@<TRIPOS>MOLECULE
DB03439
24 24 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     0.3677     0.2843     0.4552	O.3	1	noname	-0.3452
2	C1     1.2623    -0.2490    -0.5738	C.3	1	noname	0.1835
3	C2     0.1840     1.7289     0.6078	C.3	1	noname	0.0758
4	O2     1.8517    -1.4547    -0.1100	O.3	1	noname	-0.3656
5	C3     2.3769     0.7116    -1.0818	C.3	1	noname	0.1321
6	C4     0.5180     2.6017    -0.6376	C.3	1	noname	0.0596
7	C5    -1.2486     2.0157     1.0622	C.3	1	noname	-0.0369
8	O3     3.4354     0.7506    -0.1361	O.3	1	noname	-0.3849
9	C6     1.8456     2.1583    -1.3279	C.3	1	noname	0.1025
10	N1     0.6219     4.0037    -0.2365	N.3	1	noname	-0.3232
11	O4     1.7561     2.3985    -2.7246	O.3	1	noname	-0.3884
12	H1     0.5871    -0.4892    -1.3951	H	1	noname	0.0949
13	H2     0.9254     1.9600     1.3727	H	1	noname	0.0618
14	H3     1.8547    -1.4609     0.8500	H	1	noname	0.2134
15	H4     2.8210     0.3147    -1.9947	H	1	noname	0.0682
16	H5    -0.3024     2.5375    -1.3524	H	1	noname	0.0517
17	H6    -1.2895     2.0239     2.1514	H	1	noname	0.0257
18	H7    -1.5637     2.9864     0.6794	H	1	noname	0.0257
19	H8    -1.9131     1.2411     0.6794	H	1	noname	0.0257
20	H9     3.0716     0.7372     0.7522	H	1	noname	0.2108
21	H10     2.6141     2.8202    -0.9286	H	1	noname	0.0647
22	H11     1.5301     4.4234    -0.0980	H	1	noname	0.1188
23	H12    -0.2145     4.5527    -0.0980	H	1	noname	0.1188
24	H13     1.7261     1.5606    -3.1921	H	1	noname	0.2106
@<TRIPOS>BOND
1	1	2	1
2	1	3	1
3	2	4	1
4	2	5	1
5	3	6	1
6	3	7	1
7	5	8	1
8	5	9	1
9	6	10	1
10	6	9	1
11	9	11	1
12	2	12	1
13	3	13	1
14	4	14	1
15	5	15	1
16	6	16	1
17	7	17	1
18	7	18	1
19	7	19	1
20	8	20	1
21	9	21	1
22	10	22	1
23	10	23	1
24	11	24	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1
