@<TRIPOS>MOLECULE
http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=4280
15 15 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	N1     9.6538    -5.8500     1.8923	N.1	1	noname	-0.1749
2	C1     9.5018    -4.7960     1.4593	C.1	1	noname	0.0945
3	C2     9.3407    -3.6030     0.9714	C.2	1	noname	0.0808
4	C3    10.4166    -2.8830     0.8994	C.1	1	noname	0.0945
5	C4     8.1007    -3.0700     0.5775	C.2	1	noname	0.0310
6	N2    11.3795    -2.2580     0.8435	N.1	1	noname	-0.1749
7	C5     6.8757    -3.7710     0.5095	C.2	1	noname	-0.0585
8	N3     6.6587    -5.0949     0.6245	N.3	1	noname	-0.0103
9	C6     5.6308    -3.1899     0.3215	C.2	1	noname	0.0056
10	N4     5.3937    -5.3748     0.5686	N.2	1	noname	-0.2976
11	C7     4.7178    -4.2249     0.4006	C.2	1	noname	0.0165
12	H1     8.0637    -2.0710     0.3435	H	1	noname	0.0664
13	H2     7.3536    -5.7598     0.7286	H	1	noname	0.1754
14	H3     5.4257    -2.2040     0.1986	H	1	noname	0.0659
15	H4     3.7028    -4.1288     0.3556	H	1	noname	0.0856
@<TRIPOS>BOND
1	1	2	3
2	2	3	1
3	3	4	1
4	3	5	2
5	4	6	3
6	5	7	1
7	5	12	1
8	7	8	1
9	7	9	2
10	8	10	1
11	8	13	1
12	9	11	1
13	9	14	1
14	10	11	2
15	11	15	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1