@<TRIPOS>MOLECULE
57376351
39 40 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Cl1    -4.2805     3.5698    -0.9830	Cl	1	noname	-0.0856
2	N1     0.0558    -0.9587    -2.4320	N.3	1	noname	-0.3268
3	C1    -0.9446    -1.3548    -0.2384	C.3	1	noname	0.0295
4	C2    -0.4570    -1.5773     1.1958	C.3	1	noname	-0.0420
5	C3    -1.5609    -2.7660    -0.1894	C.3	1	noname	-0.0420
6	C4    -1.2622    -2.8701     1.3051	C.3	1	noname	-0.0515
7	C5     0.3597    -1.1834    -1.0197	C.3	1	noname	0.0140
8	C6    -1.8349    -0.1657    -0.3797	C.2	1	noname	-0.0488
9	C7     1.2101    -2.4471    -0.8759	C.3	1	noname	-0.0348
10	C8     2.5144    -2.2758    -1.6573	C.3	1	noname	-0.0456
11	C9    -1.2045     1.0149    -0.9000	C.2	1	noname	-0.0488
12	C10    -3.2335    -0.1578    -0.0185	C.2	1	noname	-0.0488
13	C11     3.3648    -3.5395    -1.5134	C.3	1	noname	-0.0627
14	C12     3.2862    -1.0760    -1.1044	C.3	1	noname	-0.0627
15	C13    -1.9703     2.2030    -1.0867	C.2	1	noname	-0.0268
16	C14    -4.0147     1.0132    -0.2043	C.2	1	noname	-0.0268
17	C15    -3.3641     2.1739    -0.7428	C.2	1	noname	-0.0172
18	H1    -0.8928    -0.8215     1.8492	H	1	noname	0.0276
19	H2     0.6182    -1.7480     1.2507	H	1	noname	0.0276
20	H3    -2.6381    -2.6974    -0.3407	H	1	noname	0.0276
21	H4    -1.0005    -3.4898    -0.7811	H	1	noname	0.0276
22	H5    -2.1744    -2.6832     1.8718	H	1	noname	0.0267
23	H6    -0.5939    -3.7103     1.4936	H	1	noname	0.0267
24	H7     0.9096    -0.3286    -0.6259	H	1	noname	0.0471
25	H8     0.6603    -3.3019    -1.2697	H	1	noname	0.0285
26	H9     1.4367    -2.6147     0.1770	H	1	noname	0.0285
27	H10     2.2878    -2.1082    -2.7102	H	1	noname	0.0297
28	H11     0.9270    -0.8442    -2.9539	H	1	noname	0.1187
29	H12    -0.5123    -0.1145    -2.5281	H	1	noname	0.1187
30	H13    -0.2120     1.0036    -1.1352	H	1	noname	0.0626
31	H14    -3.6618    -0.9973     0.3717	H	1	noname	0.0626
32	H15     4.2940    -3.4174    -2.0701	H	1	noname	0.0233
33	H16     2.8150    -4.3943    -1.9073	H	1	noname	0.0233
34	H17     3.5914    -3.7071    -0.4605	H	1	noname	0.0233
35	H18     4.2154    -0.9539    -1.6611	H	1	noname	0.0233
36	H19     2.6803    -0.1757    -1.2069	H	1	noname	0.0233
37	H20     3.5128    -1.2435    -0.0515	H	1	noname	0.0233
38	H21    -1.5395     3.0511    -1.4548	H	1	noname	0.0638
39	H22    -5.0056     1.0291     0.0370	H	1	noname	0.0638
@<TRIPOS>BOND
1	1	17	1
2	7	2	1
3	2	28	1
4	2	29	1
5	3	4	1
6	3	5	1
7	3	7	1
8	3	8	1
9	4	6	1
10	4	18	1
11	4	19	1
12	5	6	1
13	5	20	1
14	5	21	1
15	6	22	1
16	6	23	1
17	7	9	1
18	7	24	1
19	8	11	2
20	8	12	1
21	9	10	1
22	9	25	1
23	9	26	1
24	10	13	1
25	10	14	1
26	10	27	1
27	11	15	1
28	11	30	1
29	12	16	2
30	12	31	1
31	13	32	1
32	13	33	1
33	13	34	1
34	14	35	1
35	14	36	1
36	14	37	1
37	15	17	2
38	15	38	1
39	16	17	1
40	16	39	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1