File: gs.xyz

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gpaw 21.1.0-1
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file content (16 lines) | stat: -rw-r--r-- 1,012 bytes parent folder | download | duplicates (6)
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Pt      0.000000000000000      0.000000000000000      0.000000000000000
Pt      1.417500000000000      2.455182019728883      0.000000000000000
Pt      0.000000000000000      3.273576026305178      2.314777500000000
Pt      1.417500000000000      0.818394006576295      2.314777500000000
Pt      0.000000000000000      1.636788013152589      4.641355000000001
Pt      1.417500000000000      4.091970032881473      4.641355000000001
Pt      2.835000000000000      0.000000000000000      0.000000000000000
Pt      4.252500000000000      2.455182019728883      0.000000000000000
Pt      2.835000000000000      3.273576026305178      2.314777500000000
Pt      4.252500000000000      0.818394006576295      2.314777500000000
Pt      2.835000000000000      1.636788013152589      4.641355000000001
Pt      4.252500000000000      4.091970032881473      4.641355000000001
C       1.417500015396857      4.092053726367659      6.510235842827654
O       1.417500024461528      4.091934739974321      7.668105648600448