@<TRIPOS>MOLECULE
http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=3791
26 28 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	N1     0.6984     0.9604     0.0000	N.3	1	noname	-0.0532
2	C1     1.5334     1.9995    -0.3299	C.2	1	noname	-0.0248
3	C2    -0.6315     1.0045     0.2680	C.2	1	noname	-0.0795
4	C3     1.0874    -0.3324     0.1070	C.2	1	noname	-0.0977
5	C4     2.8263     2.0905     0.2370	C.2	1	noname	-0.0579
6	C5     1.1413     2.9876    -1.2599	C.2	1	noname	-0.0579
7	C6    -1.0856    -0.2904     0.5330	C.2	1	noname	-0.0330
8	C7    -1.5336     2.0845     0.3400	C.2	1	noname	-0.0410
9	C8     0.0024    -1.1384     0.4310	C.2	1	noname	-0.0347
10	C9     3.6913     3.1446    -0.1018	C.2	1	noname	-0.0626
11	C10     2.0043     4.0436    -1.6019	C.2	1	noname	-0.0626
12	C11    -2.4256    -0.5624     0.8471	C.2	1	noname	-0.0409
13	C12    -2.8846     1.8326     0.6551	C.2	1	noname	-0.0506
14	C13     3.2793     4.1226    -1.0208	C.2	1	noname	-0.0877
15	C14    -3.3287     0.5176     0.9031	C.2	1	noname	-0.0542
16	H1     2.0364    -0.6804    -0.0409	H	1	noname	0.0795
17	H2     3.1393     1.3896     0.9091	H	1	noname	0.0642
18	H3     0.2253     2.9356    -1.7058	H	1	noname	0.0642
19	H4    -1.2207     3.0406     0.1751	H	1	noname	0.0642
20	H5     0.0103    -2.1504     0.5671	H	1	noname	0.0643
21	H6     4.6193     3.1996     0.3201	H	1	noname	0.0623
22	H7     1.7052     4.7486    -2.2758	H	1	noname	0.0623
23	H8    -2.7407    -1.5153     1.0351	H	1	noname	0.0629
24	H9    -3.5457     2.6086     0.7061	H	1	noname	0.0623
25	H10     3.9072     4.8887    -1.2678	H	1	noname	0.0622
26	H11    -4.3087     0.3476     1.1302	H	1	noname	0.0622
@<TRIPOS>BOND
1	1	2	1
2	1	3	1
3	1	4	1
4	2	5	2
5	2	6	1
6	3	7	2
7	3	8	1
8	4	9	2
9	4	16	1
10	5	10	1
11	5	17	1
12	6	11	2
13	6	18	1
14	7	12	1
15	7	9	1
16	8	13	2
17	8	19	1
18	9	20	1
19	10	14	2
20	10	21	1
21	11	14	1
22	11	22	1
23	12	15	2
24	12	23	1
25	13	15	1
26	13	24	1
27	14	25	1
28	15	26	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1