@<TRIPOS>MOLECULE
85875443
35 37 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Cl1    -5.1607     2.1897     1.8764	Cl	1	noname	-0.0751
2	Cl2    -9.6748    -0.3081     2.5448	Cl	1	noname	-0.0805
3	O1    -1.8248    -1.5227     1.1056	O.3	1	noname	-0.1946
4	O2     1.4908     1.6562     3.8799	O.3	1	noname	-0.3930
5	O3    -3.0827     0.8079     3.3793	O.3	1	noname	-0.2793
6	O4    -3.6018    -2.7395     0.4179	O.2	1	noname	-0.2523
7	C1    -1.5628    -0.4242     1.9986	C.3	1	noname	0.1250
8	C2    -0.9958     0.7910     1.1678	C.3	1	noname	-0.0145
9	C3    -0.7188    -0.8987     3.2286	C.3	1	noname	-0.0145
10	C4     0.7720    -0.5608     3.0847	C.3	1	noname	-0.0238
11	C5    -0.0645     1.7078     1.9957	C.3	1	noname	-0.0238
12	C6     1.0748     0.9290     2.7187	C.3	1	noname	0.0544
13	C7    -2.8814    -0.1202     2.4601	C.2	1	noname	0.0302
14	C8    -3.8218    -0.8363     1.8560	C.2	1	noname	0.0843
15	C9    -3.1485    -1.7577     1.0654	C.2	1	noname	0.1189
16	C10    -5.2002    -0.6603     1.9799	C.2	1	noname	0.0016
17	C11    -5.8295     0.6323     2.1098	C.2	1	noname	0.0250
18	C12    -6.0141    -1.8302     1.9954	C.2	1	noname	-0.0117
19	C13    -7.2116     0.6873     2.3767	C.2	1	noname	0.0125
20	C14    -7.4010    -1.7328     2.1525	C.2	1	noname	-0.0175
21	C15    -7.9970    -0.4797     2.3635	C.2	1	noname	0.0106
22	H1    -1.7910     1.4196     0.7374	H	1	noname	0.0301
23	H2    -0.4472     0.4151     0.3044	H	1	noname	0.0301
24	H3    -1.0655    -0.4336     4.1579	H	1	noname	0.0301
25	H4    -0.8502    -1.9795     3.3439	H	1	noname	0.0301
26	H5    -0.6631     2.2859     2.7109	H	1	noname	0.0294
27	H6     0.3845     2.4296     1.3052	H	1	noname	0.0294
28	H7     1.1819    -1.2226     2.3196	H	1	noname	0.0294
29	H8     1.2533    -0.8161     4.0292	H	1	noname	0.0294
30	H9     1.9312     0.9121     2.0390	H	1	noname	0.0600
31	H10     0.7461     1.5743     4.5108	H	1	noname	0.2104
32	H11    -3.2203     1.6318     2.8592	H	1	noname	0.2179
33	H12    -5.6384    -2.7913     1.8824	H	1	noname	0.0630
34	H13    -7.6725     1.5826     2.5422	H	1	noname	0.0654
35	H14    -7.9775    -2.5849     2.1073	H	1	noname	0.0638
@<TRIPOS>BOND
1	1	17	1
2	2	21	1
3	3	7	1
4	3	15	1
5	4	12	1
6	4	31	1
7	5	13	1
8	5	32	1
9	6	15	2
10	7	8	1
11	7	9	1
12	7	13	1
13	8	11	1
14	8	22	1
15	8	23	1
16	9	10	1
17	9	24	1
18	9	25	1
19	10	12	1
20	10	28	1
21	10	29	1
22	11	12	1
23	11	26	1
24	11	27	1
25	12	30	1
26	13	14	2
27	14	15	1
28	14	16	1
29	16	17	2
30	16	18	1
31	17	19	1
32	18	20	2
33	18	33	1
34	19	21	2
35	19	34	1
36	20	21	1
37	20	35	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1