{
    "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-rhombohedral-crystal-npt"
    "instance-id" 1
    "space-group" {
        "source-value" "R3c"
    }
    "basis-atom-coordinates" {
        "source-value" [
            [
                0.853059
                0.131757
                0.067327
            ]
            [
                0.130949
                0.287204
                0.935053
            ]
            [
                0.464282
                0.510411
                0.10172
            ]
            [
                0.205934
                0.392056
                0.841684
            ]
            [
                0.519726
                0.054635
                0.900661
            ]
            [
                0.519456
                0.058723
                0.00835
            ]
            [
                0.712796
                0.843745
                0.935053
            ]
            [
                0.941277
                0.460733
                0.00835
            ]
            [
                0.945365
                0.46509
                0.900661
            ]
            [
                0.278698
                0.146941
                0.067327
            ]
            [
                0.607944
                0.813878
                0.841684
            ]
            [
                0.046129
                0.535718
                0.10172
            ]
            [
                0.186122
                0.794066
                0.841684
            ]
            [
                0.489589
                0.953871
                0.10172
            ]
            [
                0.539267
                0.480544
                0.00835
            ]
            [
                0.53491
                0.480274
                0.900661
            ]
            [
                0.868243
                0.721302
                0.067327
            ]
            [
                0.156255
                0.869051
                0.935053
            ]
            [
                0.519726
                0.46509
                0.400661
            ]
            [
                0.797615
                0.620537
                0.268387
            ]
            [
                0.130949
                0.843745
                0.435053
            ]
            [
                0.872601
                0.72539
                0.175017
            ]
            [
                0.186392
                0.387969
                0.233994
            ]
            [
                0.186122
                0.392056
                0.341684
            ]
            [
                0.379463
                0.177078
                0.268387
            ]
            [
                0.607944
                0.794066
                0.341684
            ]
            [
                0.612031
                0.798424
                0.233994
            ]
            [
                0.945365
                0.480274
                0.400661
            ]
            [
                0.27461
                0.147211
                0.175017
            ]
            [
                0.712796
                0.869051
                0.435053
            ]
            [
                0.852789
                0.127399
                0.175017
            ]
            [
                0.156255
                0.287204
                0.435053
            ]
            [
                0.205934
                0.813878
                0.341684
            ]
            [
                0.201576
                0.813608
                0.233994
            ]
            [
                0.53491
                0.054635
                0.400661
            ]
            [
                0.822922
                0.202385
                0.268387
            ]
            [
                0.186392
                0.798424
                0.733994
            ]
            [
                0.464282
                0.953871
                0.60172
            ]
            [
                0.797615
                0.177078
                0.768387
            ]
            [
                0.539267
                0.058723
                0.50835
            ]
            [
                0.853059
                0.721302
                0.567327
            ]
            [
                0.852789
                0.72539
                0.675017
            ]
            [
                0.046129
                0.510411
                0.60172
            ]
            [
                0.27461
                0.127399
                0.675017
            ]
            [
                0.278698
                0.131757
                0.567327
            ]
            [
                0.612031
                0.813608
                0.733994
            ]
            [
                0.941277
                0.480544
                0.50835
            ]
            [
                0.379463
                0.202385
                0.768387
            ]
            [
                0.519456
                0.460733
                0.50835
            ]
            [
                0.822922
                0.620537
                0.768387
            ]
            [
                0.872601
                0.147211
                0.675017
            ]
            [
                0.868243
                0.146941
                0.567327
            ]
            [
                0.201576
                0.387969
                0.733994
            ]
            [
                0.489589
                0.535718
                0.60172
            ]
            [
                0
                0
                0.999707
            ]
            [
                0.333333
                0.666667
                0.166373
            ]
            [
                0.666667
                0.333333
                0.33304
            ]
            [
                0
                0
                0.499707
            ]
            [
                0.333333
                0.666667
                0.666373
            ]
            [
                0.666667
                0.333333
                0.83304
            ]
            [
                0.825104
                0.141607
                0.8635
            ]
            [
                0.144052
                0.323884
                0.135805
            ]
            [
                0.810718
                0.153501
                0.969138
            ]
            [
                0.158437
                0.350164
                0.030166
            ]
            [
                0.676116
                0.820167
                0.135805
            ]
            [
                0.649836
                0.808273
                0.030166
            ]
            [
                0.666667
                0.333333
                0.061576
            ]
            [
                0.333333
                0.666667
                0.894909
            ]
            [
                0.316503
                0.174896
                0.8635
            ]
            [
                0.342782
                0.189282
                0.969138
            ]
            [
                0.846499
                0.657218
                0.969138
            ]
            [
                0.191727
                0.841563
                0.030166
            ]
            [
                0.858393
                0.683497
                0.8635
            ]
            [
                0.179833
                0.855948
                0.135805
            ]
            [
                0.491771
                0.47494
                0.196833
            ]
            [
                0.810718
                0.657218
                0.469138
            ]
            [
                0.477385
                0.486834
                0.302472
            ]
            [
                0.825104
                0.683497
                0.3635
            ]
            [
                0.342782
                0.153501
                0.469138
            ]
            [
                0.316503
                0.141607
                0.3635
            ]
            [
                0.333333
                0.666667
                0.394909
            ]
            [
                0
                0
                0.228242
            ]
            [
                0.983169
                0.508229
                0.196833
            ]
            [
                0.009449
                0.522615
                0.302472
            ]
            [
                0.513166
                0.990551
                0.302472
            ]
            [
                0.858393
                0.174896
                0.3635
            ]
            [
                0.52506
                0.016831
                0.196833
            ]
            [
                0.846499
                0.189282
                0.469138
            ]
            [
                0.158437
                0.808273
                0.530166
            ]
            [
                0.477385
                0.990551
                0.802472
            ]
            [
                0.144052
                0.820167
                0.635805
            ]
            [
                0.491771
                0.016831
                0.696833
            ]
            [
                0.009449
                0.486834
                0.802472
            ]
            [
                0.983169
                0.47494
                0.696833
            ]
            [
                0
                0
                0.728242
            ]
            [
                0.666667
                0.333333
                0.561576
            ]
            [
                0.649836
                0.841563
                0.530166
            ]
            [
                0.676116
                0.855948
                0.635805
            ]
            [
                0.179833
                0.323884
                0.635805
            ]
            [
                0.52506
                0.508229
                0.696833
            ]
            [
                0.191727
                0.350164
                0.530166
            ]
            [
                0.513166
                0.522615
                0.802472
            ]
            [
                0.905022
                0.075271
                0.962827
            ]
            [
                0.218375
                0.251602
                0.114809
            ]
            [
                0.08415
                0.173703
                0.033779
            ]
            [
                0.726721
                0.005686
                0.887648
            ]
            [
                0.481535
                0.420369
                0.158392
            ]
            [
                0.475723
                0.957302
                0.842613
            ]
            [
                0.650542
                0.046099
                0.9566
            ]
            [
                0.983743
                0.235912
                0.877937
            ]
            [
                0.317076
                0.414497
                0.044604
            ]
            [
                0.983875
                0.271109
                0.123267
            ]
            [
                0.809056
                0.185088
                0.009279
            ]
            [
                0.643593
                0.181393
                0.074284
            ]
            [
                0.148202
                0.3945
                0.991725
            ]
            [
                0.204467
                0.514726
                0.907617
            ]
            [
                0.728891
                0.712766
                0.123267
            ]
            [
                0.612299
                0.672353
                0.054315
            ]
            [
                0.060054
                0.387701
                0.054315
            ]
            [
                0.750817
                0.24378
                0.867113
            ]
            [
                0.885041
                0.300106
                0.948142
            ]
            [
                0.238355
                0.496418
                0.129494
            ]
            [
                0.252169
                0.016257
                0.877937
            ]
            [
                0.415065
                0.114959
                0.948142
            ]
            [
                0.6055
                0.753702
                0.991725
            ]
            [
                0.485274
                0.68974
                0.907617
            ]
            [
                0.503582
                0.741937
                0.129494
            ]
            [
                0.042698
                0.518421
                0.842613
            ]
            [
                0.826297
                0.910447
                0.033779
            ]
            [
                0.666667
                0.333333
                0.019869
            ]
            [
                0.333333
                0.666667
                0.853202
            ]
            [
                0.492963
                0.249183
                0.867113
            ]
            [
                0.376031
                0.190944
                0.009279
            ]
            [
                0.170249
                0.094978
                0.962827
            ]
            [
                0.818607
                0.4622
                0.074284
            ]
            [
                0.938834
                0.518465
                0.158392
            ]
            [
                0.748398
                0.966773
                0.114809
            ]
            [
                0.585503
                0.902579
                0.044604
            ]
            [
                0.953901
                0.604443
                0.9566
            ]
            [
                0.097421
                0.682924
                0.044604
            ]
            [
                0.75622
                0.507037
                0.867113
            ]
            [
                0.258063
                0.761645
                0.129494
            ]
            [
                0.278966
                0.273279
                0.887648
            ]
            [
                0.395557
                0.349458
                0.9566
            ]
            [
                0.5378
                0.356407
                0.074284
            ]
            [
                0.31026
                0.795533
                0.907617
            ]
            [
                0.814912
                0.623969
                0.009279
            ]
            [
                0.246298
                0.851798
                0.991725
            ]
            [
                0.994314
                0.721034
                0.887648
            ]
            [
                0.699894
                0.584935
                0.948142
            ]
            [
                0.033227
                0.781625
                0.114809
            ]
            [
                0.327647
                0.939946
                0.054315
            ]
            [
                0.579631
                0.061166
                0.158392
            ]
            [
                0.481579
                0.524277
                0.842613
            ]
            [
                0.924729
                0.829751
                0.962827
            ]
            [
                0.089553
                0.91585
                0.033779
            ]
            [
                0.764088
                0.747831
                0.877937
            ]
            [
                0.287234
                0.016125
                0.123267
            ]
            [
                0.571689
                0.408604
                0.29616
            ]
            [
                0.885041
                0.584935
                0.448142
            ]
            [
                0.750817
                0.507037
                0.367113
            ]
            [
                0.393387
                0.33902
                0.220981
            ]
            [
                0.148202
                0.753702
                0.491725
            ]
            [
                0.14239
                0.290635
                0.175946
            ]
            [
                0.317208
                0.379432
                0.289934
            ]
            [
                0.650409
                0.569245
                0.21127
            ]
            [
                0.983743
                0.747831
                0.377937
            ]
            [
                0.650542
                0.604443
                0.4566
            ]
            [
                0.475723
                0.518421
                0.342613
            ]
            [
                0.31026
                0.514726
                0.407617
            ]
            [
                0.814868
                0.727833
                0.325058
            ]
            [
                0.871133
                0.84806
                0.24095
            ]
            [
                0.395557
                0.046099
                0.4566
            ]
            [
                0.278966
                0.005686
                0.387648
            ]
            [
                0.726721
                0.721034
                0.387648
            ]
            [
                0.417483
                0.577113
                0.200446
            ]
            [
                0.551708
                0.63344
                0.281476
            ]
            [
                0.905022
                0.829751
                0.462827
            ]
            [
                0.918836
                0.349591
                0.21127
            ]
            [
                0.081732
                0.448292
                0.281476
            ]
            [
                0.272167
                0.087036
                0.325058
            ]
            [
                0.15194
                0.023074
                0.24095
            ]
            [
                0.170249
                0.075271
                0.462827
            ]
            [
                0.709365
                0.851755
                0.175946
            ]
            [
                0.492963
                0.24378
                0.367113
            ]
            [
                0.333333
                0.666667
                0.353202
            ]
            [
                0
                0
                0.186535
            ]
            [
                0.15963
                0.582517
                0.200446
            ]
            [
                0.042698
                0.524277
                0.342613
            ]
            [
                0.836915
                0.428311
                0.29616
            ]
            [
                0.485274
                0.795533
                0.407617
            ]
            [
                0.6055
                0.851798
                0.491725
            ]
            [
                0.415065
                0.300106
                0.448142
            ]
            [
                0.252169
                0.235912
                0.377937
            ]
            [
                0.620568
                0.937776
                0.289934
            ]
            [
                0.764088
                0.016257
                0.377937
            ]
            [
                0.422887
                0.84037
                0.200446
            ]
            [
                0.924729
                0.094978
                0.462827
            ]
            [
                0.945633
                0.606613
                0.220981
            ]
            [
                0.062224
                0.682792
                0.289934
            ]
            [
                0.204467
                0.68974
                0.407617
            ]
            [
                0.976926
                0.128867
                0.24095
            ]
            [
                0.481579
                0.957302
                0.342613
            ]
            [
                0.912964
                0.185132
                0.325058
            ]
            [
                0.66098
                0.054367
                0.220981
            ]
            [
                0.36656
                0.918268
                0.281476
            ]
            [
                0.699894
                0.114959
                0.448142
            ]
            [
                0.994314
                0.273279
                0.387648
            ]
            [
                0.246298
                0.3945
                0.491725
            ]
            [
                0.148245
                0.85761
                0.175946
            ]
            [
                0.591396
                0.163085
                0.29616
            ]
            [
                0.75622
                0.249183
                0.367113
            ]
            [
                0.430755
                0.081164
                0.21127
            ]
            [
                0.953901
                0.349458
                0.4566
            ]
            [
                0.238355
                0.741937
                0.629494
            ]
            [
                0.551708
                0.918268
                0.781476
            ]
            [
                0.417483
                0.84037
                0.700446
            ]
            [
                0.060054
                0.672353
                0.554315
            ]
            [
                0.814868
                0.087036
                0.825058
            ]
            [
                0.809056
                0.623969
                0.509279
            ]
            [
                0.983875
                0.712766
                0.623267
            ]
            [
                0.317076
                0.902579
                0.544604
            ]
            [
                0.650409
                0.081164
                0.71127
            ]
            [
                0.317208
                0.937776
                0.789934
            ]
            [
                0.14239
                0.851755
                0.675946
            ]
            [
                0.976926
                0.84806
                0.74095
            ]
            [
                0.481535
                0.061166
                0.658392
            ]
            [
                0.5378
                0.181393
                0.574284
            ]
            [
                0.062224
                0.379432
                0.789934
            ]
            [
                0.945633
                0.33902
                0.720981
            ]
            [
                0.393387
                0.054367
                0.720981
            ]
            [
                0.08415
                0.910447
                0.533779
            ]
            [
                0.218375
                0.966773
                0.614809
            ]
            [
                0.571689
                0.163085
                0.79616
            ]
            [
                0.585503
                0.682924
                0.544604
            ]
            [
                0.748398
                0.781625
                0.614809
            ]
            [
                0.938834
                0.420369
                0.658392
            ]
            [
                0.818607
                0.356407
                0.574284
            ]
            [
                0.836915
                0.408604
                0.79616
            ]
            [
                0.376031
                0.185088
                0.509279
            ]
            [
                0.15963
                0.577113
                0.700446
            ]
            [
                0
                0
                0.686535
            ]
            [
                0.666667
                0.333333
                0.519869
            ]
            [
                0.826297
                0.91585
                0.533779
            ]
            [
                0.709365
                0.85761
                0.675946
            ]
            [
                0.503582
                0.761645
                0.629494
            ]
            [
                0.15194
                0.128867
                0.74095
            ]
            [
                0.272167
                0.185132
                0.825058
            ]
            [
                0.081732
                0.63344
                0.781476
            ]
            [
                0.918836
                0.569245
                0.71127
            ]
            [
                0.287234
                0.271109
                0.623267
            ]
            [
                0.430755
                0.349591
                0.71127
            ]
            [
                0.089553
                0.173703
                0.533779
            ]
            [
                0.591396
                0.428311
                0.79616
            ]
            [
                0.612299
                0.939946
                0.554315
            ]
            [
                0.728891
                0.016125
                0.623267
            ]
            [
                0.871133
                0.023074
                0.74095
            ]
            [
                0.643593
                0.4622
                0.574284
            ]
            [
                0.148245
                0.290635
                0.675946
            ]
            [
                0.579631
                0.518465
                0.658392
            ]
            [
                0.327647
                0.387701
                0.554315
            ]
            [
                0.033227
                0.251602
                0.614809
            ]
            [
                0.36656
                0.448292
                0.781476
            ]
            [
                0.66098
                0.606613
                0.720981
            ]
            [
                0.912964
                0.727833
                0.825058
            ]
            [
                0.814912
                0.190944
                0.509279
            ]
            [
                0.258063
                0.496418
                0.629494
            ]
            [
                0.422887
                0.582517
                0.700446
            ]
            [
                0.097421
                0.414497
                0.544604
            ]
            [
                0.620568
                0.682792
                0.789934
            ]
        ]
    }
    "species" {
        "source-value" [
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Co"
            "Co"
            "Co"
            "Co"
            "Co"
            "Co"
            "P"
            "P"
            "P"
            "P"
            "P"
            "P"
            "P"
            "P"
            "P"
            "P"
            "P"
            "P"
            "P"
            "P"
            "P"
            "P"
            "P"
            "P"
            "P"
            "P"
            "P"
            "P"
            "P"
            "P"
            "P"
            "P"
            "P"
            "P"
            "P"
            "P"
            "P"
            "P"
            "P"
            "P"
            "P"
            "P"
            "P"
            "P"
            "P"
            "P"
            "P"
            "P"
            "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"
            "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"
            "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"
            "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" 10.46403477
        "source-unit" "angstrom"
    }
    "alpha" {
        "source-value" 90
        "source-unit" "degree"
    }
}