@<TRIPOS>MOLECULE
DB07395
37 38 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Cl1     0.9693    -0.8088     2.1365	Cl	1	noname	-0.0706
2	C1     0.5251     0.0128     0.7316	C.2	1	noname	0.0399
3	C2     1.2514    -0.1699    -0.4394	C.2	1	noname	0.0302
4	C3    -0.5671     0.8724     0.7451	C.2	1	noname	0.0507
5	C4     2.3437    -1.0295    -0.4529	C.2	1	noname	0.0630
6	C5     0.8854     0.5070    -1.5970	C.2	1	noname	0.0585
7	C6    -0.9331     1.5493    -0.4125	C.2	1	noname	0.0930
8	O1     2.6503    -1.6341    -1.5031	O.2	1	noname	-0.2865
9	N1     3.0680    -1.2100     0.6600	N.3	1	noname	0.0898
10	C7    -0.2069     1.3666    -1.5835	C.2	1	noname	0.0844
11	F1    -1.9555     2.3538    -0.3999	F	1	noname	-0.1481
12	C8     4.1209    -2.0386     0.6470	C.2	1	noname	0.0803
13	F2    -0.5495     2.0002    -2.6669	F	1	noname	-0.1504
14	O2     4.4275    -2.6432    -0.4032	O.2	1	noname	-0.2670
15	N2     4.8452    -2.2191     1.7598	N.3	1	noname	-0.1191
16	C9     5.8982    -3.0478     1.7469	C.2	1	noname	0.0391
17	C10     6.6495    -3.2350     2.9012	C.2	1	noname	0.0469
18	C11     6.2392    -3.7201     0.5791	C.2	1	noname	-0.0060
19	O3     6.3184    -2.5820     4.0354	O.3	1	noname	-0.2030
20	C12     7.7418    -4.0946     2.8878	C.2	1	noname	0.0394
21	C13     7.3314    -4.5797     0.5656	C.2	1	noname	-0.0030
22	C14     5.4064    -3.3699     4.7862	C.3	1	noname	0.5273
23	C15     8.0827    -4.7669     1.7200	C.2	1	noname	0.0073
24	F3     5.0701    -2.7068     5.9381	F	1	noname	-0.1435
25	F4     4.2770    -3.5952     4.0423	F	1	noname	-0.1435
26	F5     5.9914    -4.5686     5.1032	F	1	noname	-0.1435
27	C16     9.1750    -5.6265     1.7065	C.2	1	noname	0.0849
28	O4     9.4816    -6.2311     0.6563	O.2	1	noname	-0.2597
29	O5     9.9047    -5.8083     2.8276	O.3	1	noname	-0.2190
30	H1    -1.1367     1.0156     1.6633	H	1	noname	0.0670
31	H2     1.4549     0.3638    -2.5152	H	1	noname	0.0663
32	H3     2.8202    -0.7214     1.5085	H	1	noname	0.1418
33	H4     4.5975    -1.7306     2.6084	H	1	noname	0.1386
34	H5     5.6500    -3.5733    -0.3262	H	1	noname	0.0640
35	H6     8.3310    -4.2414     3.7930	H	1	noname	0.0659
36	H7     7.5988    -5.1069    -0.3502	H	1	noname	0.0631
37	H8    10.0112    -6.7483     2.9912	H	1	noname	0.2216
@<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	2
8	5	9	1
9	6	10	2
10	7	11	1
11	7	10	1
12	9	12	1
13	10	13	1
14	12	14	2
15	12	15	1
16	15	16	1
17	16	17	2
18	16	18	1
19	17	19	1
20	17	20	1
21	18	21	2
22	19	22	1
23	20	23	2
24	21	23	1
25	22	24	1
26	22	25	1
27	22	26	1
28	23	27	1
29	27	28	2
30	27	29	1
31	4	30	1
32	6	31	1
33	9	32	1
34	15	33	1
35	18	34	1
36	20	35	1
37	21	36	1
38	29	37	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1