@<TRIPOS>MOLECULE
DB03175
12 11 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     2.0033     1.3388     0.0000	O.3	1	noname	-0.3962
2	C1     1.5300     0.0000     0.0000	C.3	1	noname	0.0429
3	C2     0.0000     0.0000     0.0000	C.3	1	noname	-0.0327
4	C3    -0.5100    -1.4425     0.0000	C.3	1	noname	-0.0632
5	H1     2.1100     1.6405     0.9051	H	1	noname	0.2100
6	H2     1.8677    -0.4278    -0.9440	H	1	noname	0.0563
7	H3     1.8677    -0.4278     0.9440	H	1	noname	0.0563
8	H4    -0.3147     0.4450     0.9440	H	1	noname	0.0287
9	H5    -0.3147     0.4450    -0.9440	H	1	noname	0.0287
10	H6    -0.6311    -1.7851     1.0277	H	1	noname	0.0231
11	H7    -1.4702    -1.4884    -0.5138	H	1	noname	0.0231
12	H8     0.2080    -2.0817    -0.5138	H	1	noname	0.0231
@<TRIPOS>BOND
1	1	2	1
2	2	3	1
3	3	4	1
4	1	5	1
5	2	6	1
6	2	7	1
7	3	8	1
8	3	9	1
9	4	10	1
10	4	11	1
11	4	12	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1
