@<TRIPOS>MOLECULE
DB06900
23 23 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -0.2704    -1.4901     2.3309	O.3	1	noname	-0.3915
2	C1    -0.2005    -1.5162     0.9129	C.3	1	noname	0.0683
3	C2     0.2460    -0.2152     0.4236	C.2	1	noname	-0.0652
4	C3     1.6027     0.0352     0.2538	C.2	1	noname	-0.0506
5	C4    -0.6855     0.7731     0.1275	C.2	1	noname	-0.0506
6	C5     2.0279     1.2739    -0.2120	C.2	1	noname	-0.0538
7	C6    -0.2603     2.0118    -0.3383	C.2	1	noname	-0.0538
8	C7     1.0964     2.2622    -0.5081	C.2	1	noname	-0.0297
9	N1     1.5063     3.4563    -0.9572	N.3	1	noname	-0.0154
10	C8     1.5707     3.4322    -2.2654	C.2	1	noname	-0.1220
11	N2     1.9411     4.4713    -2.9047	N.2	1	noname	-0.2707
12	N3     1.2546     2.3405    -2.9168	N.3	1	noname	-0.1313
13	H1    -0.2870    -2.3892     2.6671	H	1	noname	0.2105
14	H2     0.5732    -2.2405     0.6581	H	1	noname	0.0614
15	H3    -1.2212    -1.6618     0.5590	H	1	noname	0.0614
16	H4     2.3332    -0.7398     0.4860	H	1	noname	0.0626
17	H5    -1.7493     0.5768     0.2606	H	1	noname	0.0626
18	H6     3.0918     1.4702    -0.3451	H	1	noname	0.0639
19	H7    -0.9907     2.7868    -0.5705	H	1	noname	0.0639
20	H8     1.7343     4.2604    -0.3901	H	1	noname	0.1367
21	H9     2.1993     5.1954    -2.2496	H	1	noname	0.1898
22	H10     0.2926     2.1629    -3.1679	H	1	noname	0.1267
23	H11     1.9729     1.6763    -3.1679	H	1	noname	0.1267
@<TRIPOS>BOND
1	1	2	1
2	2	3	1
3	3	4	2
4	3	5	1
5	4	6	1
6	5	7	2
7	6	8	2
8	7	8	1
9	8	9	1
10	9	10	1
11	10	11	2
12	10	12	1
13	1	13	1
14	2	14	1
15	2	15	1
16	4	16	1
17	5	17	1
18	6	18	1
19	7	19	1
20	9	20	1
21	11	21	1
22	12	22	1
23	12	23	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1