@<TRIPOS>MOLECULE
86278190
16 16 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     1.9685    -1.7055    -0.5245	O.3	1	noname	-0.2764
2	O2    -1.7534    -0.7734     0.6705	O.3	1	noname	-0.2173
3	O3    -0.5440    -2.0972    -0.6923	O.2	1	noname	-0.2571
4	C1     0.3154    -0.0300    -0.2230	C.2	1	noname	0.0197
5	C2     1.6380    -0.3995    -0.4384	C.2	1	noname	0.0467
6	C3    -0.0250     1.3147    -0.1344	C.2	1	noname	0.0003
7	C4     2.6202     0.5759    -0.5651	C.2	1	noname	-0.0163
8	C5     0.9573     2.2901    -0.2612	C.2	1	noname	-0.0565
9	C6     2.2799     1.9206    -0.4765	C.2	1	noname	-0.0288
10	C7    -0.6668    -1.0053    -0.0963	C.2	1	noname	0.0933
11	H1    -0.9955     1.5859     0.0236	H	1	noname	0.0632
12	H2     3.5907     0.3048    -0.7232	H	1	noname	0.0650
13	H3     0.7075     3.2769    -0.1961	H	1	noname	0.0622
14	H4     3.0006     2.6363    -0.5695	H	1	noname	0.0623
15	H5     2.9331    -1.7890    -0.6766	H	1	noname	0.2182
16	H6    -2.6090    -1.1969     0.4490	H	1	noname	0.2216
@<TRIPOS>BOND
1	1	5	1
2	1	15	1
3	2	10	1
4	2	16	1
5	3	10	2
6	4	5	1
7	4	6	2
8	4	10	1
9	5	7	2
10	6	8	1
11	6	11	1
12	7	9	1
13	7	12	1
14	8	9	2
15	8	13	1
16	9	14	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1