@<TRIPOS>MOLECULE
DB07202
37 40 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Cl1     3.7918     1.6516     0.1102	Cl	1	noname	-0.0847
2	C1     2.2124     1.3335    -0.3901	C.2	1	noname	-0.0090
3	C2     1.4554     0.3133     0.2384	C.2	1	noname	-0.0032
4	C3     1.6294     2.0862    -1.4452	C.2	1	noname	-0.0163
5	C4     0.1029    -0.0091    -0.1390	C.2	1	noname	-0.0045
6	C5     0.3074     1.8227    -1.8981	C.2	1	noname	-0.0212
7	C6    -0.7374    -1.0485     0.4841	C.2	1	noname	0.0208
8	C7    -0.4313     0.7804    -1.2411	C.2	1	noname	-0.0017
9	C8    -2.0309    -1.2869    -0.1850	C.2	1	noname	0.0967
10	C9    -0.2468    -1.8378     1.6822	C.2	1	noname	-0.0390
11	N1    -1.6968     0.5840    -1.6729	N.3	1	noname	-0.1328
12	C10    -2.4915    -0.3988    -1.1879	C.2	1	noname	0.1152
13	C11    -2.9351    -2.4207    -0.0749	C.2	1	noname	0.1053
14	C12    -1.1023    -2.7015     2.4614	C.2	1	noname	-0.0421
15	C13     1.1486    -1.8941     2.1105	C.2	1	noname	-0.0421
16	O1    -3.6528    -0.5249    -1.6330	O.2	1	noname	-0.2721
17	O2    -4.3043    -2.4582    -0.1241	O.3	1	noname	-0.3183
18	C14    -2.5571    -3.7564    -0.0164	C.2	1	noname	0.0640
19	C15    -0.6224    -3.6323     3.4468	C.2	1	noname	-0.0562
20	C16     1.7063    -2.7845     3.0762	C.2	1	noname	-0.0562
21	N2    -4.7610    -3.6777     0.0102	N.2	1	noname	-0.1620
22	C17    -3.7161    -4.5139     0.0935	C.2	1	noname	0.0692
23	C18     0.7819    -3.6620     3.7085	C.2	1	noname	-0.0553
24	C19    -3.7845    -5.9618     0.2684	C.3	1	noname	0.0476
25	H1     1.9322    -0.2455     1.0437	H	1	noname	0.0645
26	H2     2.2076     2.8812    -1.9163	H	1	noname	0.0638
27	H3    -0.1234     2.3978    -2.7177	H	1	noname	0.0640
28	H4    -2.0636     1.1967    -2.3872	H	1	noname	0.1374
29	H5    -2.1782    -2.6474     2.2953	H	1	noname	0.0629
30	H6     1.8517    -1.1939     1.6595	H	1	noname	0.0629
31	H7    -1.5374    -4.1400    -0.0505	H	1	noname	0.0671
32	H8    -1.3032    -4.2961     3.9798	H	1	noname	0.0622
33	H9     2.7697    -2.7938     3.3153	H	1	noname	0.0622
34	H10     1.1662    -4.3885     4.4244	H	1	noname	0.0622
35	H11    -3.7957    -6.1991     1.3321	H	1	noname	0.0296
36	H12    -4.6934    -6.3416    -0.1982	H	1	noname	0.0296
37	H13    -2.9154    -6.4256    -0.1982	H	1	noname	0.0296
@<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	1
7	5	8	2
8	6	8	1
9	7	9	2
10	7	10	1
11	8	11	1
12	9	12	1
13	9	13	1
14	10	14	2
15	10	15	1
16	11	12	1
17	12	16	2
18	13	17	1
19	13	18	2
20	14	19	1
21	15	20	2
22	17	21	1
23	18	22	1
24	19	23	2
25	20	23	1
26	21	22	2
27	22	24	1
28	3	25	1
29	4	26	1
30	6	27	1
31	11	28	1
32	14	29	1
33	15	30	1
34	18	31	1
35	19	32	1
36	20	33	1
37	23	34	1
38	24	35	1
39	24	36	1
40	24	37	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1