@<TRIPOS>MOLECULE
DB04734
15 14 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -1.7706     0.9158     0.2469	O.2	1	noname	-0.2600
2	C1    -0.7642     0.3222    -0.1973	C.2	1	noname	0.1010
3	O2    -0.9009    -0.8744    -0.8073	O.3	1	noname	-0.2195
4	C2     0.4684     0.8817    -0.0662	C.2	1	noname	0.0998
5	C3     1.5432     0.1056     0.0396	C.2	1	noname	0.0983
6	C4     0.6088     2.3046    -0.0420	C.3	1	noname	-0.0335
7	C5     1.4097    -1.2477     0.0166	C.2	1	noname	0.0989
8	O3     2.4199    -1.9771     0.1160	O.2	1	noname	-0.2613
9	O4     0.1862    -1.8031    -0.1136	O.3	1	noname	-0.2205
10	H1    -0.9797    -1.5643    -0.1444	H	1	noname	0.2216
11	H2     2.5223     0.5732     0.1439	H	1	noname	0.0691
12	H3     0.6427     2.6489     0.9917	H	1	noname	0.0282
13	H4     1.5310     2.5874    -0.5496	H	1	noname	0.0282
14	H5    -0.2404     2.7622    -0.5496	H	1	noname	0.0282
15	H6    -0.1833    -1.9708     0.7564	H	1	noname	0.2216
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	2	4	1
4	4	5	2
5	4	6	1
6	5	7	1
7	7	8	2
8	7	9	1
9	3	10	1
10	5	11	1
11	6	12	1
12	6	13	1
13	6	14	1
14	9	15	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1