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https://github.com/pfloos/quack
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6 lines
157 B
Plaintext
6 lines
157 B
Plaintext
# nAt nEla nElb nCore nRyd
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2 7 6 0 0
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# Znuc x y z
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C 0.00000000 0.00000000 -1.18953886
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N 0.00000000 0.00000000 1.01938091
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