@<TRIPOS>MOLECULE
71586879
24 24 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     2.3094    -2.0529    -0.0982	O.3	1	noname	0.0000
2	O2     3.5650    -0.1953    -0.3111	O.2	1	noname	0.0000
3	N1     0.4169    -0.0161     0.7834	N.3	1	noname	0.0000
4	C1     1.2379     0.1103    -0.4106	C.3	1	noname	0.0000
5	C2    -0.4785     1.1395     0.6626	C.3	1	noname	0.0000
6	C3     1.6402     1.5817    -0.4209	C.3	1	noname	0.0000
7	C4     0.3843     2.2753     0.1186	C.3	1	noname	0.0000
8	C5    -0.3655    -1.2488     0.7086	C.3	1	noname	0.0000
9	C6     1.2486     0.1190     1.9782	C.3	1	noname	0.0000
10	C7     2.4310    -0.7195    -0.2709	C.2	1	noname	0.0000
11	H1     0.6345    -0.1081    -1.2918	H	1	noname	0.0000
12	H2    -1.2712     0.9119    -0.0501	H	1	noname	0.0000
13	H3    -0.9583     1.3958     1.6072	H	1	noname	0.0000
14	H4     1.8198     1.9022    -1.4471	H	1	noname	0.0000
15	H5     2.4737     1.7420     0.2630	H	1	noname	0.0000
16	H6    -0.1387     2.7685    -0.7007	H	1	noname	0.0000
17	H7     0.6763     2.9917     0.8864	H	1	noname	0.0000
18	H8    -0.9808    -1.3435     1.6034	H	1	noname	0.0000
19	H9     0.6254     0.0230     2.8673	H	1	noname	0.0000
20	H10     1.7311     1.0963     1.9764	H	1	noname	0.0000
21	H11     2.0092    -0.6618     1.9816	H	1	noname	0.0000
22	H12    -1.0072    -1.2191    -0.1720	H	1	noname	0.0000
23	H13     0.3080    -2.1030     0.6388	H	1	noname	0.0000
24	H14     2.9864    -2.5447     0.4120	H	1	noname	0.0000
@<TRIPOS>BOND
1	1	10	1
2	1	24	1
3	2	10	2
4	3	4	1
5	3	5	1
6	3	8	1
7	3	9	1
8	4	6	1
9	4	10	1
10	4	11	1
11	5	7	1
12	5	12	1
13	5	13	1
14	6	7	1
15	6	14	1
16	6	15	1
17	7	16	1
18	7	17	1
19	8	18	1
20	8	22	1
21	8	23	1
22	9	19	1
23	9	20	1
24	9	21	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1
