@<TRIPOS>MOLECULE
http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=3820
24 26 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	N1     1.9913     3.9855    -1.6448	N.2	1	noname	-0.2557
2	C1     1.1343     2.9956    -1.2928	C.2	1	noname	0.0009
3	C2     3.2493     4.0776    -1.1508	C.2	1	noname	-0.0292
4	C3     1.5253     1.9987    -0.3728	C.2	1	noname	0.0106
5	C4     3.7062     3.1136    -0.2417	C.2	1	noname	-0.0274
6	N2     0.6813     0.9818    -0.0037	N.3	1	noname	-0.0168
7	C5     2.8392     2.0777     0.1392	C.2	1	noname	-0.0345
8	C6    -0.6446     1.0268     0.2502	C.2	1	noname	-0.0471
9	C7     1.0442    -0.3101     0.1782	C.2	1	noname	-0.0318
10	C8    -1.0537    -0.2670     0.5703	C.2	1	noname	0.0113
11	C9    -1.5747     2.0848     0.2663	C.2	1	noname	-0.0304
12	N3     0.0022    -1.0880     0.5222	N.2	1	noname	-0.2287
13	C10    -2.3877    -0.5610     0.8893	C.2	1	noname	-0.0105
14	C11    -2.9187     1.8068     0.5843	C.2	1	noname	-0.0469
15	C12    -3.3237     0.4909     0.8913	C.2	1	noname	-0.0439
16	H1     0.2063     2.9727    -1.7157	H	1	noname	0.0859
17	H2     3.8602     4.8406    -1.4427	H	1	noname	0.0839
18	H3     4.6522     3.1657     0.1382	H	1	noname	0.0639
19	H4     3.1691     1.3798     0.8052	H	1	noname	0.0643
20	H5     1.9931    -0.6680     0.0563	H	1	noname	0.1019
21	H6    -1.2877     3.0418     0.0603	H	1	noname	0.0643
22	H7    -2.6717    -1.5139     1.1193	H	1	noname	0.0645
23	H8    -3.6037     2.5628     0.5953	H	1	noname	0.0623
24	H9    -4.2997     0.3010     1.1204	H	1	noname	0.0623
@<TRIPOS>BOND
1	1	2	2
2	1	3	1
3	2	4	1
4	2	16	1
5	3	5	2
6	3	17	1
7	4	6	1
8	4	7	2
9	5	7	1
10	5	18	1
11	6	8	1
12	6	9	1
13	7	19	1
14	8	10	2
15	8	11	1
16	9	12	2
17	9	20	1
18	10	13	1
19	10	12	1
20	11	14	2
21	11	21	1
22	13	15	2
23	13	22	1
24	14	15	1
25	14	23	1
26	15	24	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1