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- COMPND tert-butyl chloride
- ATOM 1 C MOL 1 0.152 -0.384 -0.004 1.00 0.00
- ATOM 2 CL MOL 1 1.628 -1.440 -0.048 1.00 0.00
- ATOM 3 C MOL 1 -0.700 -0.676 -1.248 1.00 0.00
- ATOM 4 C MOL 1 -0.640 -0.700 1.272 1.00 0.00
- ATOM 5 C MOL 1 0.604 1.084 -0.000 1.00 0.00
- ATOM 6 H MOL 1 -1.028 -1.744 -1.280 1.00 0.00
- ATOM 7 H MOL 1 -0.144 -0.468 -2.192 1.00 0.00
- ATOM 8 H MOL 1 -1.624 -0.048 -1.256 1.00 0.00
- ATOM 9 H MOL 1 -0.040 -0.488 2.192 1.00 0.00
- ATOM 10 H MOL 1 -0.952 -1.772 1.308 1.00 0.00
- ATOM 11 H MOL 1 -1.568 -0.084 1.328 1.00 0.00
- ATOM 12 H MOL 1 1.240 1.316 0.880 1.00 0.00
- ATOM 13 H MOL 1 -0.268 1.772 0.024 1.00 0.00
- ATOM 14 H MOL 1 1.192 1.332 -0.916 1.00 0.00
- COLOR# ## C ### ## 50.0 50.0 50.0 0.48 1.43
- COLOR# ## CL ### ## 00.0 99.0 00.0 0.56 1.69
- COLOR# ## H ### ## 99.0 99.0 00.0 0.38 1.14
- TER 15 MOL 1
- END
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