@<TRIPOS>MOLECULE
http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=3282
33 35 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	N1     0.3489     0.0000    -0.4362	N.2	1	noname	-0.2644
2	C1    -0.6280     0.8060     0.0497	C.2	1	noname	0.0369
3	C2     0.3399    -1.3399    -0.2521	C.2	1	noname	0.0434
4	N2    -0.5570     2.1400    -0.1721	N.3	1	noname	-0.1010
5	C3    -1.6990     0.2420     0.7738	C.2	1	noname	-0.0393
6	N3    -0.6761    -1.9068     0.4378	N.2	1	noname	-0.2728
7	C4     0.5018     2.7510    -0.8971	C.3	1	noname	0.0265
8	C5    -1.6850    -1.1638     0.9508	C.2	1	noname	0.0509
9	C6    -2.7600     0.9971     1.3168	C.2	1	noname	-0.0196
10	C7     0.2828     4.2060    -0.9880	C.2	1	noname	-0.0486
11	C8    -2.7210    -1.7967     1.6598	C.2	1	noname	-0.0059
12	C9    -3.7930     0.3582     2.0248	C.2	1	noname	-0.0475
13	C10    -0.8401     4.7100    -1.6769	C.2	1	noname	-0.0531
14	C11     1.1897     5.1110    -0.3990	C.2	1	noname	-0.0531
15	C12    -3.7750    -1.0367     2.1969	C.2	1	noname	-0.0063
16	C13    -1.0561     6.0960    -1.7699	C.2	1	noname	-0.0594
17	C14     0.9747     6.4970    -0.4919	C.2	1	noname	-0.0594
18	N4    -4.7641    -1.6437     2.8719	N.3	1	noname	-0.1519
19	C15    -0.1482     6.9891    -1.1778	C.2	1	noname	-0.0613
20	H1     1.0908    -1.9168    -0.6311	H	1	noname	0.1062
21	H2    -1.2610     2.7060     0.1778	H	1	noname	0.1300
22	H3     0.5468     2.3351    -1.9060	H	1	noname	0.0482
23	H4     1.4468     2.5371    -0.3930	H	1	noname	0.0482
24	H5    -2.7901     2.0111     1.2019	H	1	noname	0.0631
25	H6    -2.7061    -2.8107     1.7839	H	1	noname	0.0662
26	H7    -4.5560     0.9132     2.4139	H	1	noname	0.0639
27	H8    -1.5032     4.0661    -2.1109	H	1	noname	0.0626
28	H9     2.0077     4.7621     0.1009	H	1	noname	0.0626
29	H10    -1.8722     6.4521    -2.2688	H	1	noname	0.0622
30	H11     1.6346     7.1461    -0.0619	H	1	noname	0.0622
31	H12    -5.4921    -1.1216     3.2419	H	1	noname	0.1242
32	H13    -4.7531    -2.6066     2.9889	H	1	noname	0.1242
33	H14    -0.3043     7.9951    -1.2458	H	1	noname	0.0622
@<TRIPOS>BOND
1	1	2	2
2	1	3	1
3	2	4	1
4	2	5	1
5	3	6	2
6	3	20	1
7	4	7	1
8	4	21	1
9	5	8	1
10	5	9	2
11	6	8	1
12	7	10	1
13	7	22	1
14	7	23	1
15	8	11	2
16	9	12	1
17	9	24	1
18	10	13	2
19	10	14	1
20	11	15	1
21	11	25	1
22	12	15	2
23	12	26	1
24	13	16	1
25	13	27	1
26	14	17	2
27	14	28	1
28	15	18	1
29	16	19	2
30	16	29	1
31	17	19	1
32	17	30	1
33	18	31	1
34	18	32	1
35	19	33	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1