{
    "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-rhombohedral-crystal-npt"
    "instance-id" 1
    "space-group" {
        "source-value" "R3"
    }
    "basis-atom-coordinates" {
        "source-value" [
            [
                0
                0
                0.025842
            ]
            [
                0.333333
                0.666667
                0.912369
            ]
            [
                0.666667
                0.333333
                0.941747
            ]
            [
                0.333333
                0.666667
                0.057566
            ]
            [
                0.666667
                0.333333
                0.859589
            ]
            [
                0
                0
                0.973839
            ]
            [
                0
                0
                0.890112
            ]
            [
                0.666667
                0.333333
                0.359176
            ]
            [
                0
                0
                0.245702
            ]
            [
                0.333333
                0.666667
                0.27508
            ]
            [
                0
                0
                0.390899
            ]
            [
                0.333333
                0.666667
                0.192922
            ]
            [
                0.666667
                0.333333
                0.307172
            ]
            [
                0.666667
                0.333333
                0.223445
            ]
            [
                0.333333
                0.666667
                0.692509
            ]
            [
                0.666667
                0.333333
                0.579035
            ]
            [
                0
                0
                0.608413
            ]
            [
                0.666667
                0.333333
                0.724233
            ]
            [
                0
                0
                0.526255
            ]
            [
                0.333333
                0.666667
                0.640505
            ]
            [
                0.333333
                0.666667
                0.556778
            ]
            [
                0
                0
                0.104928
            ]
            [
                0
                0
                0.162054
            ]
            [
                0.333333
                0.666667
                0.870504
            ]
            [
                0
                0
                0.065052
            ]
            [
                0.333333
                0.666667
                0.96268
            ]
            [
                0.666667
                0.333333
                0.995498
            ]
            [
                0.333333
                0.666667
                0.00487
            ]
            [
                0.333333
                0.666667
                0.099116
            ]
            [
                0.666667
                0.333333
                0.899552
            ]
            [
                0.666667
                0.333333
                0.037725
            ]
            [
                0.666667
                0.333333
                0.131057
            ]
            [
                0
                0
                0.838054
            ]
            [
                0.666667
                0.333333
                0.438261
            ]
            [
                0.666667
                0.333333
                0.495388
            ]
            [
                0
                0
                0.203838
            ]
            [
                0.666667
                0.333333
                0.398385
            ]
            [
                0
                0
                0.296013
            ]
            [
                0.333333
                0.666667
                0.328832
            ]
            [
                0
                0
                0.338203
            ]
            [
                0
                0
                0.432449
            ]
            [
                0.333333
                0.666667
                0.232886
            ]
            [
                0.333333
                0.666667
                0.371058
            ]
            [
                0.333333
                0.666667
                0.46439
            ]
            [
                0.666667
                0.333333
                0.171388
            ]
            [
                0.333333
                0.666667
                0.771594
            ]
            [
                0.333333
                0.666667
                0.828721
            ]
            [
                0.666667
                0.333333
                0.537171
            ]
            [
                0.333333
                0.666667
                0.731719
            ]
            [
                0.666667
                0.333333
                0.629347
            ]
            [
                0
                0
                0.662165
            ]
            [
                0.666667
                0.333333
                0.671537
            ]
            [
                0.666667
                0.333333
                0.765782
            ]
            [
                0
                0
                0.566219
            ]
            [
                0
                0
                0.704392
            ]
            [
                0
                0
                0.797724
            ]
            [
                0.333333
                0.666667
                0.504721
            ]
            [
                0
                0
                0.932094
            ]
            [
                0.666667
                0.333333
                0.265427
            ]
            [
                0.333333
                0.666667
                0.59876
            ]
            [
                0.02177
                0.63336
                0.984198
            ]
            [
                0.965718
                0.675251
                0.050029
            ]
            [
                0.61159
                0.97823
                0.984198
            ]
            [
                0.299248
                0.3543
                0.849677
            ]
            [
                0.36664
                0.38841
                0.984198
            ]
            [
                0.338164
                0.291433
                0.916548
            ]
            [
                0.995714
                0.658847
                0.11623
            ]
            [
                0.91771
                0.274004
                0.150111
            ]
            [
                0.293764
                0.965177
                0.950345
            ]
            [
                0.242722
                0.920888
                0.084788
            ]
            [
                0.624062
                0.620133
                0.883684
            ]
            [
                0.671413
                0.706236
                0.950345
            ]
            [
                0.356293
                0.08229
                0.150111
            ]
            [
                0.379867
                0.003928
                0.883684
            ]
            [
                0.079112
                0.321834
                0.084788
            ]
            [
                0.953268
                0.661836
                0.916548
            ]
            [
                0.663133
                0.004286
                0.11623
            ]
            [
                0.6457
                0.944948
                0.849677
            ]
            [
                0.324749
                0.290467
                0.050029
            ]
            [
                0.341153
                0.336867
                0.11623
            ]
            [
                0.708567
                0.046732
                0.916548
            ]
            [
                0.709533
                0.034282
                0.050029
            ]
            [
                0.055052
                0.700752
                0.849677
            ]
            [
                0.996072
                0.375938
                0.883684
            ]
            [
                0.678166
                0.757278
                0.084788
            ]
            [
                0.631589
                0.609821
                0.016526
            ]
            [
                0.725996
                0.643707
                0.150111
            ]
            [
                0.390179
                0.021769
                0.016526
            ]
            [
                0.034823
                0.328587
                0.950345
            ]
            [
                0.978231
                0.368411
                0.016526
            ]
            [
                0.688437
                0.966694
                0.317532
            ]
            [
                0.632384
                0.008584
                0.383363
            ]
            [
                0.278257
                0.311563
                0.317532
            ]
            [
                0.965915
                0.687633
                0.18301
            ]
            [
                0.033306
                0.721743
                0.317532
            ]
            [
                0.004831
                0.624766
                0.249881
            ]
            [
                0.662381
                0.99218
                0.449563
            ]
            [
                0.584377
                0.607337
                0.483444
            ]
            [
                0.960431
                0.29851
                0.283678
            ]
            [
                0.909389
                0.254221
                0.418121
            ]
            [
                0.290728
                0.953467
                0.217017
            ]
            [
                0.338079
                0.039569
                0.283678
            ]
            [
                0.02296
                0.415623
                0.483444
            ]
            [
                0.046533
                0.337262
                0.217017
            ]
            [
                0.745779
                0.655167
                0.418121
            ]
            [
                0.619935
                0.995169
                0.249881
            ]
            [
                0.329799
                0.337619
                0.449563
            ]
            [
                0.312367
                0.278282
                0.18301
            ]
            [
                0.991416
                0.6238
                0.383363
            ]
            [
                0.00782
                0.670201
                0.449563
            ]
            [
                0.375234
                0.380065
                0.249881
            ]
            [
                0.3762
                0.367616
                0.383363
            ]
            [
                0.721718
                0.034085
                0.18301
            ]
            [
                0.662738
                0.709272
                0.217017
            ]
            [
                0.344833
                0.090611
                0.418121
            ]
            [
                0.298256
                0.943154
                0.349859
            ]
            [
                0.392663
                0.97704
                0.483444
            ]
            [
                0.056846
                0.355102
                0.349859
            ]
            [
                0.70149
                0.661921
                0.283678
            ]
            [
                0.644898
                0.701744
                0.349859
            ]
            [
                0.355103
                0.300027
                0.650865
            ]
            [
                0.299051
                0.341918
                0.716696
            ]
            [
                0.944924
                0.644897
                0.650865
            ]
            [
                0.632581
                0.020966
                0.516343
            ]
            [
                0.699973
                0.055076
                0.650865
            ]
            [
                0.671497
                0.958099
                0.583215
            ]
            [
                0.329048
                0.325514
                0.782896
            ]
            [
                0.251044
                0.940671
                0.816777
            ]
            [
                0.627097
                0.631843
                0.617011
            ]
            [
                0.576056
                0.587555
                0.751454
            ]
            [
                0.957395
                0.2868
                0.55035
            ]
            [
                0.004746
                0.372903
                0.617011
            ]
            [
                0.689627
                0.748956
                0.816777
            ]
            [
                0.7132
                0.670595
                0.55035
            ]
            [
                0.412445
                0.988501
                0.751454
            ]
            [
                0.286602
                0.328503
                0.583215
            ]
            [
                0.996466
                0.670952
                0.782896
            ]
            [
                0.979034
                0.611615
                0.516343
            ]
            [
                0.658082
                0.957133
                0.716696
            ]
            [
                0.674486
                0.003534
                0.782896
            ]
            [
                0.041901
                0.713398
                0.583215
            ]
            [
                0.042867
                0.700949
                0.716696
            ]
            [
                0.388385
                0.367419
                0.516343
            ]
            [
                0.329405
                0.042605
                0.55035
            ]
            [
                0.011499
                0.423944
                0.751454
            ]
            [
                0.964923
                0.276487
                0.683193
            ]
            [
                0.059329
                0.310373
                0.816777
            ]
            [
                0.723513
                0.688435
                0.683193
            ]
            [
                0.368157
                0.995254
                0.617011
            ]
            [
                0.311565
                0.035077
                0.683193
            ]
        ]
    }
    "species" {
        "source-value" [
            "Li"
            "Li"
            "Li"
            "Li"
            "Li"
            "Li"
            "Li"
            "Li"
            "Li"
            "Li"
            "Li"
            "Li"
            "Li"
            "Li"
            "Li"
            "Li"
            "Li"
            "Li"
            "Li"
            "Li"
            "Li"
            "Ti"
            "Ti"
            "Ti"
            "Ti"
            "Ti"
            "Ti"
            "Ti"
            "Ti"
            "Ti"
            "Ti"
            "Ti"
            "Ti"
            "Ti"
            "Ti"
            "Ti"
            "Ti"
            "Ti"
            "Ti"
            "Ti"
            "Ti"
            "Ti"
            "Ti"
            "Ti"
            "Ti"
            "Ti"
            "Ti"
            "Ti"
            "Ti"
            "Ti"
            "Ti"
            "Ti"
            "Ti"
            "Ti"
            "Ti"
            "Ti"
            "Ti"
            "Nb"
            "Nb"
            "Nb"
            "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" 5.14079564
        "source-unit" "angstrom"
    }
    "alpha" {
        "source-value" 90
        "source-unit" "degree"
    }
}