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quack
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quack/mol/ethylene.xyz

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xyz files
2020-10-12 14:30:00 +02:00
6
qsGW
2021-06-25 10:19:42 +02:00
xyz files
2020-10-12 14:30:00 +02:00
C 0.00000000 0.66690396 0.00000000
C 0.00000000 -0.66690396 0.00000000
H 0.00000000 1.22952195 0.92229064
H 0.00000000 -1.22952195 0.92229064
H 0.00000000 1.22952195 -0.92229064
qsGW
2021-06-25 10:19:42 +02:00
H 0.00000000 -1.22952195 -0.92229064