@<TRIPOS>MOLECULE
http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=3344
34 36 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	N1     3.2145     1.3892     0.6944	N.2	1	noname	-0.2264
2	C1     2.1175     2.1862     0.6684	C.2	1	noname	0.0553
3	C2     3.1295     0.0402     0.6324	C.2	1	noname	0.0578
4	N2     2.2674     3.5293     0.7355	N.3	1	noname	-0.0980
5	C3     0.8394     1.6013     0.5734	C.2	1	noname	-0.0044
6	N3     1.9124    -0.5437     0.5415	N.2	1	noname	-0.2432
7	C4     3.5344     4.1663     0.8385	C.3	1	noname	0.0281
8	C5     0.7744     0.1893     0.5105	C.2	1	noname	0.0234
9	C6    -0.3666     2.3283     0.5385	C.2	1	noname	0.0246
10	C7     3.3574     5.6314     0.8716	C.2	1	noname	-0.0595
11	C8    -0.4676    -0.4606     0.4175	C.2	1	noname	0.0083
12	N4    -1.5476     1.6673     0.4475	N.2	1	noname	-0.2578
13	C9     2.8223     6.3225    -0.2393	C.2	1	noname	-0.0287
14	C10     3.7253     6.3615     2.0206	C.2	1	noname	-0.0572
15	C11    -1.6357     0.3164     0.3876	C.2	1	noname	0.0377
16	N5     2.4643     5.6595    -1.3523	N.3	1	noname	-0.1535
17	C12     2.6562     7.7185    -0.1933	C.2	1	noname	-0.0691
18	C13     3.5593     7.7566     2.0647	C.2	1	noname	-0.0914
19	N6    -2.8417    -0.2585     0.2996	N.3	1	noname	-0.1172
20	C14     3.0242     8.4346     0.9587	C.2	1	noname	-0.0651
21	H1     3.9745    -0.5307     0.6545	H	1	noname	0.1062
22	H2     1.4744     4.0874     0.7145	H	1	noname	0.1300
23	H3     4.1544     3.8994    -0.0194	H	1	noname	0.0483
24	H4     4.0324     3.8174     1.7466	H	1	noname	0.0483
25	H5    -0.3656     3.3474     0.5815	H	1	noname	0.0848
26	H6    -0.5187    -1.4796     0.3726	H	1	noname	0.0679
27	H7     4.1133     5.8775     2.8317	H	1	noname	0.0626
28	H8     2.1012     6.1416    -2.1123	H	1	noname	0.1242
29	H9     2.5742     4.6965    -1.3983	H	1	noname	0.1242
30	H10     2.2682     8.2176    -0.9942	H	1	noname	0.0639
31	H11     3.8272     8.2756     2.9018	H	1	noname	0.0622
32	H12    -2.9198    -1.2245     0.2567	H	1	noname	0.1257
33	H13    -3.6378     0.2945     0.2797	H	1	noname	0.1257
34	H14     2.9032     9.4476     0.9897	H	1	noname	0.0623
@<TRIPOS>BOND
1	1	2	2
2	1	3	1
3	2	4	1
4	2	5	1
5	3	6	2
6	3	21	1
7	4	7	1
8	4	22	1
9	5	8	1
10	5	9	2
11	6	8	1
12	7	10	1
13	7	23	1
14	7	24	1
15	8	11	2
16	9	12	1
17	9	25	1
18	10	13	2
19	10	14	1
20	11	15	1
21	11	26	1
22	12	15	2
23	13	16	1
24	13	17	1
25	14	18	2
26	14	27	1
27	15	19	1
28	16	28	1
29	16	29	1
30	17	20	2
31	17	30	1
32	18	20	1
33	18	31	1
34	19	32	1
35	19	33	1
36	20	34	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1