@<TRIPOS>MOLECULE
86278246
22 21 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	N1     0.3006     0.3191    -0.7513	N.3	1	noname	-0.3122
2	C1    -0.5574     1.4598    -0.4354	C.3	1	noname	0.0014
3	C2     0.9539    -0.1520     0.4688	C.3	1	noname	0.0014
4	C3    -1.2412     1.9528    -1.7122	C.3	1	noname	-0.0500
5	C4     1.8519    -1.3459     0.1381	C.3	1	noname	-0.0500
6	C5     1.8020     0.9753     1.0610	C.3	1	noname	-0.0500
7	C6    -1.6197     1.0333     0.5799	C.3	1	noname	-0.0500
8	H1     0.1972    -0.4559     1.1920	H	1	noname	0.0459
9	H2     0.0467     2.2630    -0.0134	H	1	noname	0.0459
10	H3     1.0101     0.6040    -1.4295	H	1	noname	0.1227
11	H4     2.2891     0.6241     1.9707	H	1	noname	0.0246
12	H5    -2.2594     1.8838     0.8154	H	1	noname	0.0246
13	H6    -2.2238     0.2301     0.1579	H	1	noname	0.0246
14	H7     1.1622     1.8259     1.2966	H	1	noname	0.0246
15	H8     2.5587     1.2792     0.3378	H	1	noname	0.0246
16	H9     2.3390    -1.6971     1.0477	H	1	noname	0.0246
17	H10     1.2478    -2.1490    -0.2839	H	1	noname	0.0246
18	H11     2.6086    -1.0420    -0.5852	H	1	noname	0.0246
19	H12    -1.8809     2.8033    -1.4766	H	1	noname	0.0246
20	H13    -1.8453     1.1497    -2.1342	H	1	noname	0.0246
21	H14    -0.4845     2.2567    -2.4355	H	1	noname	0.0246
22	H15    -1.1325     0.6821     1.4895	H	1	noname	0.0246
@<TRIPOS>BOND
1	1	2	1
2	1	3	1
3	1	10	1
4	2	4	1
5	2	7	1
6	2	9	1
7	3	5	1
8	3	6	1
9	3	8	1
10	4	19	1
11	4	20	1
12	4	21	1
13	5	16	1
14	5	17	1
15	5	18	1
16	6	11	1
17	6	14	1
18	6	15	1
19	7	12	1
20	7	13	1
21	7	22	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1