@<TRIPOS>MOLECULE
109374151
21 20 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -0.4830    -0.3416    -0.7364	O.3	1	noname	-0.3782
2	O2    -1.8765    -0.6592     1.5459	O.3	1	noname	-0.2094
3	O3     0.0341    -0.3283     2.6917	O.2	1	noname	-0.2437
4	O4     3.0121    -1.9965     0.6314	O.3	1	noname	-0.2180
5	O5    -1.9825     3.3583     0.2060	O.3	1	noname	-0.2180
6	O6     0.7756    -2.2519     0.5566	O.2	1	noname	-0.2548
7	O7    -2.3929     1.1453     0.2867	O.2	1	noname	-0.2548
8	C1     0.0721     0.2681     0.4197	C.3	1	noname	0.1682
9	C2    -0.1325     1.7825     0.3458	C.3	1	noname	0.0725
10	C3     1.5688    -0.0415     0.4907	C.3	1	noname	0.0725
11	C4    -0.5901    -0.2549     1.6111	C.2	1	noname	0.1521
12	C5    -1.5607     2.0779     0.2780	C.2	1	noname	0.1365
13	C6     1.7640    -1.4867     0.5612	C.2	1	noname	0.1365
14	H1     1.9949     0.4264     1.3781	H	1	noname	0.0408
15	H2     0.2936     2.2505     1.2332	H	1	noname	0.0408
16	H3     0.3619     2.1729    -0.5438	H	1	noname	0.0408
17	H4     2.0632     0.3489    -0.3988	H	1	noname	0.0408
18	H5    -0.0385     0.0095    -1.5362	H	1	noname	0.2116
19	H6    -2.1957    -1.3747     2.1346	H	1	noname	0.2214
20	H7     3.1700    -2.8429     1.0995	H	1	noname	0.2213
21	H8    -2.8495     3.6107     0.5867	H	1	noname	0.2213
@<TRIPOS>BOND
1	1	8	1
2	1	18	1
3	2	11	1
4	2	19	1
5	3	11	2
6	4	13	1
7	4	20	1
8	5	12	1
9	5	21	1
10	6	13	2
11	7	12	2
12	8	9	1
13	8	10	1
14	8	11	1
15	9	12	1
16	9	15	1
17	9	16	1
18	10	13	1
19	10	14	1
20	10	17	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1