@<TRIPOS>MOLECULE
http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=3285
33 35 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	N1     0.4363     0.0000     1.5714	N.2	1	noname	-0.2424
2	C1    -0.5727     0.8220     1.1885	C.2	1	noname	0.0200
3	C2     0.4142    -1.3299     1.3325	C.2	1	noname	0.0239
4	N2    -0.4857     2.1450     1.4596	N.3	1	noname	-0.1045
5	C3    -1.6907     0.2860     0.5145	C.2	1	noname	-0.0044
6	N3    -0.6457    -1.8689     0.6895	N.2	1	noname	-0.2472
7	C4     0.6222     2.7311     2.1306	C.3	1	noname	0.0265
8	C5    -1.6917    -1.1118     0.2756	C.2	1	noname	0.0311
9	C6    -2.7827     1.0671     0.0786	C.2	1	noname	-0.0403
10	C7     0.4311     4.1881     2.2476	C.2	1	noname	-0.0486
11	C8    -2.7788    -1.7108    -0.3943	C.2	1	noname	0.0166
12	C9    -3.8608     0.4631    -0.5893	C.2	1	noname	-0.0504
13	C10     0.3661     4.9872     1.0877	C.2	1	noname	-0.0531
14	C11     0.3171     4.8021     3.5127	C.2	1	noname	-0.0531
15	N4    -2.7968    -3.0347    -0.6263	N.3	1	noname	-0.1421
16	C12    -3.8598    -0.9207    -0.8252	C.2	1	noname	-0.0341
17	C13     0.1870     6.3772     1.1887	C.2	1	noname	-0.0594
18	C14     0.1380     6.1932     3.6147	C.2	1	noname	-0.0594
19	C15     0.0730     6.9802     2.4527	C.2	1	noname	-0.0613
20	H1     1.1892    -1.9199     1.6345	H	1	noname	0.1062
21	H2    -1.2137     2.7231     1.1826	H	1	noname	0.1300
22	H3     1.5371     2.5371     1.5676	H	1	noname	0.0482
23	H4     0.7201     2.2751     3.1186	H	1	noname	0.0482
24	H5    -2.8008     2.0741     0.2417	H	1	noname	0.0630
25	H6    -4.6478     1.0321    -0.9032	H	1	noname	0.0623
26	H7     0.4500     4.5552     0.1667	H	1	noname	0.0626
27	H8     0.3640     4.2382     4.3617	H	1	noname	0.0626
28	H9    -3.5459    -3.4417    -1.0882	H	1	noname	0.1243
29	H10    -2.0538    -3.5827    -0.3272	H	1	noname	0.1243
30	H11    -4.6479    -1.3506    -1.3112	H	1	noname	0.0639
31	H12     0.1410     6.9482     0.3447	H	1	noname	0.0622
32	H13     0.0560     6.6312     4.5328	H	1	noname	0.0622
33	H14    -0.0570     7.9903     2.5268	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	16	1
22	12	16	2
23	12	25	1
24	13	17	1
25	13	26	1
26	14	18	2
27	14	27	1
28	15	28	1
29	15	29	1
30	16	30	1
31	17	19	2
32	17	31	1
33	18	19	1
34	18	32	1
35	19	33	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1