{
    "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-hexagonal-crystal-npt"
    "instance-id" 1
    "space-group" {
        "source-value" "P6_1"
    }
    "basis-atom-coordinates" {
        "source-value" [
            [
                0.977952
                0.982135
                0.500112
            ]
            [
                0.004183
                0.022048
                0.166778
            ]
            [
                0.995817
                0.977952
                0.666778
            ]
            [
                0.017865
                0.995817
                0.833445
            ]
            [
                0.982135
                0.004183
                0.333445
            ]
            [
                0.022048
                0.017865
                0.000112
            ]
            [
                0.266851
                0.783684
                0.692628
            ]
            [
                0.329232
                0.664076
                0.318571
            ]
            [
                0.665156
                0.329232
                0.485238
            ]
            [
                0.484697
                0.868816
                0.801075
            ]
            [
                0.369581
                0.519968
                0.355745
            ]
            [
                0.692778
                0.332895
                0.680304
            ]
            [
                0.733149
                0.216316
                0.192628
            ]
            [
                0.546795
                0.08843
                0.918036
            ]
            [
                0.730665
                0.210219
                0.304676
            ]
            [
                0.470483
                0.922517
                0.123867
            ]
            [
                0.458365
                0.546795
                0.084702
            ]
            [
                0.664076
                0.334844
                0.151905
            ]
            [
                0.335924
                0.665156
                0.651905
            ]
            [
                0.427064
                0.260711
                0.546141
            ]
            [
                0.873568
                0.591404
                0.920032
            ]
            [
                0.332895
                0.640117
                0.513637
            ]
            [
                0.91157
                0.458365
                0.251369
            ]
            [
                0.849613
                0.369581
                0.522412
            ]
            [
                0.307222
                0.667105
                0.180304
            ]
            [
                0.334844
                0.670768
                0.985238
            ]
            [
                0.282164
                0.873568
                0.086698
            ]
            [
                0.789781
                0.520446
                0.638009
            ]
            [
                0.640117
                0.307222
                0.34697
            ]
            [
                0.536562
                0.458406
                0.207769
            ]
            [
                0.541635
                0.453205
                0.584702
            ]
            [
                0.667105
                0.359883
                0.013637
            ]
            [
                0.453205
                0.91157
                0.418036
            ]
            [
                0.458406
                0.921845
                0.041102
            ]
            [
                0.439285
                0.26849
                0.629017
            ]
            [
                0.166352
                0.427064
                0.712808
            ]
            [
                0.868816
                0.384119
                0.634409
            ]
            [
                0.483167
                0.266851
                0.859294
            ]
            [
                0.359883
                0.692778
                0.84697
            ]
            [
                0.529517
                0.077483
                0.623867
            ]
            [
                0.216316
                0.483167
                0.025961
            ]
            [
                0.210219
                0.479554
                0.138009
            ]
            [
                0.560715
                0.73151
                0.129017
            ]
            [
                0.408596
                0.282164
                0.253365
            ]
            [
                0.479554
                0.269335
                0.971343
            ]
            [
                0.452034
                0.529517
                0.790533
            ]
            [
                0.384119
                0.515303
                0.467742
            ]
            [
                0.572936
                0.739289
                0.046141
            ]
            [
                0.541594
                0.078155
                0.541102
            ]
            [
                0.73151
                0.170795
                0.96235
            ]
            [
                0.739289
                0.166352
                0.879474
            ]
            [
                0.269335
                0.789781
                0.804676
            ]
            [
                0.516833
                0.733149
                0.359294
            ]
            [
                0.515303
                0.131184
                0.301075
            ]
            [
                0.260711
                0.833648
                0.379474
            ]
            [
                0.670768
                0.335924
                0.818571
            ]
            [
                0.170795
                0.439285
                0.795683
            ]
            [
                0.519968
                0.150387
                0.189078
            ]
            [
                0.150387
                0.630419
                0.022412
            ]
            [
                0.591404
                0.717836
                0.753365
            ]
            [
                0.520446
                0.730665
                0.471343
            ]
            [
                0.783684
                0.516833
                0.525961
            ]
            [
                0.077483
                0.547966
                0.4572
            ]
            [
                0.480032
                0.849613
                0.689078
            ]
            [
                0.630419
                0.480032
                0.855745
            ]
            [
                0.463438
                0.541594
                0.707769
            ]
            [
                0.829205
                0.560715
                0.295683
            ]
            [
                0.08843
                0.541635
                0.751369
            ]
            [
                0.922517
                0.452034
                0.9572
            ]
            [
                0.078155
                0.536562
                0.374436
            ]
            [
                0.921845
                0.463438
                0.874436
            ]
            [
                0.717836
                0.126432
                0.586698
            ]
            [
                0.126432
                0.408596
                0.420032
            ]
            [
                0.26849
                0.829205
                0.46235
            ]
            [
                0.547966
                0.470483
                0.290533
            ]
            [
                0.131184
                0.615881
                0.134409
            ]
            [
                0.833648
                0.572936
                0.212808
            ]
            [
                0.615881
                0.484697
                0.967742
            ]
            [
                0.254712
                0.612118
                0.024832
            ]
            [
                0.240663
                0.606386
                0.138135
            ]
            [
                0.675679
                0.179892
                0.919253
            ]
            [
                0.324321
                0.820108
                0.419253
            ]
            [
                0.864998
                0.472821
                0.917102
            ]
            [
                0.365724
                0.759337
                0.804802
            ]
            [
                0.820108
                0.495787
                0.252586
            ]
            [
                0.135002
                0.527179
                0.417102
            ]
            [
                0.642594
                0.254712
                0.191499
            ]
            [
                0.606386
                0.365724
                0.971469
            ]
            [
                0.179892
                0.504213
                0.752586
            ]
            [
                0.504213
                0.324321
                0.58592
            ]
            [
                0.607823
                0.135002
                0.583769
            ]
            [
                0.393614
                0.634276
                0.471469
            ]
            [
                0.357406
                0.745288
                0.691499
            ]
            [
                0.745288
                0.387882
                0.524832
            ]
            [
                0.527179
                0.392177
                0.250436
            ]
            [
                0.472821
                0.607823
                0.750436
            ]
            [
                0.759337
                0.393614
                0.638135
            ]
            [
                0.392177
                0.864998
                0.083769
            ]
            [
                0.634276
                0.240663
                0.304802
            ]
            [
                0.612118
                0.357406
                0.858166
            ]
            [
                0.387882
                0.642594
                0.358166
            ]
            [
                0.495787
                0.675679
                0.08592
            ]
            [
                0.757377
                0.836505
                0.918866
            ]
            [
                0.08212
                0.275451
                0.255284
            ]
            [
                0.860123
                0.130276
                0.076563
            ]
            [
                0.724549
                0.806669
                0.588617
            ]
            [
                0.729848
                0.860123
                0.24323
            ]
            [
                0.917879
                0.724549
                0.755284
            ]
            [
                0.836505
                0.079128
                0.752199
            ]
            [
                0.079128
                0.242623
                0.585532
            ]
            [
                0.242623
                0.163495
                0.418866
            ]
            [
                0.869724
                0.729848
                0.409896
            ]
            [
                0.163495
                0.920872
                0.252199
            ]
            [
                0.270152
                0.139877
                0.74323
            ]
            [
                0.920872
                0.757377
                0.085532
            ]
            [
                0.130276
                0.270152
                0.909896
            ]
            [
                0.139877
                0.869724
                0.576563
            ]
            [
                0.275451
                0.193331
                0.088617
            ]
            [
                0.193331
                0.917879
                0.92195
            ]
            [
                0.806669
                0.08212
                0.42195
            ]
            [
                0.656198
                0.346272
                0.249826
            ]
            [
                0.346272
                0.690074
                0.083159
            ]
            [
                0.653728
                0.309926
                0.583159
            ]
            [
                0.690074
                0.343802
                0.916492
            ]
            [
                0.309926
                0.656198
                0.416492
            ]
            [
                0.343802
                0.653728
                0.749826
            ]
        ]
    }
    "species" {
        "source-value" [
            "Cd"
            "Cd"
            "Cd"
            "Cd"
            "Cd"
            "Cd"
            "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"
            "C"
            "C"
            "C"
            "C"
            "C"
            "C"
            "C"
            "C"
            "Br"
            "Br"
            "Br"
            "Br"
            "Br"
            "Br"
            "Br"
            "Br"
            "Br"
            "Br"
            "Br"
            "Br"
            "Br"
            "Br"
            "Br"
            "Br"
            "Br"
            "Br"
            "N"
            "N"
            "N"
            "N"
            "N"
            "N"
        ]
    }
    "cauchy-stress" {
        "source-value" [
            0
            0
            0
            0
            0
            0
        ]
        "source-unit" "GPa"
    }
    "temperature" {
        "source-value" 0
        "source-unit" "K"
    }
    "a" {
        "source-value" 9.55045450207
        "source-unit" "angstrom"
    }
    "c" {
        "source-value" 21.56541422
        "source-unit" "angstrom"
    }
}