@<TRIPOS>MOLECULE
http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50442794
35 38 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	F1     7.3795    -2.9128    -0.8560	F	1	noname	-0.1613
2	C1     6.9464    -3.3588    -2.0040	C.2	1	noname	0.0296
3	C2     5.9783    -4.3928    -2.0640	C.2	1	noname	0.0233
4	C3     7.4394    -2.7767    -3.1851	C.2	1	noname	-0.0087
5	N1     5.4923    -5.0128    -0.9329	N.3	1	noname	0.0932
6	C4     5.5353    -4.8348    -3.3300	C.2	1	noname	-0.0326
7	C5     6.9814    -3.2217    -4.4361	C.2	1	noname	-0.0598
8	C6     6.3963    -5.8478    -0.2688	C.2	1	noname	0.0476
9	C7     4.1282    -4.9537    -0.5559	C.2	1	noname	0.0676
10	C8     6.0293    -4.2507    -4.5080	C.2	1	noname	-0.0629
11	N2     7.6803    -5.8887    -0.5898	N.2	1	noname	-0.1405
12	C9     5.9483    -6.7088     0.7681	C.2	1	noname	0.0651
13	C10     3.1381    -4.0606    -1.0999	C.2	1	noname	0.0426
14	C11     3.6751    -5.9157     0.4001	C.2	1	noname	-0.0063
15	C12     8.5843    -6.6567     0.0032	C.2	1	noname	0.1143
16	C13     6.9083    -7.5298     1.4082	C.2	1	noname	0.0817
17	C14     4.5882    -6.7487     1.0752	C.2	1	noname	0.0159
18	N3     3.3961    -2.8826    -1.7629	N.2	1	noname	-0.0118
19	C15     1.7670    -4.3266    -0.8638	C.2	1	noname	0.0269
20	C16     2.3080    -6.0927     0.6832	C.2	1	noname	-0.0141
21	O1     9.7784    -6.6257    -0.3627	O.2	1	noname	-0.2481
22	N4     8.2043    -7.4777     1.0113	N.3	1	noname	0.1044
23	O2     6.5982    -8.3178     2.3293	O.2	1	noname	-0.2831
24	O3     2.5540    -2.2865    -2.3838	O.2	1	noname	-0.1434
25	O4     4.4071    -2.2625    -1.6078	O.3	1	noname	-0.1434
26	C17     1.3510    -5.3286     0.0151	C.2	1	noname	-0.0465
27	H1     8.1304    -2.0266    -3.1380	H	1	noname	0.0653
28	H2     4.8502    -5.5888    -3.3950	H	1	noname	0.0640
29	H3     7.3403    -2.7976    -5.2920	H	1	noname	0.0623
30	H4     5.6992    -4.5766    -5.4170	H	1	noname	0.0623
31	H5     4.2551    -7.4077     1.7833	H	1	noname	0.0638
32	H6     1.0499    -3.7325    -1.2838	H	1	noname	0.0647
33	H7     1.9970    -6.7977     1.3552	H	1	noname	0.0629
34	H8     8.8623    -8.0397     1.4463	H	1	noname	0.1424
35	H9     0.3579    -5.4745     0.1972	H	1	noname	0.0623
@<TRIPOS>BOND
1	1	2	1
2	2	3	2
3	2	4	1
4	3	5	1
5	3	6	1
6	4	7	2
7	4	27	1
8	5	8	1
9	5	9	1
10	6	10	2
11	6	28	1
12	7	10	1
13	7	29	1
14	8	11	2
15	8	12	1
16	9	13	2
17	9	14	1
18	10	30	1
19	11	15	1
20	12	16	1
21	12	17	2
22	13	18	1
23	13	19	1
24	14	20	2
25	14	17	1
26	15	21	2
27	15	22	1
28	16	23	2
29	16	22	1
30	17	31	1
31	18	24	2
32	18	25	1
33	19	26	2
34	19	32	1
35	20	26	1
36	20	33	1
37	22	34	1
38	26	35	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1