@<TRIPOS>MOLECULE
60022665
37 37 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Cl1    -3.0293     1.0716    -2.7209	Cl	1	noname	-0.0706
2	Cl2    -4.7962    -4.1074    -5.5364	Cl	1	noname	-0.0824
3	O1    -3.6977    -1.6764     1.7290	O.3	1	noname	-0.3892
4	O2    -2.5746    -1.6446    -1.7410	O.3	1	noname	-0.2640
5	N1    -1.2330    -3.0566     1.9942	N.3	1	noname	-0.3093
6	C1    -0.4537    -4.2923     2.0511	C.3	1	noname	0.0099
7	C2    -1.9470    -2.9890     0.7202	C.3	1	noname	0.0241
8	C3    -2.7625    -1.6959     0.6606	C.3	1	noname	0.0904
9	C4     0.2935    -4.3630     3.3844	C.3	1	noname	-0.0474
10	C5     0.5539    -4.3133     0.9000	C.3	1	noname	-0.0474
11	C6    -1.3931    -5.4937     1.9286	C.3	1	noname	-0.0474
12	C7    -3.5098    -1.6251    -0.6727	C.3	1	noname	0.0807
13	C8    -3.2339    -1.5822    -2.9174	C.2	1	noname	0.0401
14	C9    -3.5136    -0.3481    -3.4927	C.2	1	noname	0.0172
15	C10    -3.6330    -2.7520    -3.5534	C.2	1	noname	0.0113
16	C11    -4.3118    -2.6877    -4.7646	C.2	1	noname	-0.0022
17	C12    -4.1925    -0.2839    -4.7040	C.2	1	noname	-0.0102
18	C13    -4.5916    -1.4537    -5.3399	C.2	1	noname	-0.0299
19	H1    -0.6055    -2.2541     2.0760	H	1	noname	0.1228
20	H2    -2.6162    -3.8450     0.6329	H	1	noname	0.0455
21	H3    -1.2291    -3.0040    -0.0999	H	1	noname	0.0455
22	H4    -2.0933    -0.8399     0.7479	H	1	noname	0.0638
23	H5     0.8745    -5.2843     3.4268	H	1	noname	0.0249
24	H6    -0.8121    -6.4150     1.9710	H	1	noname	0.0249
25	H7    -2.1110    -5.4788     2.7487	H	1	noname	0.0249
26	H8    -1.9254    -5.4434     0.9788	H	1	noname	0.0249
27	H9     1.1349    -5.2346     0.9424	H	1	noname	0.0249
28	H10     0.0216    -4.2629    -0.0498	H	1	noname	0.0249
29	H11     1.2232    -3.4573     0.9873	H	1	noname	0.0249
30	H12    -0.4244    -4.3481     4.2044	H	1	noname	0.0249
31	H13     0.9627    -3.5071     3.4717	H	1	noname	0.0249
32	H14    -4.1790    -2.4811    -0.7599	H	1	noname	0.0599
33	H15    -4.0908    -0.7038    -0.7151	H	1	noname	0.0599
34	H16    -4.2201    -0.8481     1.6908	H	1	noname	0.2106
35	H17    -3.4277    -3.6575    -3.1312	H	1	noname	0.0666
36	H18    -4.3978     0.6217    -5.1261	H	1	noname	0.0639
37	H19    -5.0897    -1.4065    -6.2287	H	1	noname	0.0638
@<TRIPOS>BOND
1	1	14	1
2	2	16	1
3	8	3	1
4	3	34	1
5	4	12	1
6	4	13	1
7	5	6	1
8	5	7	1
9	5	19	1
10	6	9	1
11	6	10	1
12	6	11	1
13	7	8	1
14	7	20	1
15	7	21	1
16	8	12	1
17	8	22	1
18	9	23	1
19	9	30	1
20	9	31	1
21	10	27	1
22	10	28	1
23	10	29	1
24	11	24	1
25	11	25	1
26	11	26	1
27	12	32	1
28	12	33	1
29	13	14	2
30	13	15	1
31	14	17	1
32	15	16	2
33	15	35	1
34	16	18	1
35	17	18	2
36	17	36	1
37	18	37	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1