@<TRIPOS>MOLECULE
http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50442790
36 39 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	F1    33.5063   -12.5053     0.6053	F	1	noname	-0.1614
2	C1    33.0642   -11.7103     1.5403	C.2	1	noname	0.0287
3	C2    33.7672   -10.5304     1.8763	C.2	1	noname	0.0232
4	C3    31.8773   -12.0413     2.2173	C.2	1	noname	-0.0088
5	N1    34.9281   -10.1883     1.2304	N.3	1	noname	0.0797
6	C4    33.2642    -9.6934     2.8933	C.2	1	noname	-0.0334
7	C5    31.3852   -11.2003     3.2303	C.2	1	noname	-0.0606
8	C6    34.8311    -9.4023     0.0895	C.2	1	noname	0.0452
9	C7    36.1700   -10.6193     1.7074	C.2	1	noname	-0.0036
10	C8    32.0782   -10.0273     3.5683	C.2	1	noname	-0.0630
11	N2    33.6601    -8.9933    -0.3704	N.2	1	noname	-0.1408
12	C9    36.0100    -9.0203    -0.6134	C.2	1	noname	0.0646
13	C10    37.3529   -10.2442     1.0145	C.2	1	noname	-0.0283
14	C11    36.3180   -11.4262     2.8644	C.2	1	noname	-0.0101
15	C12    33.5080    -8.2433    -1.4533	C.2	1	noname	0.1143
16	C13    35.8459    -8.2203    -1.7693	C.2	1	noname	0.0817
17	C14    37.2579    -9.4442    -0.1433	C.2	1	noname	0.0124
18	C15    38.6178   -10.6632     1.4715	C.2	1	noname	-0.0373
19	C16    37.5769   -11.8562     3.3354	C.2	1	noname	-0.0068
20	O1    32.3680    -7.8963    -1.8253	O.2	1	noname	-0.2481
21	N3    34.5990    -7.8523    -2.1582	N.3	1	noname	0.1044
22	O2    36.8199    -7.8353    -2.4522	O.2	1	noname	-0.2831
23	C17    38.7258   -11.4601     2.6195	C.2	1	noname	-0.0371
24	C18    37.6518   -12.7021     4.5564	C.3	1	noname	0.4161
25	F2    38.9317   -13.0580     4.9154	F	1	noname	-0.1661
26	F3    37.1068   -12.0341     5.6264	F	1	noname	-0.1661
27	F4    36.9488   -13.8670     4.3664	F	1	noname	-0.1661
28	H1    31.3693   -12.8922     1.9754	H	1	noname	0.0653
29	H2    33.7631    -8.8384     3.1433	H	1	noname	0.0640
30	H3    30.5233   -11.4432     3.7204	H	1	noname	0.0623
31	H4    31.7201    -9.4163     4.3043	H	1	noname	0.0623
32	H5    35.4909   -11.7162     3.3864	H	1	noname	0.0645
33	H6    38.1048    -9.1712    -0.6463	H	1	noname	0.0638
34	H7    39.4668   -10.3922     0.9716	H	1	noname	0.0629
35	H8    34.4859    -7.3053    -2.9492	H	1	noname	0.1424
36	H9    39.6527   -11.7521     2.9305	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	6	1
6	4	7	2
7	4	28	1
8	5	8	1
9	5	9	1
10	6	10	2
11	6	29	1
12	7	10	1
13	7	30	1
14	8	11	2
15	8	12	1
16	9	13	2
17	9	14	1
18	10	31	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