@<TRIPOS>MOLECULE
71463918
17 16 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     2.6363     1.5657    -1.5574	O.3	1	noname	-0.3946
2	O2    -2.2153     0.4282     0.7570	O.3	1	noname	-0.2185
3	O3    -0.5250     1.8757     0.4103	O.2	1	noname	-0.2554
4	N1     2.3468    -0.9360    -0.2503	N.3	1	noname	-0.3252
5	C1     1.4074     0.1628    -0.0318	C.3	1	noname	0.0368
6	C2     0.0174    -0.4053     0.2617	C.3	1	noname	0.0508
7	C3     1.3463     1.0384    -1.2850	C.3	1	noname	0.0589
8	C4    -0.9206     0.6920     0.4800	C.2	1	noname	0.1356
9	H1     1.7408     0.7629     0.8148	H	1	noname	0.0491
10	H2    -0.3160    -1.0054    -0.5849	H	1	noname	0.0389
11	H3     0.0610    -1.0291     1.1545	H	1	noname	0.0389
12	H4     0.6459     1.8576    -1.1221	H	1	noname	0.0579
13	H5     1.0128     0.4383    -2.1316	H	1	noname	0.0579
14	H6     3.2752    -0.5565    -0.4464	H	1	noname	0.1187
15	H7     2.0341    -1.4986    -1.0441	H	1	noname	0.1187
16	H8     2.5971     2.1265    -2.3601	H	1	noname	0.2100
17	H9    -2.9135     1.0588     0.4826	H	1	noname	0.2213
@<TRIPOS>BOND
1	1	7	1
2	1	16	1
3	2	8	1
4	2	17	1
5	3	8	2
6	5	4	1
7	4	14	1
8	4	15	1
9	5	6	1
10	5	7	1
11	5	9	1
12	6	8	1
13	6	10	1
14	6	11	1
15	7	12	1
16	7	13	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1