@<TRIPOS>MOLECULE
92209461
24 23 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     0.2600    -1.6780    -1.7991	O.3	1	noname	-0.3787
2	O2     2.2282     0.2717     1.3815	O.3	1	noname	-0.2170
3	O3     0.8026     0.0606    -4.0561	O.3	1	noname	-0.2095
4	O4     2.5037    -0.6752    -0.5484	O.2	1	noname	-0.2535
5	O5     1.5572     1.3570    -2.4461	O.2	1	noname	-0.2439
6	O6    -0.2824     3.5520     1.4988	O.3	1	noname	-0.2187
7	O7    -0.1273     1.5301     2.4082	O.2	1	noname	-0.2556
8	C1     0.2407     0.1570    -0.2088	C.3	1	noname	0.0922
9	C2    -0.0318    -0.2923    -1.7045	C.3	1	noname	0.1595
10	C3    -0.1531     1.6457     0.0236	C.3	1	noname	0.0489
11	C4    -1.5108    -0.3114    -2.1314	C.3	1	noname	-0.0255
12	C5     1.6867    -0.0824     0.1944	C.2	1	noname	0.1384
13	C6     0.7901     0.4159    -2.7491	C.2	1	noname	0.1518
14	C7    -0.1987     2.2123     1.3675	C.2	1	noname	0.1352
15	H1    -0.3740    -0.4408     0.4620	H	1	noname	0.0450
16	H2    -1.0892     1.8588    -0.4925	H	1	noname	0.0382
17	H3     0.5229     2.2707    -0.5601	H	1	noname	0.0382
18	H4    -1.9070     0.7039    -2.1145	H	1	noname	0.0265
19	H5    -2.0799    -0.9351    -1.4420	H	1	noname	0.0265
20	H6    -1.5927    -0.7166    -3.1400	H	1	noname	0.0265
21	H7    -0.3170    -2.1761    -1.1832	H	1	noname	0.2116
22	H8     1.9586     1.0848     1.8399	H	1	noname	0.2213
23	H9     0.9975     0.7307    -4.7442	H	1	noname	0.2214
24	H10    -0.7124     3.9410     2.2888	H	1	noname	0.2213
@<TRIPOS>BOND
1	9	1	1
2	1	21	1
3	2	12	1
4	2	22	1
5	3	13	1
6	3	23	1
7	4	12	2
8	5	13	2
9	6	14	1
10	6	24	1
11	7	14	2
12	8	9	1
13	8	10	1
14	8	12	1
15	8	15	1
16	9	11	1
17	9	13	1
18	10	14	1
19	10	16	1
20	10	17	1
21	11	18	1
22	11	19	1
23	11	20	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1