@<TRIPOS>MOLECULE
71587299
15 14 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     1.4731     1.1996     0.1741	O.3	1	noname	-0.3933
2	C1     1.5740    -0.1839    -0.1295	C.3	1	noname	0.0510
3	C2     0.1939    -0.7249    -0.5084	C.3	1	noname	-0.0301
4	C3     2.5379    -0.3800    -1.3013	C.3	1	noname	-0.0390
5	C4    -0.7701    -0.5288     0.6635	C.3	1	noname	-0.0629
6	H1     1.9479    -0.7208     0.7423	H	1	noname	0.0597
7	H2    -0.1800    -0.1879    -1.3802	H	1	noname	0.0290
8	H3     0.2713    -1.7869    -0.7414	H	1	noname	0.0290
9	H4     2.6154    -1.4419    -1.5343	H	1	noname	0.0256
10	H5     2.1640     0.1570    -2.1731	H	1	noname	0.0256
11	H6     3.5212     0.0054    -1.0314	H	1	noname	0.0256
12	H7    -1.7533    -0.9142     0.3935	H	1	noname	0.0231
13	H8    -0.8475     0.5332     0.8965	H	1	noname	0.0231
14	H9    -0.3962    -1.0657     1.5353	H	1	noname	0.0231
15	H10     2.3571     1.5461     0.4168	H	1	noname	0.2104
@<TRIPOS>BOND
1	2	1	1
2	1	15	1
3	2	3	1
4	2	4	1
5	2	6	1
6	3	5	1
7	3	7	1
8	3	8	1
9	4	9	1
10	4	10	1
11	4	11	1
12	5	12	1
13	5	13	1
14	5	14	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1