@<TRIPOS>MOLECULE
101315119
25 26 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	S1     1.6954     3.9402    -0.2615	S	1	noname	-0.0458
2	O1     2.6038     4.3839    -1.6158	O.3	1	noname	-0.1486
3	O2     1.8867     5.0263     0.8839	O.2	1	noname	-0.1687
4	O3     0.1584     3.8545    -0.6593	O.2	1	noname	-0.1687
5	C1     3.0885    -0.0809     1.2317	C.2	1	noname	-0.0153
6	C2     2.0726    -0.0045     0.2862	C.2	1	noname	-0.0180
7	C3     3.6751     1.0821     1.7171	C.2	1	noname	-0.0174
8	C4     2.2298     2.3978     0.3113	C.2	1	noname	0.0290
9	C5     1.6432     1.2348    -0.1740	C.2	1	noname	0.0258
10	C6     3.2458     2.3214     1.2568	C.2	1	noname	0.0208
11	C7     3.5179    -1.3202     1.6920	C.2	1	noname	-0.0418
12	C8     1.4860    -1.1675    -0.1991	C.2	1	noname	-0.0444
13	C9     4.7423     1.0019     2.7102	C.3	1	noname	0.0043
14	C10     2.9313    -2.4832     1.2067	C.2	1	noname	-0.0563
15	C11     1.9153    -2.4068     0.2611	C.2	1	noname	-0.0566
16	H1     0.8977     1.2909    -0.8679	H	1	noname	0.0646
17	H2     3.6762     3.1748     1.6130	H	1	noname	0.0642
18	H3     4.2634    -1.3762     2.3858	H	1	noname	0.0629
19	H4     0.7404    -1.1114    -0.8930	H	1	noname	0.0629
20	H5     4.4368     1.5274     3.6150	H	1	noname	0.0280
21	H6     4.9407    -0.0435     2.9467	H	1	noname	0.0280
22	H7     5.6460     1.4618     2.3105	H	1	noname	0.0280
23	H8     3.2464    -3.3926     1.5444	H	1	noname	0.0622
24	H9     1.4849    -3.2602    -0.0950	H	1	noname	0.0622
25	H10     3.4448     4.7945    -1.3249	H	1	noname	0.2388
@<TRIPOS>BOND
1	1	2	1
2	1	3	2
3	1	4	2
4	1	8	1
5	2	25	1
6	5	6	1
7	5	7	1
8	5	11	2
9	6	9	1
10	6	12	2
11	7	10	2
12	7	13	1
13	8	9	2
14	8	10	1
15	9	16	1
16	10	17	1
17	11	14	1
18	11	18	1
19	12	15	1
20	12	19	1
21	13	20	1
22	13	21	1
23	13	22	1
24	14	15	2
25	14	23	1
26	15	24	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1