@<TRIPOS>MOLECULE
DB04103
17 17 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -0.6603    -1.1437     0.0000	O.2	1	noname	-0.2053
2	C1    -0.0353    -0.0611    -0.0000	C.2	1	noname	0.1674
3	N1     1.3424    -0.0311    -0.0000	N.2	1	noname	0.1981
4	N2    -0.6981     1.1470    -0.0000	N.3	1	noname	0.0679
5	C2     2.0538     1.1515     0.0000	C.2	1	noname	0.0422
6	C3     2.0498    -1.2508    -0.0000	C.3	1	noname	0.0228
7	C4    -0.0297     2.3544     0.0000	C.2	1	noname	-0.0398
8	N3     3.3932     1.1101    -0.0000	N.3	1	noname	-0.0924
9	C5     1.3954     2.4170     0.0000	C.2	1	noname	0.0263
10	H1    -1.7081     1.1477    -0.0000	H	1	noname	0.1427
11	H2     2.2321    -1.5651     1.0277	H	1	noname	0.0880
12	H3     1.4622    -2.0116    -0.5138	H	1	noname	0.0880
13	H4     3.0019    -1.1187    -0.5138	H	1	noname	0.0880
14	H5    -0.6307     3.2637    -0.0000	H	1	noname	0.0758
15	H6     3.8709     0.2202    -0.0000	H	1	noname	0.1297
16	H7     3.9250     1.9687    -0.0000	H	1	noname	0.1297
17	H8     1.9404     3.3609     0.0000	H	1	noname	0.0710
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	2	4	1
4	3	5	2
5	3	6	1
6	4	7	1
7	5	8	1
8	5	9	1
9	7	9	2
10	4	10	1
11	6	11	1
12	6	12	1
13	6	13	1
14	7	14	1
15	8	15	1
16	8	16	1
17	9	17	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1