@<TRIPOS>MOLECULE
http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50442782
36 39 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	F1    13.2217   -22.5153    -4.5094	F	1	noname	-0.1648
2	C1    13.5327   -22.5503    -3.2452	C.2	1	noname	0.0234
3	C2    14.5957   -21.7692    -2.7592	C.2	1	noname	0.0039
4	C3    12.7986   -23.3622    -2.3611	C.2	1	noname	-0.0226
5	C4    14.9596   -21.8192    -1.3951	C.2	1	noname	-0.0099
6	C5    13.1195   -23.3812    -0.9941	C.2	1	noname	-0.0442
7	N1    15.9156   -20.9661    -0.9080	N.3	1	noname	0.0761
8	C6    14.1836   -22.6001    -0.5110	C.2	1	noname	-0.0503
9	C7    15.3945   -19.7170    -0.5379	C.2	1	noname	0.0441
10	C8    17.2986   -21.2800    -0.7809	C.2	1	noname	0.0195
11	N2    14.1054   -19.4229    -0.6549	N.2	1	noname	-0.1410
12	C9    16.2445   -18.7099    -0.0189	C.2	1	noname	0.0645
13	C10    18.1296   -20.2339    -0.2539	C.2	1	noname	-0.0230
14	C11    17.9646   -22.5220    -1.1179	C.2	1	noname	0.0023
15	C12    13.5554   -18.2628    -0.3249	C.2	1	noname	0.1143
16	C13    15.6675   -17.4658     0.3371	C.2	1	noname	0.0817
17	C14    17.6026   -18.9809     0.1161	C.2	1	noname	0.0134
18	C15    19.5157   -20.3869    -0.0718	C.2	1	noname	-0.0447
19	C16    19.3676   -22.6270    -0.9179	C.2	1	noname	-0.0245
20	C17    17.3236   -23.7630    -1.6739	C.3	1	noname	0.4176
21	O1    12.3282   -18.0798    -0.4718	O.2	1	noname	-0.2481
22	N3    14.3354   -17.2758     0.1741	N.3	1	noname	0.1044
23	O2    16.3504   -16.5257     0.8011	O.2	1	noname	-0.2831
24	C18    20.1356   -21.5839    -0.4058	C.2	1	noname	-0.0636
25	F2    18.1575   -24.8360    -1.9118	F	1	noname	-0.1660
26	F3    16.4165   -24.2910    -0.7948	F	1	noname	-0.1660
27	F4    16.7825   -23.5350    -2.9109	F	1	noname	-0.1660
28	H1    15.1127   -21.1631    -3.3982	H	1	noname	0.0670
29	H2    12.0245   -23.9292    -2.7081	H	1	noname	0.0653
30	H3    12.5755   -23.9552    -0.3500	H	1	noname	0.0624
31	H4    14.3965   -22.6011     0.4870	H	1	noname	0.0639
32	H5    18.2175   -18.2528     0.4901	H	1	noname	0.0638
33	H6    20.0867   -19.6268     0.3052	H	1	noname	0.0629
34	H7    19.8656   -23.4860    -1.1479	H	1	noname	0.0629
35	H8    13.9373   -16.4257     0.4161	H	1	noname	0.1424
36	H9    21.1416   -21.6989    -0.2758	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	28	1
6	4	6	2
7	4	29	1
8	5	7	1
9	5	8	2
10	6	8	1
11	6	30	1
12	7	9	1
13	7	10	1
14	8	31	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	20	1
26	15	21	2
27	15	22	1
28	16	23	2
29	16	22	1
30	17	32	1
31	18	24	2
32	18	33	1
33	19	24	1
34	19	34	1
35	20	25	1
36	20	26	1
37	20	27	1
38	22	35	1
39	24	36	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1