@<TRIPOS>MOLECULE
76965528
39 41 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Cl1    -3.4564     1.1385     2.4162	Cl	1	noname	-0.0782
2	Cl2    -7.4258     0.2821    -1.0355	Cl	1	noname	-0.0826
3	Cl3    -1.0749    -5.0776     1.9433	Cl	1	noname	-0.0786
4	Cl4    -3.7299    -0.9620     4.0448	Cl	1	noname	-0.0786
5	O1    -1.7681    -1.1835     1.8969	O.3	1	noname	-0.3669
6	N1     0.2491    -1.6393    -0.0058	N.3	1	noname	-0.0438
7	N2     2.3927    -1.3710     0.2173	N.2	1	noname	-0.2421
8	C1    -1.7978    -0.5531     0.6249	C.3	1	noname	0.1005
9	C2    -1.0898    -1.4406    -0.4008	C.3	1	noname	-0.0374
10	C3    -3.1841    -0.3473     0.2159	C.2	1	noname	-0.0052
11	C4    -2.4298    -2.4375     1.8192	C.3	1	noname	0.0756
12	C5    -4.0308     0.4312     0.9963	C.2	1	noname	0.0103
13	C6    -3.6574    -0.9301    -0.9540	C.2	1	noname	-0.0279
14	C7    -2.3993    -3.0857     3.1271	C.2	1	noname	0.0219
15	C8     0.6947    -2.6307     0.7715	C.2	1	noname	-0.0710
16	C9     1.2884    -0.8659    -0.3466	C.2	1	noname	-0.0483
17	C10    -5.3506     0.6271     0.6069	C.2	1	noname	0.0089
18	C11    -4.9773    -0.7342    -1.3434	C.2	1	noname	-0.0213
19	C12    -5.8239     0.0444    -0.5629	C.2	1	noname	-0.0019
20	C13     2.0651    -2.4627     0.9166	C.2	1	noname	0.0082
21	C14    -1.7851    -4.3239     3.2750	C.2	1	noname	0.0089
22	C15    -2.9845    -2.4647     4.2243	C.2	1	noname	0.0089
23	C16    -1.7561    -4.9410     4.5201	C.2	1	noname	-0.0224
24	C17    -2.9555    -3.0818     5.4695	C.2	1	noname	-0.0224
25	C18    -2.3413    -4.3200     5.6174	C.2	1	noname	-0.0407
26	H1    -1.2899     0.4095     0.6845	H	1	noname	0.0672
27	H2    -1.5977    -2.4032    -0.4604	H	1	noname	0.0503
28	H3    -1.1125    -0.9567    -1.3772	H	1	noname	0.0503
29	H4    -3.4648    -2.2839     1.5139	H	1	noname	0.0619
30	H5    -1.9254    -3.0698     1.0885	H	1	noname	0.0619
31	H6    -3.0361    -1.5014    -1.5267	H	1	noname	0.0627
32	H7     0.1311    -3.3747     1.1829	H	1	noname	0.0808
33	H8     1.2458    -0.0341    -0.9354	H	1	noname	0.1015
34	H9    -5.9719     1.1985     1.1797	H	1	noname	0.0653
35	H10    -5.3246    -1.1618    -2.2018	H	1	noname	0.0638
36	H11     2.6985    -3.0563     1.4522	H	1	noname	0.0853
37	H12    -1.3054    -5.8496     4.6287	H	1	noname	0.0638
38	H13    -3.3849    -2.6261     6.2747	H	1	noname	0.0638
39	H14    -2.3200    -4.7728     6.5311	H	1	noname	0.0623
@<TRIPOS>BOND
1	1	12	1
2	2	19	1
3	3	21	1
4	4	22	1
5	8	5	1
6	5	11	1
7	6	9	1
8	6	15	1
9	6	16	1
10	7	16	2
11	7	20	1
12	8	9	1
13	8	10	1
14	8	26	1
15	9	27	1
16	9	28	1
17	10	12	2
18	10	13	1
19	11	14	1
20	11	29	1
21	11	30	1
22	12	17	1
23	13	18	2
24	13	31	1
25	14	21	2
26	14	22	1
27	15	20	2
28	15	32	1
29	16	33	1
30	17	19	2
31	17	34	1
32	18	19	1
33	18	35	1
34	20	36	1
35	21	23	1
36	22	24	2
37	23	25	2
38	23	37	1
39	24	25	1
40	24	38	1
41	25	39	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1