quack/mol/hccl.xyz

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2020-10-12 14:30:00 +02:00
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\ce{HCCl},^1A^\prime,CC3,aug-cc-pVTZ
H -0.99521495 0.00000000 -0.07579894
Cl 1.20948440 0.00000000 -0.22892822
C -0.21426945 0.00000000 0.69937099