@<TRIPOS>MOLECULE
DB03092
24 24 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -0.6149     1.2077     2.8387	O.3	1	noname	-0.3857
2	C1    -0.6252     1.3813     1.4294	C.3	1	noname	0.1059
3	C2    -0.4375     0.0869     0.7778	C.2	1	noname	-0.0274
4	C3     0.4916     2.3921     1.0216	C.3	1	noname	0.1126
5	C4     0.2778    -0.0972    -0.3530	C.2	1	noname	-0.0372
6	C5    -1.0505    -1.0584     1.3757	C.3	1	noname	0.0669
7	O2     0.1177     3.7001     1.4286	O.3	1	noname	-0.3871
8	C6     0.7694     2.3841    -0.5253	C.3	1	noname	0.1123
9	C7     0.9952     0.9453    -1.0916	C.3	1	noname	0.1012
10	O3    -2.3555    -1.2293     0.8425	O.3	1	noname	-0.3918
11	O4     1.9063     3.1871    -0.8063	O.3	1	noname	-0.3871
12	O5     2.3844     0.6512    -1.0964	O.3	1	noname	-0.3861
13	H1    -0.6134     0.2702     3.0456	H	1	noname	0.2110
14	H2    -1.6236     1.7285     1.1636	H	1	noname	0.0677
15	H3     1.4059     2.1741     1.5736	H	1	noname	0.0659
16	H4     0.2761    -1.1354    -0.6851	H	1	noname	0.0605
17	H5    -0.4699    -1.9270     1.0650	H	1	noname	0.0612
18	H6    -1.1727    -0.8353     2.4355	H	1	noname	0.0612
19	H7     0.1047     3.7454     2.3875	H	1	noname	0.2107
20	H8    -0.0544     2.8607    -1.0567	H	1	noname	0.0659
21	H9     0.6424     0.8645    -2.1197	H	1	noname	0.0674
22	H10    -2.9865    -1.3119     1.5612	H	1	noname	0.2104
23	H11     2.3087     3.4714     0.0176	H	1	noname	0.2107
24	H12     2.7005     0.5843    -0.1924	H	1	noname	0.2110
@<TRIPOS>BOND
1	2	1	1
2	2	3	1
3	2	4	1
4	3	5	2
5	3	6	1
6	4	7	1
7	4	8	1
8	5	9	1
9	6	10	1
10	8	11	1
11	8	9	1
12	9	12	1
13	1	13	1
14	2	14	1
15	4	15	1
16	5	16	1
17	6	17	1
18	6	18	1
19	7	19	1
20	8	20	1
21	9	21	1
22	10	22	1
23	11	23	1
24	12	24	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1