@<TRIPOS>MOLECULE
67337441
37 39 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Cl1     2.0569    -5.8142     4.6564	Cl	1	noname	-0.0845
2	O1    -2.0225    -2.0837     0.9901	O.3	1	noname	-0.3398
3	N1    -2.0359    -1.0044     0.1343	N.3	1	noname	-0.1315
4	N2     1.6467    -0.4754     2.7285	N.2	1	noname	-0.2513
5	C1    -0.6435    -0.9009    -0.4003	C.3	1	noname	0.0724
6	C2    -0.5392    -2.4232    -0.7660	C.3	1	noname	0.0044
7	C3    -1.2990    -3.1637     0.3698	C.3	1	noname	0.1066
8	C4     0.2987    -0.3022     0.6725	C.2	1	noname	-0.0102
9	C5    -0.5207    -0.1453    -1.7626	C.3	1	noname	-0.0400
10	C6    -0.4988    -3.9722     1.3593	C.2	1	noname	-0.0373
11	C7    -2.7681     0.1531     0.7449	C.3	1	noname	0.0137
12	C8     0.5072     1.1031     0.8092	C.2	1	noname	-0.0305
13	C9     0.8954    -1.0146     1.7501	C.2	1	noname	0.0080
14	C10    -1.0932    -4.4049     2.5739	C.2	1	noname	-0.0379
15	C11     0.9046    -4.2072     1.2138	C.2	1	noname	-0.0379
16	C12     1.2776     1.6699     1.8538	C.2	1	noname	-0.0238
17	C13    -0.3180    -5.0065     3.5941	C.2	1	noname	-0.0235
18	C14     1.6890    -4.7016     2.2592	C.2	1	noname	-0.0235
19	C15     1.8691     0.8428     2.8252	C.2	1	noname	-0.0024
20	C16     1.0831    -5.1415     3.4441	C.2	1	noname	-0.0120
21	H1    -1.0798    -2.7142    -1.6923	H	1	noname	0.0320
22	H2     0.5115    -2.6844    -0.9214	H	1	noname	0.0320
23	H3    -2.0562    -3.8213    -0.0383	H	1	noname	0.0677
24	H4     0.5244    -0.1202    -2.0713	H	1	noname	0.0253
25	H5    -1.1108    -0.6624    -2.5193	H	1	noname	0.0253
26	H6    -0.8901     0.8737    -1.6475	H	1	noname	0.0253
27	H7    -2.7647     0.9926     0.0497	H	1	noname	0.0419
28	H8    -3.7967    -0.1388     0.9570	H	1	noname	0.0419
29	H9    -2.2752     0.4467     1.6716	H	1	noname	0.0419
30	H10     0.0539     1.7570     0.1608	H	1	noname	0.0627
31	H11     0.7354    -1.9617     1.9185	H	1	noname	0.0842
32	H12    -2.0927    -4.2471     2.7340	H	1	noname	0.0627
33	H13     1.4237    -3.9182     0.3801	H	1	noname	0.0627
34	H14     1.3785     2.6803     1.9320	H	1	noname	0.0638
35	H15    -0.7852    -5.2937     4.4684	H	1	noname	0.0638
36	H16     2.7060    -4.7114     2.1590	H	1	noname	0.0638
37	H17     2.4264     1.2063     3.6099	H	1	noname	0.0839
@<TRIPOS>BOND
1	1	20	1
2	2	3	1
3	2	7	1
4	3	5	1
5	3	11	1
6	4	13	1
7	4	19	2
8	5	6	1
9	5	8	1
10	5	9	1
11	6	7	1
12	6	21	1
13	6	22	1
14	7	10	1
15	7	23	1
16	8	12	1
17	8	13	2
18	9	24	1
19	9	25	1
20	9	26	1
21	10	14	2
22	10	15	1
23	11	27	1
24	11	28	1
25	11	29	1
26	12	16	2
27	12	30	1
28	13	31	1
29	14	17	1
30	14	32	1
31	15	18	2
32	15	33	1
33	16	19	1
34	16	34	1
35	17	20	2
36	17	35	1
37	18	20	1
38	18	36	1
39	19	37	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1