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https://github.com/pfloos/quack
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7 lines
234 B
Plaintext
7 lines
234 B
Plaintext
# nAt nEla nElb nCore nRyd
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3 12 12 0 0
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# Znuc x y z
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O 0.00000 0.65550 -0.73139
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O -0.00000 -0.61386 0.00000
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O 0.00000 0.65550 0.73139
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