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LCPQ
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qp2
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https://github.com/QuantumPackage/qp2.git
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qp2
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tests
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hcn.xyz
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HCN Geo: Experiment Mult: 1 symmetry: 14
C 0.0 0.0 0.0
H 0.0 0.0 1.064
N 0.0 0.0 -1.156
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