@<TRIPOS>MOLECULE
DB04063
25 24 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     1.7256    -2.3086     0.0561	O.2	1	noname	-0.2485
2	C1     2.0035    -1.2592     0.6757	C.2	1	noname	0.1452
3	O2     2.7431    -1.3169     1.8036	O.3	1	noname	-0.2132
4	C2     1.5281     0.0291     0.1797	C.3	1	noname	0.0998
5	N1     2.0591     0.2604    -1.1628	N.3	1	noname	-0.3171
6	C3    -0.0010     0.0234     0.1293	C.3	1	noname	-0.0234
7	C4     2.0035     1.1427     1.1150	C.3	1	noname	-0.0374
8	C5    -0.4992     1.3734    -0.3905	C.3	1	noname	-0.0448
9	C6    -2.0284     1.3678    -0.4409	C.3	1	noname	-0.0627
10	C7     0.0564     1.6155    -1.7954	C.3	1	noname	-0.0627
11	H1     2.8972    -2.2349     2.0385	H	1	noname	0.2213
12	H2     1.4291     0.3403    -1.9481	H	1	noname	0.1194
13	H3     3.0558     0.3403    -1.3047	H	1	noname	0.1194
14	H4    -0.2888    -0.7240    -0.6100	H	1	noname	0.0293
15	H5    -0.3494    -0.0655     1.1583	H	1	noname	0.0293
16	H6     1.8697     0.8293     2.1504	H	1	noname	0.0254
17	H7     3.0582     1.3466     0.9305	H	1	noname	0.0254
18	H8     1.4212     2.0454     0.9305	H	1	noname	0.0254
19	H9    -0.1605     2.1668     0.2758	H	1	noname	0.0298
20	H10    -2.4253     1.3663     0.5743	H	1	noname	0.0233
21	H11    -2.3779     2.2565    -0.9664	H	1	noname	0.0233
22	H12    -2.3713     0.4766    -0.9664	H	1	noname	0.0233
23	H13     0.2482     0.6583    -2.2802	H	1	noname	0.0233
24	H14    -0.6691     2.1803    -2.3807	H	1	noname	0.0233
25	H15     0.9861     2.1803    -1.7261	H	1	noname	0.0233
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	2	4	1
4	4	5	1
5	4	6	1
6	4	7	1
7	6	8	1
8	8	9	1
9	8	10	1
10	3	11	1
11	5	12	1
12	5	13	1
13	6	14	1
14	6	15	1
15	7	16	1
16	7	17	1
17	7	18	1
18	8	19	1
19	9	20	1
20	9	21	1
21	9	22	1
22	10	23	1
23	10	24	1
24	10	25	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1