@<TRIPOS>MOLECULE
DB04484
24 24 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -3.9346    -2.1759     0.1587	O.3	1	noname	-0.3946
2	C1    -2.5296    -2.3141     0.0061	C.3	1	noname	0.0587
3	C2    -1.8649    -0.9423     0.1377	C.3	1	noname	0.0315
4	N1    -2.1593    -0.3825     1.4558	N.3	1	noname	-0.3254
5	C3    -0.3510    -1.0913    -0.0267	C.3	1	noname	0.0159
6	C4     0.2832     0.2178     0.0988	C.2	1	noname	-0.0567
7	C5     0.6974     0.6727     1.3452	C.2	1	noname	-0.0631
8	C6     0.4729     1.0091    -1.0281	C.2	1	noname	-0.0631
9	C7     1.3013     1.9190     1.4647	C.2	1	noname	-0.0628
10	C8     1.0767     2.2554    -0.9086	C.2	1	noname	-0.0628
11	C9     1.4909     2.7103     0.3378	C.2	1	noname	-0.0679
12	H1    -4.1544    -2.1543     1.0929	H	1	noname	0.2100
13	H2    -2.2049    -2.9285     0.8459	H	1	noname	0.0579
14	H3    -2.3810    -2.6647    -1.0152	H	1	noname	0.0579
15	H4    -2.2657    -0.2481    -0.6009	H	1	noname	0.0489
16	H5    -1.4073    -0.1892     2.1017	H	1	noname	0.1187
17	H6    -3.1146    -0.1892     1.7204	H	1	noname	0.1187
18	H7     0.0145    -1.6832     0.8124	H	1	noname	0.0332
19	H8    -0.1616    -1.4194    -1.0487	H	1	noname	0.0332
20	H9     0.5487     0.0522     2.2289	H	1	noname	0.0625
21	H10     0.1481     0.6523    -2.0055	H	1	noname	0.0625
22	H11     1.6261     2.2758     2.4421	H	1	noname	0.0622
23	H12     1.2254     2.8759    -1.7923	H	1	noname	0.0622
24	H13     1.9645     3.6876     0.4315	H	1	noname	0.0622
@<TRIPOS>BOND
1	1	2	1
2	2	3	1
3	3	4	1
4	3	5	1
5	5	6	1
6	6	7	2
7	6	8	1
8	7	9	1
9	8	10	2
10	9	11	2
11	10	11	1
12	1	12	1
13	2	13	1
14	2	14	1
15	3	15	1
16	4	16	1
17	4	17	1
18	5	18	1
19	5	19	1
20	7	20	1
21	8	21	1
22	9	22	1
23	10	23	1
24	11	24	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1