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 chloroethane trans state geom file
8
1 0 0 0 0 35.45
2 1 0 0 1.84 12.
3 2 100. -120 1.09 1.008
4 2 100. 120 1.09 1.008
5 2 100. 0 1.36 12.
6 5 115. -105 1.09 1.008
7 5 115. 105 1.09 1.008
8 5 100. 0 1.6 1.008
0

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