@<TRIPOS>MOLECULE
76961626
34 36 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Cl1     4.4479     1.4649    -3.2749	Cl	1	noname	-0.0793
2	F1     6.0068     4.2488     3.6612	F	1	noname	-0.1655
3	O1     3.9887     0.9777    -1.1546	O.3	1	noname	-0.3758
4	N1    -0.4422     1.9853     0.2404	N.2	1	noname	-0.2139
5	N2     0.4807    -0.1308     0.7233	N.2	1	noname	-0.2139
6	C1     3.2521     2.0698    -0.6244	C.3	1	noname	0.1446
7	C2     3.9779     2.6440     0.5048	C.2	1	noname	-0.0398
8	C3     3.0769     3.0862    -1.6578	C.2	1	noname	-0.0041
9	C4     1.9440     1.6022    -0.1751	C.2	1	noname	0.0325
10	C5     4.2650     1.8611     1.6169	C.2	1	noname	-0.0291
11	C6     4.3818     3.9735     0.4678	C.2	1	noname	-0.0291
12	C7     3.6048     2.8843    -2.9277	C.2	1	noname	0.0029
13	C8     2.3823     4.2557    -1.3717	C.2	1	noname	-0.0352
14	C9     0.7882     2.4423    -0.1879	C.2	1	noname	0.0332
15	C10     1.7341     0.2764     0.3061	C.2	1	noname	0.0332
16	C11     4.9561     2.4077     2.6920	C.2	1	noname	-0.0041
17	C12     5.0729     4.5201     1.5429	C.2	1	noname	-0.0041
18	C13     3.4381     3.8519    -3.9116	C.2	1	noname	-0.0238
19	C14     2.2155     5.2233    -2.3556	C.2	1	noname	-0.0544
20	C15     5.3600     3.7372     2.6550	C.2	1	noname	0.0237
21	C16     2.7434     5.0214    -3.6255	C.2	1	noname	-0.0506
22	C17    -0.6221     0.6989     0.7018	C.2	1	noname	0.0585
23	H1     3.9686     0.8855     1.6441	H	1	noname	0.0627
24	H2     4.1712     4.5479    -0.3483	H	1	noname	0.0627
25	H3     1.9949     4.4038    -0.4399	H	1	noname	0.0627
26	H4     4.1063     0.2955    -0.4609	H	1	noname	0.2122
27	H5     0.8743     3.4024    -0.5214	H	1	noname	0.0844
28	H6     2.5160    -0.3776     0.3428	H	1	noname	0.0844
29	H7     5.1668     1.8332     3.5081	H	1	noname	0.0653
30	H8     5.3693     5.4957     1.5157	H	1	noname	0.0653
31	H9     3.8254     3.7038    -4.8434	H	1	noname	0.0638
32	H10     1.7057     6.0815    -2.1457	H	1	noname	0.0622
33	H11     2.6210     5.7315    -4.3475	H	1	noname	0.0623
34	H12    -1.5361     0.3724     1.0157	H	1	noname	0.1061
@<TRIPOS>BOND
1	1	12	1
2	2	20	1
3	6	3	1
4	3	26	1
5	4	14	2
6	4	22	1
7	5	15	1
8	5	22	2
9	6	7	1
10	6	8	1
11	6	9	1
12	7	10	2
13	7	11	1
14	8	12	1
15	8	13	2
16	9	14	1
17	9	15	2
18	10	16	1
19	10	23	1
20	11	17	2
21	11	24	1
22	12	18	2
23	13	19	1
24	13	25	1
25	14	27	1
26	15	28	1
27	16	20	2
28	16	29	1
29	17	20	1
30	17	30	1
31	18	21	1
32	18	31	1
33	19	21	2
34	19	32	1
35	21	33	1
36	22	34	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1