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The Datafile PD-CD 5
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Text File
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1996-12-01
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432b
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11 lines
COMPND ACETONITRILE
AUTHOR DAVE WOODCOCK 96 11 18
ATOM 1 C 1 0.278 -0.024 -0.381
ATOM 2 N 1 1.475 -0.050 -0.471
ATOM 3 C 1 -1.243 0.011 -0.266
ATOM 4 H 1 -1.527 0.057 0.785
ATOM 5 H 1 -1.662 -0.889 -0.717
ATOM 6 H 1 -1.627 0.889 -0.785
TER 7 1
END