{
    "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-tetragonal-crystal-npt"
    "instance-id" 1
    "space-group" {
        "source-value" "I4/mmm"
    }
    "basis-atom-coordinates" {
        "source-value" [
            [
                0.5
                0.5
                0.960791
            ]
            [
                0.5
                0.5
                0.039209
            ]
            [
                0.5
                0.5
                0.808093
            ]
            [
                0.5
                0.5
                0.191907
            ]
            [
                0
                0
                0.460791
            ]
            [
                0
                0
                0.539209
            ]
            [
                0
                0
                0.308093
            ]
            [
                0
                0
                0.691907
            ]
            [
                0.5
                0.5
                0.140356
            ]
            [
                0.5
                0.5
                0.092583
            ]
            [
                0.5
                0.5
                0.907417
            ]
            [
                0.5
                0.5
                0.859644
            ]
            [
                0
                0
                0.640356
            ]
            [
                0
                0
                0.592583
            ]
            [
                0
                0
                0.407417
            ]
            [
                0
                0
                0.359644
            ]
            [
                0
                0
                0.766571
            ]
            [
                0
                0
                0
            ]
            [
                0
                0
                0.233429
            ]
            [
                0.5
                0.5
                0.266571
            ]
            [
                0.5
                0.5
                0.5
            ]
            [
                0.5
                0.5
                0.733429
            ]
            [
                0
                0
                0.83725
            ]
            [
                0
                0
                0.069878
            ]
            [
                0
                0
                0.16275
            ]
            [
                0
                0
                0.930122
            ]
            [
                0
                0
                0.882718
            ]
            [
                0
                0
                0.117282
            ]
            [
                0.5
                0.5
                0.33725
            ]
            [
                0.5
                0.5
                0.569878
            ]
            [
                0.5
                0.5
                0.66275
            ]
            [
                0.5
                0.5
                0.430122
            ]
            [
                0.5
                0.5
                0.382718
            ]
            [
                0.5
                0.5
                0.617282
            ]
            [
                0
                0.5
                0.071602
            ]
            [
                0
                0.5
                0.928398
            ]
            [
                0.5
                0
                0.071602
            ]
            [
                0
                0
                0.795919
            ]
            [
                0.5
                0
                0.117519
            ]
            [
                0
                0.5
                0.836643
            ]
            [
                0.5
                0.5
                0.763553
            ]
            [
                0
                0
                0.969622
            ]
            [
                0
                0.5
                0.163357
            ]
            [
                0
                0.5
                0.882481
            ]
            [
                0
                0
                0.204081
            ]
            [
                0.5
                0
                0.836643
            ]
            [
                0
                0.5
                0.117519
            ]
            [
                0.5
                0
                0.163357
            ]
            [
                0.5
                0
                0.928398
            ]
            [
                0
                0
                0.030378
            ]
            [
                0.5
                0.5
                0
            ]
            [
                0.5
                0.5
                0.236447
            ]
            [
                0.5
                0
                0.882481
            ]
            [
                0.5
                0
                0.571602
            ]
            [
                0.5
                0
                0.428398
            ]
            [
                0
                0.5
                0.571602
            ]
            [
                0.5
                0.5
                0.295919
            ]
            [
                0
                0.5
                0.617519
            ]
            [
                0.5
                0
                0.336643
            ]
            [
                0
                0
                0.263553
            ]
            [
                0.5
                0.5
                0.469622
            ]
            [
                0.5
                0
                0.663357
            ]
            [
                0.5
                0
                0.382481
            ]
            [
                0.5
                0.5
                0.704081
            ]
            [
                0
                0.5
                0.336643
            ]
            [
                0.5
                0
                0.617519
            ]
            [
                0
                0.5
                0.663357
            ]
            [
                0
                0.5
                0.428398
            ]
            [
                0.5
                0.5
                0.530378
            ]
            [
                0
                0
                0.5
            ]
            [
                0
                0
                0.736447
            ]
            [
                0
                0.5
                0.382481
            ]
        ]
    }
    "species" {
        "source-value" [
            "Ba"
            "Ba"
            "Ba"
            "Ba"
            "Ba"
            "Ba"
            "Ba"
            "Ba"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Ca"
            "Tl"
            "Tl"
            "Tl"
            "Tl"
            "Tl"
            "Tl"
            "Cu"
            "Cu"
            "Cu"
            "Cu"
            "Cu"
            "Cu"
            "Cu"
            "Cu"
            "Cu"
            "Cu"
            "Cu"
            "Cu"
            "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" 3.86782791768
        "source-unit" "angstrom"
    }
    "c" {
        "source-value" 69.0887379187
        "source-unit" "angstrom"
    }
}