0.250909
            ]
        ]
    }
    "species" {
        "source-value" [
            "Zn"
            "Zn"
            "Zn"
            "Zn"
            "Hg"
            "Hg"
            "Hg"
            "Hg"
            "Hg"
            "Hg"
            "Hg"
            "Hg"
            "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"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
            "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" 17.9823036657
        "source-unit" "angstrom"
    }
    "b" {
        "source-value" 6.6196654
        "source-unit" "angstrom"
    }
    "c" {
        "source-value" 16.505087815
        "source-unit" "angstrom"
    }
    "beta" {
        "source-value" 95.0442154105
        "source-unit" "degree"
    }
}