@<TRIPOS>MOLECULE
DB03028
18 19 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     3.3383     2.9218    -0.0335	O.2	1	noname	-0.2414
2	C1     3.0708     1.7008    -0.0324	C.2	1	noname	0.1168
3	O2     4.0683     0.7913    -0.0501	O.3	1	noname	-0.2058
4	C2     1.7464     1.2794    -0.0130	C.2	1	noname	0.0158
5	N1     1.3542    -0.0128    -0.0102	N.2	1	noname	-0.1861
6	N2     0.6790     2.1083     0.0055	N.3	1	noname	0.0155
7	C3     0.0068    -0.0124     0.0061	C.2	1	noname	0.0206
8	C4    -0.4173     1.3305     0.0613	C.2	1	noname	-0.0337
9	C5    -0.9129    -1.1042     0.0182	C.2	1	noname	-0.0095
10	C6    -1.7971     1.6858     0.1920	C.2	1	noname	-0.0307
11	C7    -2.2943    -0.7634     0.1079	C.2	1	noname	-0.0439
12	C8    -2.7262     0.6046     0.2133	C.2	1	noname	-0.0473
13	H1     4.3135     0.5677     0.8508	H	1	noname	0.2217
14	H2     0.6972     3.1178    -0.0179	H	1	noname	0.1545
15	H3    -0.5792    -2.1404    -0.0380	H	1	noname	0.0645
16	H4    -2.1226     2.7231     0.2710	H	1	noname	0.0643
17	H5    -3.0340    -1.5639     0.0957	H	1	noname	0.0623
18	H6    -3.7884     0.8285     0.3121	H	1	noname	0.0623
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	2	4	1
4	4	5	2
5	4	6	1
6	5	7	1
7	6	8	1
8	7	9	1
9	7	8	2
10	8	10	1
11	9	11	2
12	10	12	2
13	11	12	1
14	3	13	1
15	6	14	1
16	9	15	1
17	10	16	1
18	11	17	1
19	12	18	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1