@<TRIPOS>MOLECULE
DB02649
12 11 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     2.0850    -1.0825     0.0000	O.2	1	noname	-0.2529
2	C1     1.4600     0.0000     0.0000	C.2	1	noname	0.1393
3	O2     2.1350     1.1691     0.0000	O.3	1	noname	-0.2165
4	C2     0.0000     0.0000     0.0000	C.3	1	noname	0.1070
5	C3    -0.4867     1.3765     0.0000	C.2	1	noname	0.0373
6	O3    -1.7156     1.6049     0.0000	O.2	1	noname	-0.2953
7	N1     0.3841     2.3950     0.0000	N.3	1	noname	-0.0879
8	H1     2.2950     1.4463     0.9051	H	1	noname	0.2213
9	H2    -0.3147    -0.4450    -0.9440	H	1	noname	0.0468
10	H3    -0.3147    -0.4450     0.9440	H	1	noname	0.0468
11	H4     1.3771     2.2105     0.0000	H	1	noname	0.1271
12	H5     0.0474     3.3472     0.0000	H	1	noname	0.1271
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	2	4	1
4	4	5	1
5	5	6	2
6	5	7	1
7	3	8	1
8	4	9	1
9	4	10	1
10	7	11	1
11	7	12	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1