@<TRIPOS>MOLECULE
http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=3860
26 28 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -3.8231     2.8663     0.6075	O.3	1	noname	-0.2843
2	C1    -2.9181     1.8623     0.6015	C.2	1	noname	0.0139
3	C2    -1.5750     2.1414     0.2796	C.2	1	noname	0.0007
4	C3    -3.3181     0.5463     0.9186	C.2	1	noname	-0.0115
5	C4    -0.6430     1.0853     0.2686	C.2	1	noname	-0.0400
6	C5    -2.3791    -0.5026     0.9227	C.2	1	noname	-0.0006
7	N1     0.6819     1.0444     0.0136	N.3	1	noname	-0.0235
8	C6    -1.0461    -0.2076     0.5987	C.2	1	noname	0.0025
9	C7     1.5189     2.0645    -0.3643	C.2	1	noname	-0.0236
10	C8     1.0509    -0.2435     0.2037	C.2	1	noname	-0.0334
11	N2     0.0118    -1.0236     0.5547	N.2	1	noname	-0.2315
12	C9     1.1169     3.0296    -1.3153	C.2	1	noname	-0.0550
13	C10     2.8219     2.1625     0.1757	C.2	1	noname	-0.0550
14	C11     1.9799     4.0677    -1.7033	C.2	1	noname	-0.0619
15	C12     3.6889     3.1996    -0.2092	C.2	1	noname	-0.0619
16	C13     3.2669     4.1547    -1.1482	C.2	1	noname	-0.0853
17	H1    -4.7352     2.5934     0.8395	H	1	noname	0.2181
18	H2    -1.2900     3.0964     0.0646	H	1	noname	0.0670
19	H3    -4.2932     0.3533     1.1526	H	1	noname	0.0650
20	H4    -2.6602    -1.4546     1.1597	H	1	noname	0.0646
21	H5     2.0019    -0.5985     0.0828	H	1	noname	0.1019
22	H6     0.1928     2.9716    -1.7443	H	1	noname	0.0642
23	H7     3.1419     1.4815     0.8648	H	1	noname	0.0642
24	H8     1.6738     4.7558    -2.3913	H	1	noname	0.0623
25	H9     4.6239     3.2597     0.1948	H	1	noname	0.0623
26	H10     3.8949     4.9078    -1.4292	H	1	noname	0.0622
@<TRIPOS>BOND
1	1	2	1
2	1	17	1
3	2	3	2
4	2	4	1
5	3	5	1
6	3	18	1
7	4	6	2
8	4	19	1
9	5	7	1
10	5	8	2
11	6	8	1
12	6	20	1
13	7	9	1
14	7	10	1
15	8	11	1
16	9	12	2
17	9	13	1
18	10	11	2
19	10	21	1
20	12	14	1
21	12	22	1
22	13	15	2
23	13	23	1
24	14	16	2
25	14	24	1
26	15	16	1
27	15	25	1
28	16	26	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1