@<TRIPOS>MOLECULE
DB02974
19 20 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Cl1     2.2733     3.9619    -0.1549	Cl	1	noname	-0.0836
2	C1     1.4442     2.4994    -0.0157	C.2	1	noname	-0.0096
3	C2     2.2043     1.2818     0.0505	C.2	1	noname	-0.0204
4	C3     0.0154     2.5247     0.0313	C.2	1	noname	-0.0204
5	C4     1.4873     0.0430     0.0896	C.2	1	noname	-0.0305
6	C5    -0.6710     1.2697     0.0766	C.2	1	noname	-0.0305
7	C6     0.0370     0.0194     0.0369	C.2	1	noname	-0.0286
8	C7    -0.7499    -1.1521    -0.2386	C.2	1	noname	-0.0542
9	N1    -2.0884    -1.2587    -0.1014	N.3	1	noname	-0.0410
10	C8    -0.3527    -2.3181    -0.9039	C.2	1	noname	0.0184
11	C9    -2.5131    -2.3931    -0.6830	C.2	1	noname	-0.0531
12	N2    -1.4508    -3.0398    -1.1788	N.2	1	noname	-0.2410
13	H1     3.2940     1.2974     0.0706	H	1	noname	0.0638
14	H2    -0.5313     3.4677     0.0325	H	1	noname	0.0638
15	H3     2.0494    -0.8883     0.1598	H	1	noname	0.0630
16	H4    -1.7590     1.2661     0.1429	H	1	noname	0.0630
17	H5    -2.6832    -0.5897     0.3664	H	1	noname	0.1537
18	H6     0.6609    -2.6192    -1.1685	H	1	noname	0.0860
19	H7    -3.5473    -2.7322    -0.7428	H	1	noname	0.1013
@<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	6	7	1
8	7	8	1
9	8	9	1
10	8	10	2
11	9	11	1
12	10	12	1
13	11	12	2
14	3	13	1
15	4	14	1
16	5	15	1
17	6	16	1
18	9	17	1
19	10	18	1
20	11	19	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1