@<TRIPOS>MOLECULE
DB04029
24 24 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -3.7331    -2.3961    -0.1553	O.2	1	noname	-0.2924
2	C1    -2.6855    -2.1682     0.4873	C.2	1	noname	0.0412
3	N1    -2.2199    -3.0778     1.3542	N.3	1	noname	-0.0853
4	C2    -1.9691    -0.9109     0.2935	C.3	1	noname	0.0827
5	N2    -1.9018    -0.1877     1.5623	N.3	1	noname	-0.3200
6	C3    -0.5516    -1.2029    -0.2029	C.3	1	noname	-0.0041
7	C4     0.1648     0.0544    -0.3967	C.2	1	noname	-0.0541
8	C5     0.8949     0.6067     0.6492	C.2	1	noname	-0.0567
9	C6     0.1168     0.6991    -1.6272	C.2	1	noname	-0.0567
10	C7     1.5770     1.8037     0.4647	C.2	1	noname	-0.0604
11	C8     0.7989     1.8961    -1.8118	C.2	1	noname	-0.0604
12	C9     1.5289     2.4484    -0.7658	C.2	1	noname	-0.0616
13	H1    -2.8231    -3.8192     1.6808	H	1	noname	0.1271
14	H2    -1.2658    -3.0221     1.6808	H	1	noname	0.1271
15	H3    -2.5329    -0.3047    -0.4156	H	1	noname	0.0563
16	H4    -1.0052     0.0621     1.9543	H	1	noname	0.1191
17	H5    -2.7521     0.0621     2.0468	H	1	noname	0.1191
18	H6    -0.0253    -1.7280     0.5943	H	1	noname	0.0337
19	H7    -0.6354    -1.6555    -1.1909	H	1	noname	0.0337
20	H8     0.9325     0.1012     1.6142	H	1	noname	0.0625
21	H9    -0.4557     0.2660    -2.4475	H	1	noname	0.0625
22	H10     2.1495     2.2369     1.2849	H	1	noname	0.0622
23	H11     0.7612     2.4016    -2.7767	H	1	noname	0.0622
24	H12     2.0638     3.3871    -0.9106	H	1	noname	0.0622
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	2	4	1
4	4	5	1
5	4	6	1
6	6	7	1
7	7	8	2
8	7	9	1
9	8	10	1
10	9	11	2
11	10	12	2
12	11	12	1
13	3	13	1
14	3	14	1
15	4	15	1
16	5	16	1
17	5	17	1
18	6	18	1
19	6	19	1
20	8	20	1
21	9	21	1
22	10	22	1
23	11	23	1
24	12	24	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1