@<TRIPOS>MOLECULE
DB07408
24 25 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     3.3431    -0.9616     0.1536	O.2	1	noname	-0.1437
2	N1     2.1831    -1.0442     0.0842	N.2	1	noname	-0.0091
3	O2     1.6312    -2.1818     0.0467	O.3	1	noname	-0.1437
4	C1     1.4532     0.0369     0.0452	C.2	1	noname	0.0587
5	C2     0.0138    -0.0603    -0.0408	C.2	1	noname	0.0552
6	C3     2.0753     1.3311     0.0876	C.2	1	noname	0.0327
7	C4    -0.6686    -1.2826    -0.3355	C.2	1	noname	0.0821
8	C5    -0.8022     1.1196    -0.0122	C.2	1	noname	-0.0074
9	C6     1.2397     2.4934     0.0610	C.2	1	noname	-0.0264
10	O3    -2.0107    -1.4812    -0.2061	O.3	1	noname	-0.3178
11	C7    -0.1671    -2.4457    -0.9365	C.2	1	noname	0.0268
12	C8    -0.1859     2.4158     0.0213	C.2	1	noname	-0.0204
13	C9    -2.3607    -2.6904    -0.6941	C.2	1	noname	0.0894
14	C10    -1.2268    -3.3224    -1.1546	C.2	1	noname	0.0504
15	C11    -3.6494    -3.2105    -0.7263	C.2	1	noname	0.1230
16	O4    -4.6307    -2.4429    -0.8281	O.2	1	noname	-0.2452
17	O5    -3.8411    -4.5445    -0.6478	O.3	1	noname	-0.2088
18	H1     3.1597     1.4293     0.1388	H	1	noname	0.0647
19	H2    -1.8886     1.0313    -0.0160	H	1	noname	0.0630
20	H3     1.7081     3.4776     0.0714	H	1	noname	0.0623
21	H4     0.8751    -2.6370    -1.1921	H	1	noname	0.0651
22	H5    -0.7890     3.3238     0.0167	H	1	noname	0.0622
23	H6    -1.1779    -4.3155    -1.6013	H	1	noname	0.0653
24	H7    -3.8790    -4.8086     0.2744	H	1	noname	0.2217
@<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	5	8	1
8	6	9	2
9	7	10	1
10	7	11	2
11	8	12	2
12	9	12	1
13	10	13	1
14	11	14	1
15	13	15	1
16	13	14	2
17	15	16	2
18	15	17	1
19	6	18	1
20	8	19	1
21	9	20	1
22	11	21	1
23	12	22	1
24	14	23	1
25	17	24	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1