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-ISIS- 3D
8 3 0 0 0 0 0 0 0 0 1 V2000
84.0000 138.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
84.0000 138.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
105.6510 125.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
105.6510 125.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
127.3010 138.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
127.3010 138.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
148.9520 125.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
148.9520 125.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
2 3 1 0 0 0 0
3 4 1 0 0 0 0
M END
> <a_count>
789
> <GenerationSoftware>
XDrawChem 0.9
> <testDoubleArray>
10
7.674
8.9731
8.9731
7.674
6.375
6.375
10.2721
10.2721
8.973
7.674
> <GenerationDate>
Sat May 4 14:07:20 2002
> <testIntArray>
7
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6
7
> <Kier2>
456.123
> <Kier1>
123.456
> <testDescString>
abcgdg
$$$$
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