@<TRIPOS>MOLECULE
DB04655
27 28 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Cl1     3.8990     1.3175     0.0000	Cl	1	noname	-0.0723
2	C1     2.2120     1.3038     0.0000	C.2	1	noname	0.0238
3	C2     1.4541     2.5186    -0.0000	C.2	1	noname	0.0214
4	C3     1.4761     0.0806    -0.0000	C.2	1	noname	-0.0016
5	Cl2     2.2976     3.9796    -0.0000	Cl	1	noname	-0.0724
6	C4     0.0231     2.5676     0.0000	C.2	1	noname	-0.0136
7	C5     0.0271     0.0470    -0.0000	C.2	1	noname	-0.0258
8	C6    -0.6683     1.3186    -0.0000	C.2	1	noname	-0.0319
9	C7    -0.7036    -1.2187    -0.0000	C.2	1	noname	-0.0369
10	C8    -2.1328    -1.3160     0.0000	C.2	1	noname	0.0400
11	C9    -0.0733    -2.5050     0.0000	C.2	1	noname	0.0158
12	N1    -2.8094    -2.5031     0.0000	N.2	1	noname	-0.2656
13	N2    -2.8450    -0.1809    -0.0000	N.3	1	noname	-0.1126
14	N3    -0.7630    -3.6845     0.0000	N.2	1	noname	-0.2846
15	C10     1.3857    -2.5587    -0.0000	C.3	1	noname	0.0384
16	C11    -2.1285    -3.6866     0.0000	C.2	1	noname	0.0724
17	N4    -2.7985    -4.8471     0.0000	N.3	1	noname	-0.0806
18	H1     2.0364    -0.8544     0.0000	H	1	noname	0.0645
19	H2    -0.5165     3.5146     0.0000	H	1	noname	0.0638
20	H3    -1.7581     1.3364     0.0000	H	1	noname	0.0629
21	H4    -2.3724     0.7118    -0.0000	H	1	noname	0.1258
22	H5    -3.8543    -0.2180    -0.0000	H	1	noname	0.1258
23	H6     1.7488    -2.5720     1.0277	H	1	noname	0.0296
24	H7     1.7161    -3.4614    -0.5138	H	1	noname	0.0296
25	H8     1.7815    -1.6826    -0.5138	H	1	noname	0.0296
26	H9    -3.8085    -4.8471     0.0000	H	1	noname	0.1273
27	H10    -2.2935    -5.7218     0.0000	H	1	noname	0.1273
@<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	6	8	2
8	7	9	1
9	7	8	1
10	9	10	2
11	9	11	1
12	10	12	1
13	10	13	1
14	11	14	2
15	11	15	1
16	12	16	2
17	14	16	1
18	16	17	1
19	4	18	1
20	6	19	1
21	8	20	1
22	13	21	1
23	13	22	1
24	15	23	1
25	15	24	1
26	15	25	1
27	17	26	1
28	17	27	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1