@<TRIPOS>MOLECULE
90473259
23 24 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Cl1     3.8187     1.2059    -0.0028	Cl	1	noname	-0.0873
2	O1    -2.0198     1.5165     0.1164	O.3	1	noname	-0.2829
3	C1    -0.0440    -0.0175     0.0097	C.2	1	noname	-0.0034
4	C2    -0.7596    -1.3056     0.0020	C.2	1	noname	-0.0385
5	C3     1.3884     0.0360     0.0024	C.2	1	noname	-0.0076
6	C4    -0.6965     1.2679     0.0339	C.2	1	noname	0.0120
7	C5    -2.1909    -1.4031    -0.0362	C.2	1	noname	-0.0428
8	C6    -0.0801    -2.5730     0.0133	C.2	1	noname	-0.0428
9	C7     2.1197     1.2399    -0.0064	C.2	1	noname	-0.0228
10	C8     0.0297     2.4711     0.0020	C.2	1	noname	-0.0188
11	C9    -2.8849    -2.6294     0.0073	C.2	1	noname	-0.0562
12	C10    -0.7647    -3.8036     0.0181	C.2	1	noname	-0.0562
13	C11     1.4332     2.4626    -0.0062	C.2	1	noname	-0.0202
14	C12    -2.1650    -3.8379     0.0219	C.2	1	noname	-0.0564
15	H1     1.9634    -0.8052    -0.0023	H	1	noname	0.0645
16	H2    -2.8110    -0.5990    -0.1080	H	1	noname	0.0629
17	H3     0.9337    -2.6516     0.0155	H	1	noname	0.0629
18	H4    -0.4672     3.3763    -0.0003	H	1	noname	0.0650
19	H5    -3.9112    -2.6387     0.0168	H	1	noname	0.0622
20	H6    -0.2205    -4.6803     0.0139	H	1	noname	0.0622
21	H7     1.9372     3.3545    -0.0090	H	1	noname	0.0639
22	H8    -2.6629    -4.7286     0.0262	H	1	noname	0.0622
23	H9    -2.3439     0.9646     0.8538	H	1	noname	0.2182
@<TRIPOS>BOND
1	1	9	1
2	2	6	1
3	2	23	1
4	3	4	1
5	3	5	1
6	3	6	2
7	4	7	2
8	4	8	1
9	5	9	2
10	5	15	1
11	6	10	1
12	7	11	1
13	7	16	1
14	8	12	2
15	8	17	1
16	9	13	1
17	10	13	2
18	10	18	1
19	11	14	2
20	11	19	1
21	12	14	1
22	12	20	1
23	13	21	1
24	14	22	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1