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The Datafile PD-CD 5
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nat0023
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1997-02-09
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2KB
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34 lines
COMPND GERANIOL
AUTHOR DAVE WOODCOCK 96 12 20
ATOM 1 C 1 4.289 -0.198 -0.081
ATOM 2 C 1 2.988 0.605 -0.045
ATOM 3 C 1 1.732 -0.027 -0.044
ATOM 4 C 1 1.720 -1.573 -0.081
ATOM 5 C 1 0.451 0.815 -0.007
ATOM 6 C 1 -0.841 -0.010 -0.005
ATOM 7 C 1 -2.078 0.887 0.036
ATOM 8 C 1 -3.369 0.336 0.042
ATOM 9 C 1 -4.584 1.266 0.084
ATOM 10 C 1 -3.567 -1.182 0.008
ATOM 11 O 1 5.399 0.680 -0.068
ATOM 12 H 1 4.318 -0.801 -0.988
ATOM 13 H 1 4.337 -0.851 0.791
ATOM 14 H 1 3.021 1.684 -0.019
ATOM 15 H 1 2.243 -1.961 0.793
ATOM 16 H 1 2.220 -1.918 -0.986
ATOM 17 H 1 0.690 -1.929 -0.077
ATOM 18 H 1 0.417 1.463 -0.883
ATOM 19 H 1 0.444 1.425 0.897
ATOM 20 H 1 -0.857 -0.658 0.871
ATOM 21 H 1 -0.886 -0.618 -0.908
ATOM 22 H 1 -1.966 1.961 0.060
ATOM 23 H 1 -4.573 1.916 -0.791
ATOM 24 H 1 -4.546 1.873 0.988
ATOM 25 H 1 -5.497 0.671 0.083
ATOM 26 H 1 -3.090 -1.630 0.880
ATOM 27 H 1 -3.118 -1.586 -0.899
ATOM 28 H 1 -4.633 -1.410 0.019
ATOM 29 H 1 5.375 1.277 0.831
TER 30 1
END