@<TRIPOS>MOLECULE
DB06262
26 26 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -3.6728    -1.0701     1.1188	O.2	1	noname	-0.2486
2	C1    -2.5382    -1.5484     0.9032	C.2	1	noname	0.1452
3	O2    -2.3982    -2.8674     0.6520	O.3	1	noname	-0.2132
4	C2    -1.3643    -0.6805     0.9228	C.3	1	noname	0.1217
5	N1    -0.4358    -1.1399     1.9545	N.3	1	noname	-0.3170
6	C3    -0.6737    -0.7257    -0.4417	C.3	1	noname	0.1039
7	O3    -0.2725    -2.0580    -0.7252	O.3	1	noname	-0.3861
8	C4     0.5002     0.1422    -0.4220	C.2	1	noname	-0.0454
9	C5     1.7354    -0.3679    -0.0396	C.2	1	noname	-0.0118
10	C6     0.3826     1.4787    -0.7856	C.2	1	noname	-0.0519
11	C7     2.8529     0.4584    -0.0209	C.2	1	noname	0.0255
12	C8     1.5001     2.3050    -0.7669	C.2	1	noname	-0.0209
13	O4     4.0526    -0.0370     0.3504	O.3	1	noname	-0.2759
14	C9     2.7353     1.7948    -0.3845	C.2	1	noname	0.0226
15	O5     3.8207     2.5974    -0.3663	O.3	1	noname	-0.2762
16	H1    -2.3473    -3.3475     1.4818	H	1	noname	0.2213
17	H2    -1.6911     0.3267     1.1815	H	1	noname	0.0603
18	H3    -0.5030    -2.0825     2.3108	H	1	noname	0.1192
19	H4     0.2728    -0.5146     2.3108	H	1	noname	0.1192
20	H5    -1.3282    -0.4155    -1.2562	H	1	noname	0.0674
21	H6    -0.1300    -2.5313     0.0978	H	1	noname	0.2110
22	H7     1.8276    -1.4159     0.2455	H	1	noname	0.0654
23	H8    -0.5860     1.8787    -1.0854	H	1	noname	0.0627
24	H9     1.4079     3.3530    -1.0520	H	1	noname	0.0651
25	H10     4.1068    -0.0594     1.3086	H	1	noname	0.2183
26	H11     4.0682     2.7804     0.5430	H	1	noname	0.2183
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	2	4	1
4	4	5	1
5	4	6	1
6	6	7	1
7	6	8	1
8	8	9	2
9	8	10	1
10	9	11	1
11	10	12	2
12	11	13	1
13	11	14	2
14	12	14	1
15	14	15	1
16	3	16	1
17	4	17	1
18	5	18	1
19	5	19	1
20	6	20	1
21	7	21	1
22	9	22	1
23	10	23	1
24	12	24	1
25	13	25	1
26	15	26	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1