@<TRIPOS>MOLECULE
DB03291
25 25 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     0.1918     0.6085     0.4818	O.3	1	noname	-0.3426
2	C1     1.0806    -0.1264    -0.4202	C.3	1	noname	0.1837
3	C2     0.1513     2.0720     0.4597	C.3	1	noname	0.1016
4	O2     1.5156    -1.3207     0.2131	O.3	1	noname	-0.3656
5	C3     2.3149     0.6550    -0.9579	C.3	1	noname	0.1321
6	C4     0.6411     2.7555    -0.8507	C.3	1	noname	0.0622
7	C5    -1.2662     2.5479     0.7841	C.3	1	noname	0.0712
8	O3     3.3190     0.7022     0.0451	O.3	1	noname	-0.3849
9	C6     1.9509     2.1073    -1.3984	C.3	1	noname	0.1026
10	N1     0.8683     4.1783    -0.6027	N.3	1	noname	-0.3232
11	O4    -1.6380     2.0835     2.0734	O.3	1	noname	-0.3935
12	O5     1.9626     2.1889    -2.8160	O.3	1	noname	-0.3884
13	H1     0.4296    -0.3951    -1.2521	H	1	noname	0.0949
14	H2     0.8702     2.3185     1.2411	H	1	noname	0.0646
15	H3     1.4754    -1.2105     1.1660	H	1	noname	0.2134
16	H4     2.7641     0.1122    -1.7896	H	1	noname	0.0682
17	H5    -0.1416     2.6875    -1.6063	H	1	noname	0.0518
18	H6    -1.2482     3.6350     0.8606	H	1	noname	0.0591
19	H7    -1.9525     2.0616     0.0908	H	1	noname	0.0591
20	H8     2.9066     0.6828     0.9118	H	1	noname	0.2108
21	H9     2.7612     2.7340    -1.0258	H	1	noname	0.0647
22	H10     1.8105     4.5319    -0.5171	H	1	noname	0.1188
23	H11     0.0830     4.8077    -0.5171	H	1	noname	0.1188
24	H12    -1.6398     1.1235     2.0796	H	1	noname	0.2101
25	H13     1.9656     1.3037    -3.1875	H	1	noname	0.2106
@<TRIPOS>BOND
1	1	2	1
2	1	3	1
3	2	4	1
4	2	5	1
5	3	6	1
6	3	7	1
7	5	8	1
8	5	9	1
9	6	10	1
10	6	9	1
11	7	11	1
12	9	12	1
13	2	13	1
14	3	14	1
15	4	15	1
16	5	16	1
17	6	17	1
18	7	18	1
19	7	19	1
20	8	20	1
21	9	21	1
22	10	22	1
23	10	23	1
24	11	24	1
25	12	25	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1