@<TRIPOS>MOLECULE
DB01427
23 24 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     2.0981     3.4804     0.0000	O.2	1	noname	-0.2881
2	C1     1.4280     2.4252     0.0000	C.2	1	noname	0.0355
3	N1     2.1004     1.2221     0.0000	N.3	1	noname	0.0115
4	C2     0.0068     2.5254     0.0000	C.2	1	noname	-0.0401
5	C3     1.4463     0.0177    -0.0000	C.2	1	noname	-0.0755
6	N2    -0.6462     3.6956     0.0000	N.3	1	noname	-0.1422
7	C4    -0.6512     1.2691    -0.0000	C.2	1	noname	-0.0065
8	C5    -0.0017    -0.0282     0.0000	C.2	1	noname	-0.0253
9	C6    -0.7487    -1.2887     0.0000	C.2	1	noname	-0.0199
10	C7    -2.1940    -1.2731     0.0000	C.2	1	noname	-0.0117
11	C8    -0.0368    -2.5459     0.0000	C.2	1	noname	-0.0117
12	C9    -2.9114    -2.4996    -0.0000	C.2	1	noname	0.0016
13	C10    -0.7593    -3.7672    -0.0000	C.2	1	noname	0.0016
14	N3    -2.1299    -3.6339    -0.0000	N.2	1	noname	-0.2523
15	H1     3.1104     1.2231     0.0000	H	1	noname	0.1369
16	H2     2.0625    -0.8814    -0.0000	H	1	noname	0.0760
17	H3    -0.1284     4.5628     0.0000	H	1	noname	0.1244
18	H4    -1.6561     3.7104     0.0000	H	1	noname	0.1244
19	H5    -1.7406     1.3032    -0.0000	H	1	noname	0.0647
20	H6    -2.7451    -0.3327     0.0000	H	1	noname	0.0645
21	H7     1.0529    -2.5732     0.0000	H	1	noname	0.0645
22	H8    -3.9994    -2.5665    -0.0000	H	1	noname	0.0839
23	H9    -0.2888    -4.7505    -0.0000	H	1	noname	0.0839
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	2	4	1
4	3	5	1
5	4	6	1
6	4	7	2
7	5	8	2
8	7	8	1
9	8	9	1
10	9	10	2
11	9	11	1
12	10	12	1
13	11	13	2
14	12	14	2
15	13	14	1
16	3	15	1
17	5	16	1
18	6	17	1
19	6	18	1
20	7	19	1
21	10	20	1
22	11	21	1
23	12	22	1
24	13	23	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1