@<TRIPOS>MOLECULE
http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50444551
33 35 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	F1    19.3857    -8.2889     0.7915	F	1	noname	-0.1626
2	C1    19.5177    -8.4309    -0.4984	C.2	1	noname	0.0359
3	C2    18.5076    -9.0408    -1.2823	C.2	1	noname	0.0149
4	C3    20.7156    -7.9788    -1.0813	C.2	1	noname	0.0344
5	C4    18.7676    -9.2238    -2.6603	C.2	1	noname	-0.0301
6	C5    17.2395    -9.5158    -0.6453	C.3	1	noname	0.0011
7	C6    20.9416    -8.1428    -2.4603	C.2	1	noname	0.0012
8	C7    19.9615    -8.7757    -3.2473	C.2	1	noname	-0.0195
9	N1    16.3685   -10.2918    -1.4853	N.3	1	noname	-0.0430
10	C8    16.4175    -8.3978     0.0497	C.3	1	noname	-0.0298
11	C9    22.0486    -7.7257    -3.0003	C.1	1	noname	0.0616
12	C10    15.5464    -9.8667    -2.4643	C.2	1	noname	-0.0655
13	C11    16.1964   -11.6248    -1.3892	C.2	1	noname	-0.0577
14	C12    16.0374    -7.2037    -0.8462	C.3	1	noname	-0.0508
15	N2    23.0256    -7.3567    -3.4763	N.1	1	noname	-0.1838
16	C13    14.8843   -10.9857    -2.9552	C.2	1	noname	0.0033
17	C14    15.3683    -8.4907    -2.9502	C.3	1	noname	0.0247
18	N3    15.2954   -12.0668    -2.2812	N.2	1	noname	-0.2453
19	C15    14.9114    -7.5347    -1.8382	C.3	1	noname	-0.0478
20	H1    21.4246    -7.5368    -0.4903	H	1	noname	0.0667
21	H2    18.0865    -9.6917    -3.2563	H	1	noname	0.0627
22	H3    17.5625   -10.1748     0.1647	H	1	noname	0.0561
23	H4    20.1085    -8.9197    -4.2493	H	1	noname	0.0636
24	H5    15.5024    -8.8358     0.4517	H	1	noname	0.0289
25	H6    16.9824    -8.0097     0.8957	H	1	noname	0.0289
26	H7    16.6844   -12.2258    -0.7232	H	1	noname	0.1015
27	H8    15.6824    -6.4016    -0.1972	H	1	noname	0.0267
28	H9    16.9124    -6.8397    -1.3852	H	1	noname	0.0267
29	H10    14.1943   -10.9847    -3.7072	H	1	noname	0.0856
30	H11    14.6143    -8.4796    -3.7382	H	1	noname	0.0329
31	H12    16.3043    -8.1276    -3.3722	H	1	noname	0.0329
32	H13    14.5953    -6.6016    -2.3061	H	1	noname	0.0270
33	H14    14.0573    -7.9546    -1.3031	H	1	noname	0.0270
@<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	20	1
8	5	8	2
9	5	21	1
10	6	9	1
11	6	10	1
12	6	22	1
13	7	11	1
14	7	8	1
15	8	23	1
16	9	12	1
17	9	13	1
18	10	14	1
19	10	24	1
20	10	25	1
21	11	15	3
22	12	16	2
23	12	17	1
24	13	18	2
25	13	26	1
26	14	19	1
27	14	27	1
28	14	28	1
29	16	18	1
30	16	29	1
31	17	19	1
32	17	30	1
33	17	31	1
34	19	32	1
35	19	33	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1