@<TRIPOS>MOLECULE
http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50442786
36 39 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Cl1    21.0986   -17.9140    -4.1074	Cl	1	noname	-0.0895
2	C1    22.1796   -17.0830    -3.1064	C.2	1	noname	-0.0275
3	C2    22.3796   -17.5039    -1.7784	C.2	1	noname	-0.0248
4	C3    22.8825   -15.9670    -3.5983	C.2	1	noname	-0.0248
5	C4    23.2795   -16.8149    -0.9483	C.2	1	noname	-0.0367
6	C5    23.7825   -15.2779    -2.7673	C.2	1	noname	-0.0367
7	C6    23.9875   -15.6979    -1.4373	C.2	1	noname	-0.0204
8	N1    24.8644   -15.0259    -0.6273	N.3	1	noname	0.0690
9	C7    24.3693   -13.9788     0.1397	C.2	1	noname	0.0430
10	C8    26.2143   -15.3848    -0.5722	C.2	1	noname	-0.0038
11	N2    23.0933   -13.6308     0.0947	N.2	1	noname	-0.1411
12	C9    25.2423   -13.2518     0.9997	C.2	1	noname	0.0643
13	C10    27.0952   -14.6678     0.2817	C.2	1	noname	-0.0292
14	C11    26.7653   -16.4458    -1.3352	C.2	1	noname	-0.0110
15	C12    22.5673   -12.6408     0.8037	C.2	1	noname	0.1143
16	C13    24.6793   -12.1958     1.7557	C.2	1	noname	0.0817
17	C14    26.5952   -13.6038     1.0617	C.2	1	noname	0.0123
18	C15    28.4592   -15.0068     0.3587	C.2	1	noname	-0.0375
19	C16    28.1312   -16.7987    -1.2722	C.2	1	noname	-0.0069
20	O1    21.3513   -12.3727     0.7068	O.2	1	noname	-0.2481
21	N3    23.3563   -11.9187     1.6368	N.3	1	noname	0.1044
22	O2    25.3652   -11.5018     2.5377	O.2	1	noname	-0.2831
23	C17    28.9701   -16.0607    -0.4111	C.2	1	noname	-0.0379
24	C18    28.6371   -17.9227    -2.1031	C.3	1	noname	0.4161
25	F1    29.9841   -18.1646    -1.9631	F	1	noname	-0.1661
26	F2    27.9841   -19.0856    -1.7701	F	1	noname	-0.1661
27	F3    28.4131   -17.6646    -3.4340	F	1	noname	-0.1661
28	H1    21.8755   -18.3119    -1.4084	H	1	noname	0.0638
29	H2    22.7455   -15.6499    -4.5603	H	1	noname	0.0638
30	H3    23.4195   -17.1259     0.0136	H	1	noname	0.0640
31	H4    24.2884   -14.4699    -3.1302	H	1	noname	0.0640
32	H5    26.1642   -16.9847    -1.9591	H	1	noname	0.0645
33	H6    27.2231   -13.0837     1.6787	H	1	noname	0.0638
34	H7    29.0901   -14.4897     0.9737	H	1	noname	0.0629
35	H8    22.9692   -11.1967     2.1548	H	1	noname	0.1424
36	H9    29.9621   -16.2887    -0.3391	H	1	noname	0.0629
@<TRIPOS>BOND
1	1	2	1
2	2	3	2
3	2	4	1
4	3	5	1
5	3	28	1
6	4	6	2
7	4	29	1
8	5	7	2
9	5	30	1
10	6	7	1
11	6	31	1
12	7	8	1
13	8	9	1
14	8	10	1
15	9	11	2
16	9	12	1
17	10	13	2
18	10	14	1
19	11	15	1
20	12	16	1
21	12	17	2
22	13	18	1
23	13	17	1
24	14	19	2
25	14	32	1
26	15	20	2
27	15	21	1
28	16	22	2
29	16	21	1
30	17	33	1
31	18	23	2
32	18	34	1
33	19	24	1
34	19	23	1
35	21	35	1
36	23	36	1
37	24	25	1
38	24	26	1
39	24	27	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1