@<TRIPOS>MOLECULE
DB00964
25 26 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Cl1     0.2064    -1.1052    -2.0983	Cl	1	noname	-0.0775
2	C1     0.1357    -0.0083    -0.8186	C.2	1	noname	-0.0064
3	C2     0.9534    -0.1929     0.3491	C.2	1	noname	-0.0003
4	C3    -0.7348     1.1168    -0.8759	C.2	1	noname	-0.0343
5	N1     1.9023    -1.1272     0.3194	N.3	1	noname	-0.0026
6	C4     0.9037     0.6989     1.4754	C.2	1	noname	-0.0064
7	C5    -0.7650     2.0132     0.2444	C.2	1	noname	-0.0389
8	C6     3.0991    -0.8412    -0.1694	C.2	1	noname	-0.1099
9	Cl2     1.8587     0.4161     2.8371	Cl	1	noname	-0.0775
10	C7     0.0343     1.8249     1.4214	C.2	1	noname	-0.0343
11	N2    -1.5783     3.0767     0.1889	N.3	1	noname	-0.1571
12	N3     4.0440    -1.6961    -0.2222	N.2	1	noname	-0.2565
13	N4     3.4544     0.3310    -0.6496	N.3	1	noname	-0.1180
14	C8     5.1676    -1.1076    -0.7798	C.3	1	noname	0.0548
15	C9     4.7764     0.3485    -1.0976	C.3	1	noname	0.0221
16	H1    -1.3602     1.2870    -1.7523	H	1	noname	0.0655
17	H2     1.7136    -2.0558     0.6688	H	1	noname	0.1368
18	H3    -0.0179     2.5229     2.2570	H	1	noname	0.0655
19	H4    -1.1900     4.0088     0.1679	H	1	noname	0.1242
20	H5    -2.5796     2.9461     0.1679	H	1	noname	0.1242
21	H6     2.8061     1.1052    -0.6713	H	1	noname	0.1307
22	H7     5.9238    -1.1111     0.0053	H	1	noname	0.0528
23	H8     5.3485    -1.6407    -1.7131	H	1	noname	0.0528
24	H9     4.7553     0.5055    -2.1761	H	1	noname	0.0452
25	H10     5.3305     1.0352    -0.4577	H	1	noname	0.0452
@<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	1
8	6	9	1
9	6	10	2
10	7	11	1
11	7	10	1
12	8	12	2
13	8	13	1
14	12	14	1
15	13	15	1
16	14	15	1
17	4	16	1
18	5	17	1
19	10	18	1
20	11	19	1
21	11	20	1
22	13	21	1
23	14	22	1
24	14	23	1
25	15	24	1
26	15	25	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1