{
    "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt"
    "instance-id" 1
    "space-group" {
        "source-value" "Cmcm"
    }
    "basis-atom-coordinates" {
        "source-value" [
            [
                0.952913
                0.138044
                0.25
            ]
            [
                0.047087
                0.138044
                0.75
            ]
            [
                0.047087
                0.861956
                0.75
            ]
            [
                0.952913
                0.861956
                0.25
            ]
            [
                0.452913
                0.638044
                0.25
            ]
            [
                0.547087
                0.638044
                0.75
            ]
            [
                0.547087
                0.361956
                0.75
            ]
            [
                0.452913
                0.361956
                0.25
            ]
            [
                0.320391
                0
                0.984746
            ]
            [
                0.679609
                0
                0.015254
            ]
            [
                0.320391
                0
                0.515254
            ]
            [
                0.679609
                0
                0.484746
            ]
            [
                0.398669
                0
                0.094479
            ]
            [
                0.601331
                0
                0.905521
            ]
            [
                0.398669
                0
                0.405521
            ]
            [
                0.601331
                0
                0.594479
            ]
            [
                0.063051
                0.573308
                0.08909
            ]
            [
                0.936949
                0.573308
                0.91091
            ]
            [
                0.063051
                0.573308
                0.41091
            ]
            [
                0.936949
                0.573308
                0.58909
            ]
            [
                0.936949
                0.426692
                0.91091
            ]
            [
                0.063051
                0.426692
                0.08909
            ]
            [
                0.936949
                0.426692
                0.58909
            ]
            [
                0.063051
                0.426692
                0.41091
            ]
            [
                0.913439
                0.381709
                0.024378
            ]
            [
                0.086561
                0.381709
                0.975622
            ]
            [
                0.913439
                0.381709
                0.475622
            ]
            [
                0.086561
                0.381709
                0.524378
            ]
            [
                0.086561
                0.618291
                0.975622
            ]
            [
                0.913439
                0.618291
                0.024378
            ]
            [
                0.086561
                0.618291
                0.524378
            ]
            [
                0.913439
                0.618291
                0.475622
            ]
            [
                0.820391
                0.5
                0.984746
            ]
            [
                0.179609
                0.5
                0.015254
            ]
            [
                0.820391
                0.5
                0.515254
            ]
            [
                0.179609
                0.5
                0.484746
            ]
            [
                0.898669
                0.5
                0.094479
            ]
            [
                0.101331
                0.5
                0.905521
            ]
            [
                0.898669
                0.5
                0.405521
            ]
            [
                0.101331
                0.5
                0.594479
            ]
            [
                0.563051
                0.073308
                0.08909
            ]
            [
                0.436949
                0.073308
                0.91091
            ]
            [
                0.563051
                0.073308
                0.41091
            ]
            [
                0.436949
                0.073308
                0.58909
            ]
            [
                0.436949
                0.926692
                0.91091
            ]
            [
                0.563051
                0.926692
                0.08909
            ]
            [
                0.436949
                0.926692
                0.58909
            ]
            [
                0.563051
                0.926692
                0.41091
            ]
            [
                0.413439
                0.881709
                0.024378
            ]
            [
                0.586561
                0.881709
                0.975622
            ]
            [
                0.413439
                0.881709
                0.475622
            ]
            [
                0.586561
                0.881709
                0.524378
            ]
            [
                0.586561
                0.118291
                0.975622
            ]
            [
                0.413439
                0.118291
                0.024378
            ]
            [
                0.586561
                0.118291
                0.524378
            ]
            [
                0.413439
                0.118291
                0.475622
            ]
            [
                0.762372
                0
                0.197656
            ]
            [
                0.237628
                0
                0.802344
            ]
            [
                0.762372
                0
                0.302344
            ]
            [
                0.237628
                0
                0.697656
            ]
            [
                0.841833
                0.679615
                0.197569
            ]
            [
                0.158167
                0.679615
                0.802431
            ]
            [
                0.841833
                0.679615
                0.302431
            ]
            [
                0.158167
                0.679615
                0.697569
            ]
            [
                0.158167
                0.320385
                0.802431
            ]
            [
                0.841833
                0.320385
                0.197569
            ]
            [
                0.158167
                0.320385
                0.697569
            ]
            [
                0.841833
                0.320385
                0.302431
            ]
            [
                0.124945
                0.911305
                0.393501
            ]
            [
                0.875055
                0.911305
                0.606499
            ]
            [
                0.124945
                0.911305
                0.106499
            ]
            [
                0.875055
                0.911305
                0.893501
            ]
            [
                0.875055
                0.088695
                0.606499
            ]
            [
                0.124945
                0.088695
                0.393501
            ]
            [
                0.875055
                0.088695
                0.893501
            ]
            [
                0.124945
                0.088695
                0.106499
            ]
            [
                0.045304
                0.801163
                0.406402
            ]
            [
                0.954696
                0.801163
                0.593598
            ]
            [
                0.045304
                0.801163
                0.093598
            ]
            [
                0.954696
                0.801163
                0.906402
            ]
            [
                0.954696
                0.198837
                0.593598
            ]
            [
                0.045304
                0.198837
                0.406402
            ]
            [
                0.954696
                0.198837
                0.906402
            ]
            [
                0.045304
                0.198837
                0.093598
            ]
            [
                0.193047
                0
                0.973915
            ]
            [
                0.806953
                0
                0.026085
            ]
            [
                0.193047
                0
                0.526085
            ]
            [
                0.806953
                0
                0.473915
            ]
            [
                0.325244
                0
                0.161892
            ]
            [
                0.674756
                0
                0.838108
            ]
            [
                0.325244
                0
                0.338108
            ]
            [
                0.674756
                0
                0.661892
            ]
            [
                0.106539
                0.62644
                0.15173
            ]
            [
                0.893461
                0.62644
                0.84827
            ]
            [
                0.106539
                0.62644
                0.34827
            ]
            [
                0.893461
                0.62644
                0.65173
            ]
            [
                0.893461
                0.37356
                0.84827
            ]
            [
                0.106539
                0.37356
                0.15173
            ]
            [
                0.893461
                0.37356
                0.65173
            ]
            [
                0.106539
                0.37356
                0.34827
            ]
            [
                0.853222
                0.296622
                0.041352
            ]
            [
                0.146778
                0.296622
                0.958648
            ]
            [
                0.853222
                0.296622
                0.458648
            ]
            [
                0.146778
                0.296622
                0.541352
            ]
            [
                0.146778
                0.703378
                0.958648
            ]
            [
                0.853222
                0.703378
                0.041352
            ]
            [
                0.146778
                0.703378
                0.541352
            ]
            [
                0.853222
                0.703378
                0.458648
            ]
            [
                0.262372
                0.5
                0.197656
            ]
            [
                0.737628
                0.5
                0.802344
            ]
            [
                0.262372
                0.5
                0.302344
            ]
            [
                0.737628
                0.5
                0.697656
            ]
            [
                0.341833
                0.179615
                0.197569
            ]
            [
                0.658167
                0.179615
                0.802431
            ]
            [
                0.341833
                0.179615
                0.302431
            ]
            [
                0.658167
                0.179615
                0.697569
            ]
            [
                0.658167
                0.820385
                0.802431
            ]
            [
                0.341833
                0.820385
                0.197569
            ]
            [
                0.658167
                0.820385
                0.697569
            ]
            [
                0.341833
                0.820385
                0.302431
            ]
            [
                0.624945
                0.411305
                0.393501
            ]
            [
                0.375055
                0.411305
                0.606499
            ]
            [
                0.624945
                0.411305
                0.106499
            ]
            [
                0.375055
                0.411305
                0.893501
            ]
            [
                0.375055
                0.588695
                0.606499
            ]
            [
                0.624945
                0.588695
                0.393501
            ]
            [
                0.375055
                0.588695
                0.893501
            ]
            [
                0.624945
                0.588695
                0.106499
            ]
            [
                0.545304
                0.301163
                0.406402
            ]
            [
                0.454696
                0.301163
                0.593598
            ]
            [
                0.545304
                0.301163
                0.093598
            ]
            [
                0.454696
                0.301163
                0.906402
            ]
            [
                0.454696
                0.698837
                0.593598
            ]
            [
                0.545304
                0.698837
                0.406402
            ]
            [
                0.454696
                0.698837
                0.906402
            ]
            [
                0.545304
                0.698837
                0.093598
            ]
            [
                0.693047
                0.5
                0.973915
            ]
            [
                0.306953
                0.5
                0.026085
            ]
            [
                0.693047
                0.5
                0.526085
            ]
            [
                0.306953
                0.5
                0.473915
            ]
            [
                0.825244
                0.5
                0.161892
            ]
            [
                0.174756
                0.5
                0.838108
            ]
            [
                0.825244
                0.5
                0.338108
            ]
            [
                0.174756
                0.5
                0.661892
            ]
            [
                0.606539
                0.12644
                0.15173
            ]
            [
                0.393461
                0.12644
                0.84827
            ]
            [
                0.606539
                0.12644
                0.34827
            ]
            [
                0.393461
                0.12644
                0.65173
            ]
            [
                0.393461
                0.87356
                0.84827
            ]
            [
                0.606539
                0.87356
                0.15173
            ]
            [
                0.393461
                0.87356
                0.65173
            ]
            [
                0.606539
                0.87356
                0.34827
            ]
            [
                0.353222
                0.796622
                0.041352
            ]
            [
                0.646778
                0.796622
                0.958648
            ]
            [
                0.353222
                0.796622
                0.458648
            ]
            [
                0.646778
                0.796622
                0.541352
            ]
            [
                0.646778
                0.203378
                0.958648
            ]
            [
                0.353222
                0.203378
                0.041352
            ]
            [
                0.646778
                0.203378
                0.541352
            ]
            [
                0.353222
                0.203378
                0.458648
            ]
            [
                0.8268
                0
                0.25
            ]
            [
                0.1732
                0
                0.75
            ]
            [
                0.840857
                0.728259
                0.25
            ]
            [
                0.159143
                0.728259
                0.75
            ]
            [
                0.159143
                0.271741
                0.75
            ]
            [
                0.840857
                0.271741
                0.25
            ]
            [
                0.047104
                0.867155
                0.368926
            ]
            [
                0.952896
                0.867155
                0.631074
            ]
            [
                0.047104
                0.867155
                0.131074
            ]
            [
                0.952896
                0.867155
                0.868926
            ]
            [
                0.952896
                0.132846
                0.631074
            ]
            [
                0.047104
                0.132846
                0.368926
            ]
            [
                0.952896
                0.132846
                0.868926
            ]
            [
                0.047104
                0.132846
                0.131074
            ]
            [
                0.3268
                0.5
                0.25
            ]
            [
                0.6732
                0.5
                0.75
            ]
            [
                0.340857
                0.228259
                0.25
            ]
            [
                0.659143
                0.228259
                0.75
            ]
            [
                0.659143
                0.771741
                0.75
            ]
            [
                0.340857
                0.771741
                0.25
            ]
            [
                0.547104
                0.367154
                0.368926
            ]
            [
                0.452896
                0.367154
                0.631074
            ]
            [
                0.547104
                0.367154
                0.131074
            ]
            [
                0.452896
                0.367154
                0.868926
            ]
            [
                0.452896
                0.632845
                0.631074
            ]
            [
                0.547104
                0.632845
                0.368926
            ]
            [
                0.452896
                0.632845
                0.868926
            ]
            [
                0.547104
                0.632845
                0.131074
            ]
        ]
    }
    "species" {
        "source-value" [
            "Li"
            "Li"
            "Li"
            "Li"
            "Li"
            "Li"
            "Li"
            "Li"
            "B"
            "B"
            "B"
            "B"
            "B"
            "B"
            "B"
            "B"
            "B"
            "B"
            "B"
            "B"
            "B"
            "B"
            "B"
            "B"
            "B"
            "B"
            "B"
            "B"
            "B"
            "B"
            "B"
            "B"
            "B"
            "B"
            "B"
            "B"
            "B"
            "B"
            "B"
            "B"
            "B"
            "B"
            "B"
            "B"
            "B"
            "B"
            "B"
            "B"
            "B"
            "B"
            "B"
            "B"
            "B"
            "B"
            "B"
            "B"
            "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"
            "H"
            "H"
            "H"
            "H"
            "H"
            "H"
            "H"
            "H"
            "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" 9.37325658
        "source-unit" "angstrom"
    }
    "b" {
        "source-value" 12.16335162
        "source-unit" "angstrom"
    }
    "c" {
        "source-value" 14.78118641
        "source-unit" "angstrom"
    }
}