@<TRIPOS>MOLECULE
http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=3694
34 36 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	N1    -1.0390     1.9054     0.4328	N.2	1	noname	-0.2038
2	C1    -2.2350     1.2794     0.3018	C.2	1	noname	0.0946
3	C2     0.1080     1.3454    -0.0271	C.2	1	noname	0.0554
4	N2    -2.2851     0.0673    -0.3021	N.2	1	noname	-0.2181
5	N3    -3.3762     1.8294     0.7579	N.3	1	noname	-0.0712
6	C3     1.3580     1.9765     0.0978	C.2	1	noname	0.0892
7	C4     0.0779     0.0833    -0.6571	C.2	1	noname	0.0306
8	C5    -1.1720    -0.5406    -0.7811	C.2	1	noname	0.0554
9	C6    -3.4182     3.0925     1.4020	C.3	1	noname	-0.0086
10	N4     2.4651     1.3485    -0.3810	N.2	1	noname	-0.2089
11	N5     1.4140     3.1886     0.7089	N.3	1	noname	0.0149
12	N6     1.2170    -0.4866    -1.1181	N.2	1	noname	-0.2297
13	C7     2.4111     0.1364    -0.9840	C.2	1	noname	0.0626
14	C8     2.5220     3.9427     0.9340	C.2	1	noname	-0.0334
15	C9     2.6050     4.6297     2.1601	C.2	1	noname	-0.0629
16	C10     3.5551     4.1067    -0.0139	C.2	1	noname	-0.0663
17	C11     3.7110     5.4488     2.4591	C.2	1	noname	-0.0604
18	C12     4.6631     4.9208     0.2760	C.2	1	noname	-0.0649
19	C13     4.7420     5.5879     1.5091	C.2	1	noname	-0.0875
20	C14     3.7720     6.1459     3.7533	C.3	1	noname	-0.0016
21	H1    -4.2033     1.3374     0.6379	H	1	noname	0.1308
22	H2    -1.2461    -1.4536    -1.2290	H	1	noname	0.0864
23	H3    -4.4483     3.3166     1.6810	H	1	noname	0.0396
24	H4    -2.8012     3.0746     2.3021	H	1	noname	0.0396
25	H5    -3.0543     3.8696     0.7270	H	1	noname	0.0396
26	H6     0.5769     3.5287     1.0640	H	1	noname	0.1358
27	H7     3.2631    -0.3025    -1.3340	H	1	noname	0.1062
28	H8     1.8549     4.5298     2.8462	H	1	noname	0.0642
29	H9     3.5020     3.6398    -0.9189	H	1	noname	0.0639
30	H10     5.4091     5.0298    -0.4119	H	1	noname	0.0623
31	H11     5.5500     6.1780     1.7112	H	1	noname	0.0625
32	H12     4.6850     6.7380     3.8403	H	1	noname	0.0279
33	H13     2.9129     6.8120     3.8513	H	1	noname	0.0279
34	H14     3.7509     5.4149     4.5633	H	1	noname	0.0279
@<TRIPOS>BOND
1	1	2	2
2	1	3	1
3	2	4	1
4	2	5	1
5	3	6	2
6	3	7	1
7	4	8	2
8	5	9	1
9	5	21	1
10	6	10	1
11	6	11	1
12	7	12	2
13	7	8	1
14	8	22	1
15	9	23	1
16	9	24	1
17	9	25	1
18	10	13	2
19	11	14	1
20	11	26	1
21	12	13	1
22	13	27	1
23	14	15	2
24	14	16	1
25	15	17	1
26	15	28	1
27	16	18	2
28	16	29	1
29	17	19	2
30	17	20	1
31	18	19	1
32	18	30	1
33	19	31	1
34	20	32	1
35	20	33	1
36	20	34	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1