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@<TRIPOS>MOLECULE
****
8 7 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1 C2 -11.0414 -5.72842 11.6912 C.3 0 **** -0.235
2 C4 -11.0249 -7.01459 11.6175 C.2 0 **** -0.065
3 C5 -11.0152 -8.33847 11.6127 C.2 0 **** -0.065
4 C6 -11.0134 -9.64631 11.6385 C.3 0 **** -0.235
5 H7 -11.0726 -5.23617 12.6607 H 0 **** 0.15
6 H8 -11.0101 -5.11062 10.7976 H 0 **** 0.15
7 H9 -11 -10.1707 12.586 H 0 **** 0.15
8 H10 -11.0122 -10.2053 10.7144 H 0 **** 0.15
@<TRIPOS>BOND
1 1 2 1
2 1 5 1
3 1 6 1
4 2 3 2
5 3 4 3
6 4 7 1
7 4 8 1
@<TRIPOS>SUBSTRUCTURE
1 **** 1
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