@<TRIPOS>MOLECULE
DB07063
37 40 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	S1     3.7486    -0.0055     1.3081	S.3	1	noname	-0.1707
2	C1     2.1048    -0.4444     1.7226	C.2	1	noname	0.0840
3	C2     3.2599     1.2531     0.1827	C.2	1	noname	0.0661
4	C3     1.6019    -1.3933     2.6498	C.2	1	noname	0.0828
5	C4     1.2741     0.3967     0.9221	C.2	1	noname	0.0919
6	N1     1.9144     1.2793     0.1140	N.2	1	noname	-0.2132
7	C5     4.1278     2.0823    -0.6247	C.3	1	noname	0.0870
8	F1     2.3838    -2.1403     3.3731	F	1	noname	-0.1543
9	C6     0.1804    -1.4720     2.7345	C.2	1	noname	0.0801
10	C7    -0.1423     0.2983     1.0112	C.2	1	noname	0.1193
11	C8     4.5727     3.3676    -0.0525	C.2	1	noname	-0.0291
12	C9    -0.6766    -0.6504     1.9336	C.2	1	noname	0.1104
13	F2    -0.9194     1.0435     0.2809	F	1	noname	-0.1390
14	C10     5.8552     3.6646     0.3824	C.2	1	noname	-0.0297
15	C11     3.8828     4.5841    -0.1557	C.2	1	noname	-0.1033
16	F3    -1.9669    -0.7712     2.0492	F	1	noname	-0.1461
17	C12     5.9069     5.0736     0.5230	C.2	1	noname	-0.0834
18	C13     7.0075     2.8380     0.5385	C.2	1	noname	-0.0394
19	N2     4.7062     5.5943     0.2144	N.3	1	noname	-0.0646
20	C14     7.1309     5.7491     0.8017	C.2	1	noname	-0.0425
21	C15     8.2272     3.5095     0.8250	C.2	1	noname	-0.0539
22	C16     4.3623     6.9606     0.2671	C.3	1	noname	0.1021
23	C17     8.2922     4.9282     0.9214	C.2	1	noname	-0.0509
24	C18     3.8418     7.2807     1.5931	C.2	1	noname	0.1441
25	O1     4.4142     8.1391     2.2988	O.2	1	noname	-0.2493
26	O2     2.7423     6.6495     2.0571	O.3	1	noname	-0.2138
27	H1     5.0349     1.4909    -0.7488	H	1	noname	0.0391
28	H2     3.5253     2.3452    -1.4941	H	1	noname	0.0391
29	H3    -0.2644    -2.1815     3.4323	H	1	noname	0.0685
30	H4     2.8512     4.7248    -0.4782	H	1	noname	0.0794
31	H5     6.9586     1.7532     0.4442	H	1	noname	0.0629
32	H6     7.1764     6.8320     0.9167	H	1	noname	0.0642
33	H7     9.1337     2.9229     0.9743	H	1	noname	0.0622
34	H8     5.2934     7.5132     0.1409	H	1	noname	0.0581
35	H9     3.5474     7.0962    -0.4439	H	1	noname	0.0581
36	H10     9.2599     5.4000     1.0920	H	1	noname	0.0623
37	H11     2.7515     6.6548     3.0170	H	1	noname	0.2213
@<TRIPOS>BOND
1	1	2	1
2	1	3	1
3	2	4	2
4	2	5	1
5	3	6	2
6	3	7	1
7	4	8	1
8	4	9	1
9	5	10	2
10	5	6	1
11	7	11	1
12	9	12	2
13	10	13	1
14	10	12	1
15	11	14	1
16	11	15	2
17	12	16	1
18	14	17	2
19	14	18	1
20	15	19	1
21	17	20	1
22	17	19	1
23	18	21	2
24	19	22	1
25	20	23	2
26	21	23	1
27	22	24	1
28	24	25	2
29	24	26	1
30	7	27	1
31	7	28	1
32	9	29	1
33	15	30	1
34	18	31	1
35	20	32	1
36	21	33	1
37	22	34	1
38	22	35	1
39	23	36	1
40	26	37	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1