@<TRIPOS>MOLECULE
DB07315
38 40 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Cl1    -0.7446    -3.9392     0.1860	Cl	1	noname	-0.0834
2	C1     0.0473    -2.4499     0.1566	C.2	1	noname	-0.0051
3	C2    -0.7180    -1.2448     0.0104	C.2	1	noname	-0.0059
4	C3     1.4781    -2.4064     0.2782	C.2	1	noname	-0.0166
5	C4    -0.0021    -0.0164     0.0182	C.2	1	noname	-0.0144
6	C5     2.1819    -1.1545     0.2809	C.2	1	noname	-0.0303
7	C6     1.3992     0.0293     0.1671	C.2	1	noname	-0.0596
8	C7    -0.4504     1.2827    -0.1628	C.2	1	noname	0.0087
9	N1     1.7813     1.3126     0.1021	N.3	1	noname	-0.0173
10	C8     0.6928     2.0817    -0.1057	C.2	1	noname	-0.0544
11	C9     0.7073     3.4649    -0.2427	C.2	1	noname	0.0875
12	O1    -0.3610     4.0853    -0.4332	O.2	1	noname	-0.2712
13	N2     1.8665     4.1332    -0.1706	N.3	1	noname	-0.1359
14	C10     1.8805     5.4666    -0.3026	C.2	1	noname	-0.0209
15	C11     3.0829     6.1598    -0.2278	C.2	1	noname	-0.0319
16	C12     0.6925     6.1565    -0.5144	C.2	1	noname	-0.0319
17	C13     3.0974     7.5430    -0.3648	C.2	1	noname	-0.0406
18	C14     0.7070     7.5397    -0.6514	C.2	1	noname	-0.0406
19	C15     1.9094     8.2329    -0.5766	C.2	1	noname	-0.0412
20	C16     1.9247     9.6857    -0.7205	C.3	1	noname	0.1021
21	O2     1.7708    10.2894     0.5555	O.3	1	noname	-0.3859
22	C17     3.2559    10.1235    -1.3346	C.3	1	noname	0.0734
23	O3     3.2707    11.5365    -1.4746	O.3	1	noname	-0.3932
24	H1    -1.8021    -1.2619    -0.1022	H	1	noname	0.0645
25	H2     2.0382    -3.3370     0.3699	H	1	noname	0.0638
26	H3     3.2674    -1.1048     0.3660	H	1	noname	0.0643
27	H4    -1.4799     1.6060    -0.3168	H	1	noname	0.0651
28	H5     2.7307     1.6447     0.1943	H	1	noname	0.1529
29	H6     2.7297     3.6319    -0.0167	H	1	noname	0.1375
30	H7     4.0145     5.6188    -0.0617	H	1	noname	0.0639
31	H8    -0.2505     5.6129    -0.5731	H	1	noname	0.0639
32	H9     4.0403     8.0866    -0.3061	H	1	noname	0.0627
33	H10    -0.2246     8.0807    -0.8175	H	1	noname	0.0627
34	H11     1.0646     9.9902    -1.3169	H	1	noname	0.0676
35	H12     1.6901     9.6062     1.2251	H	1	noname	0.2110
36	H13     4.0482     9.8935    -0.6223	H	1	noname	0.0594
37	H14     3.3049     9.7302    -2.3500	H	1	noname	0.0594
38	H15     3.2750    11.9441    -0.6054	H	1	noname	0.2101
@<TRIPOS>BOND
1	1	2	1
2	2	3	2
3	2	4	1
4	3	5	1
5	4	6	2
6	5	7	2
7	5	8	1
8	6	7	1
9	7	9	1
10	8	10	2
11	9	10	1
12	10	11	1
13	11	12	2
14	11	13	1
15	13	14	1
16	14	15	2
17	14	16	1
18	15	17	1
19	16	18	2
20	17	19	2
21	18	19	1
22	19	20	1
23	20	21	1
24	20	22	1
25	22	23	1
26	3	24	1
27	4	25	1
28	6	26	1
29	8	27	1
30	9	28	1
31	13	29	1
32	15	30	1
33	16	31	1
34	17	32	1
35	18	33	1
36	20	34	1
37	21	35	1
38	22	36	1
39	22	37	1
40	23	38	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1