@<TRIPOS>MOLECULE
57019232
24 25 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     0.0608    -0.0540     0.4796	O.3	1	noname	-0.0910
2	O2     2.2691    -0.8081     1.0240	O.2	1	noname	-0.2453
3	O3    -1.1110    -0.5192    -1.5528	O.2	1	noname	-0.2464
4	C1     1.8338     1.1850    -0.4078	C.3	1	noname	0.0589
5	C2     3.1669     0.9324    -1.1148	C.3	1	noname	-0.0151
6	C3     0.7057     1.1824    -1.4338	C.3	1	noname	0.0466
7	C4     1.4806    -0.0207     0.4576	C.2	1	noname	0.1753
8	C5     4.2469     0.9348    -0.1324	C.2	1	noname	-0.0546
9	C6    -0.2430     0.1018    -0.9021	C.2	1	noname	0.1738
10	C7     5.5587     0.7245    -0.5411	C.2	1	noname	-0.0570
11	C8     3.9634     1.1475     1.2117	C.2	1	noname	-0.0570
12	C9     6.5870     0.7268     0.3942	C.2	1	noname	-0.0605
13	C10     4.9916     1.1499     2.1470	C.2	1	noname	-0.0605
14	C11     6.3034     0.9395     1.7383	C.2	1	noname	-0.0616
15	H1     1.7925     2.0964     0.1887	H	1	noname	0.0418
16	H2     3.1345    -0.0347    -1.6167	H	1	noname	0.0324
17	H3     3.3427     1.7176    -1.8500	H	1	noname	0.0324
18	H4     0.2004     2.1481    -1.4206	H	1	noname	0.0381
19	H5     1.0046     0.9315    -2.4516	H	1	noname	0.0381
20	H6     5.7668     0.5684    -1.5274	H	1	noname	0.0625
21	H7     3.0008     1.3019     1.5116	H	1	noname	0.0625
22	H8     7.5496     0.5725     0.0943	H	1	noname	0.0622
23	H9     4.7836     1.3060     3.1333	H	1	noname	0.0622
24	H10     7.0580     0.9412     2.4246	H	1	noname	0.0622
@<TRIPOS>BOND
1	1	7	1
2	1	9	1
3	2	7	2
4	3	9	2
5	4	5	1
6	4	6	1
7	4	7	1
8	4	15	1
9	5	8	1
10	5	16	1
11	5	17	1
12	6	9	1
13	6	18	1
14	6	19	1
15	8	10	2
16	8	11	1
17	10	12	1
18	10	20	1
19	11	13	2
20	11	21	1
21	12	14	2
22	12	22	1
23	13	14	1
24	13	23	1
25	14	24	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1