@<TRIPOS>MOLECULE
121231123
35 37 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -0.2458     2.4526     1.7903	O.3	1	noname	-0.2631
2	O2     1.7819    -0.3215    -0.3907	O.3	1	noname	-0.3880
3	O3    -0.2444    -2.0104    -0.1841	O.3	1	noname	-0.2798
4	O4    -2.8982    -1.0547     3.7090	O.3	1	noname	-0.2826
5	O5     1.2832     7.0867     3.4687	O.3	1	noname	-0.2759
6	O6     2.0052     8.2454     1.0930	O.3	1	noname	-0.2762
7	C1     1.1226     2.6580     1.3654	C.3	1	noname	0.0921
8	C2     1.4446     2.0378    -0.0217	C.3	1	noname	0.0087
9	C3     0.7738     0.6692    -0.2717	C.3	1	noname	0.0870
10	C4    -0.2268     0.2245     0.7566	C.2	1	noname	0.0011
11	C5    -0.7094     1.1443     1.7481	C.2	1	noname	0.0297
12	C6     1.3616     4.1707     1.2917	C.2	1	noname	-0.0458
13	C7    -0.6689    -1.1444     0.7605	C.2	1	noname	0.0282
14	C8    -1.6465     0.7424     2.7441	C.2	1	noname	-0.0117
15	C9     1.2119     4.9543     2.4300	C.2	1	noname	-0.0121
16	C10     1.7279     4.7585     0.0865	C.2	1	noname	-0.0522
17	C11    -1.5609    -1.5621     1.7798	C.2	1	noname	-0.0128
18	C12    -2.0441    -0.6266     2.7552	C.2	1	noname	0.0171
19	C13     1.4286     6.3257     2.3631	C.2	1	noname	0.0254
20	C14     1.9445     6.1299     0.0197	C.2	1	noname	-0.0210
21	C15     1.7948     6.9135     1.1580	C.2	1	noname	0.0226
22	H1     1.8058     2.2364     2.1099	H	1	noname	0.0661
23	H2     1.1528     2.7344    -0.8077	H	1	noname	0.0327
24	H3     2.5242     1.9422    -0.1375	H	1	noname	0.0327
25	H4     0.2758     0.7244    -1.2338	H	1	noname	0.0654
26	H5    -2.0179     1.4079     3.4220	H	1	noname	0.0677
27	H6     0.9432     4.5229     3.3143	H	1	noname	0.0654
28	H7     1.8377     4.1835    -0.7488	H	1	noname	0.0627
29	H8     2.3058    -0.3556     0.4368	H	1	noname	0.2109
30	H9    -1.8619    -2.5358     1.8205	H	1	noname	0.0677
31	H10     2.2133     6.5613    -0.8647	H	1	noname	0.0651
32	H11    -0.6454    -2.8903    -0.0245	H	1	noname	0.2182
33	H12    -3.1354    -0.3059     4.2950	H	1	noname	0.2181
34	H13     1.0244     6.5190     4.2243	H	1	noname	0.2183
35	H14     2.2541     8.4926     0.1779	H	1	noname	0.2183
@<TRIPOS>BOND
1	1	7	1
2	1	11	1
3	9	2	1
4	2	29	1
5	3	13	1
6	3	32	1
7	4	18	1
8	4	33	1
9	5	19	1
10	5	34	1
11	6	21	1
12	6	35	1
13	7	8	1
14	7	12	1
15	7	22	1
16	8	9	1
17	8	23	1
18	8	24	1
19	9	10	1
20	9	25	1
21	10	11	1
22	10	13	2
23	11	14	2
24	12	15	2
25	12	16	1
26	13	17	1
27	14	18	1
28	14	26	1
29	15	19	1
30	15	27	1
31	16	20	2
32	16	28	1
33	17	18	2
34	17	30	1
35	19	21	2
36	20	21	1
37	20	31	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1