@<TRIPOS>MOLECULE
118796438
26 26 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Cl1     2.1811    -1.8241    -0.5067	Cl	1	noname	-0.0671
2	Cl2    -0.0268     3.7643     0.8321	Cl	1	noname	-0.0710
3	Cl3     3.0835     3.4023     0.0290	Cl	1	noname	-0.0733
4	O1    -0.6983    -1.0685     0.1158	O.3	1	noname	-0.1454
5	O2    -2.6107    -2.1720    -0.0707	O.2	1	noname	-0.2570
6	C1     0.2559    -0.1056     0.3006	C.2	1	noname	0.0472
7	C2     1.6084    -0.3003    -0.0897	C.2	1	noname	0.0374
8	C3    -0.1114     1.1436     0.8030	C.2	1	noname	0.0312
9	C4     0.6996     2.2645     0.6141	C.2	1	noname	0.0308
10	C5     2.4946     0.7895    -0.1336	C.2	1	noname	0.0236
11	C6     2.0223     2.0813     0.1600	C.2	1	noname	0.0232
12	C7    -2.0554    -1.0595    -0.1494	C.2	1	noname	0.1106
13	C8    -2.8977    -0.0375    -0.5749	C.2	1	noname	0.0592
14	C9    -2.6757     1.2674    -0.7649	C.2	1	noname	-0.0236
15	C10    -3.6615     2.0555    -1.1846	C.2	1	noname	-0.0643
16	C11    -3.4406     3.3533    -1.3736	C.2	1	noname	-0.0791
17	C12    -4.5005     4.2007    -1.8248	C.3	1	noname	-0.0467
18	H1    -1.0139     1.2232     1.2739	H	1	noname	0.0667
19	H2     3.4703     0.6630    -0.4159	H	1	noname	0.0655
20	H3    -3.8239    -0.3270    -0.7714	H	1	noname	0.0686
21	H4    -1.7776     1.6468    -0.5933	H	1	noname	0.0624
22	H5    -4.5596     1.6760    -1.3562	H	1	noname	0.0619
23	H6    -2.5425     3.7328    -1.2020	H	1	noname	0.0572
24	H7    -4.6812     4.9812    -1.0858	H	1	noname	0.0273
25	H8    -5.4066     3.6096    -1.9579	H	1	noname	0.0273
26	H9    -4.2216     4.6570    -2.7745	H	1	noname	0.0273
@<TRIPOS>BOND
1	1	7	1
2	2	9	1
3	3	11	1
4	4	6	1
5	4	12	1
6	5	12	2
7	6	7	1
8	6	8	2
9	7	10	2
10	8	9	1
11	8	18	1
12	9	11	2
13	10	11	1
14	10	19	1
15	12	13	1
16	13	14	2
17	13	20	1
18	14	15	1
19	14	21	1
20	15	16	2
21	15	22	1
22	16	17	1
23	16	23	1
24	17	24	1
25	17	25	1
26	17	26	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1