@<TRIPOS>MOLECULE
15244
37 40 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Cl1     1.6167     2.6430     2.7760	Cl	1	noname	-0.0758
2	C1     0.1343     3.0917     2.1073	C.2	1	noname	0.0200
3	C2    -0.1350     2.8225     0.7704	C.2	1	noname	0.0285
4	C3    -0.8177     3.7307     2.8930	C.2	1	noname	-0.0198
5	C4     0.8170     2.1835    -0.0153	C.2	1	noname	0.0788
6	C5    -1.3564     3.1922     0.2194	C.2	1	noname	0.0200
7	C6    -2.0391     4.1004     2.3420	C.2	1	noname	-0.0320
8	C7     1.7500     1.2614     0.5133	C.2	1	noname	0.1363
9	C8     0.9307     2.4033    -1.4089	C.2	1	noname	0.0063
10	Cl2    -1.6833     2.8654    -1.4030	Cl	1	noname	-0.0758
11	C9    -2.3084     3.8311     1.0052	C.2	1	noname	-0.0198
12	O1     1.7296     1.0004     1.7356	O.2	1	noname	-0.2556
13	N1     2.6787     0.6470    -0.2924	N.2	1	noname	-0.1520
14	N2     1.8937     1.7547    -2.1929	N.3	1	noname	0.0858
15	C10     0.0369     3.3135    -2.0326	C.2	1	noname	-0.0060
16	C11     2.7841     0.8639    -1.6415	C.2	1	noname	0.0350
17	N3     1.9669     1.9881    -3.4936	N.2	1	noname	-0.2373
18	C12     0.1326     3.5500    -3.4311	C.2	1	noname	0.0127
19	C13     1.1328     2.8566    -4.1600	C.2	1	noname	0.0385
20	S1     1.3020     3.0997    -5.8645	S.3	1	noname	-0.0554
21	C14     1.9086     1.6539    -6.5957	C.2	1	noname	0.0220
22	C15     2.1279     1.6082    -7.9676	C.2	1	noname	0.0639
23	C16     2.1767     0.5381    -5.8115	C.2	1	noname	-0.0024
24	F1     1.8770     2.6526    -8.7016	F	1	noname	-0.1570
25	C17     2.6153     0.4466    -8.5551	C.2	1	noname	0.0496
26	C18     2.6641    -0.6235    -6.3990	C.2	1	noname	-0.0043
27	C19     2.8834    -0.6693    -7.7708	C.2	1	noname	0.0427
28	F2     3.3396    -1.7565    -8.3208	F	1	noname	-0.1631
29	H1    -0.6065     3.9418     3.9413	H	1	noname	0.0638
30	H2    -2.7857     4.6015     2.9582	H	1	noname	0.0623
31	H3    -3.2662     4.1211     0.5731	H	1	noname	0.0638
32	H4    -0.7195     3.8285    -1.4404	H	1	noname	0.0641
33	H5     3.5363     0.3549    -2.2441	H	1	noname	0.0998
34	H6    -0.5428     4.2442    -3.9311	H	1	noname	0.0652
35	H7     2.0047     0.5740    -4.7357	H	1	noname	0.0636
36	H8     2.7873     0.4107    -9.6309	H	1	noname	0.0684
37	H9     2.8743    -1.4985    -5.7840	H	1	noname	0.0653
@<TRIPOS>BOND
1	1	2	1
2	2	3	2
3	2	4	1
4	3	5	1
5	3	6	1
6	4	7	2
7	5	8	1
8	5	9	2
9	6	10	1
10	6	11	2
11	7	11	1
12	8	12	2
13	8	13	1
14	9	14	1
15	9	15	1
16	13	16	2
17	14	17	1
18	14	16	1
19	15	18	2
20	17	19	2
21	18	19	1
22	19	20	1
23	20	21	1
24	21	22	2
25	21	23	1
26	22	24	1
27	22	25	1
28	23	26	2
29	25	27	2
30	26	27	1
31	27	28	1
32	4	29	1
33	7	30	1
34	11	31	1
35	15	32	1
36	16	33	1
37	18	34	1
38	23	35	1
39	25	36	1
40	26	37	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1