@<TRIPOS>MOLECULE
DB01726
15 15 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -0.6750    -1.1691     0.0000	O.3	1	noname	-0.2842
2	C1     0.0000     0.0000     0.0000	C.2	1	noname	-0.0183
3	C2     1.3900     0.0000     0.0000	C.2	1	noname	-0.0111
4	C3    -0.6950     1.2038     0.0000	C.2	1	noname	-0.0375
5	N1     2.0600    -1.1605     0.0000	N.3	1	noname	-0.1444
6	C4     2.0850     1.2038     0.0000	C.2	1	noname	-0.0629
7	C5    -0.0000     2.4076     0.0000	C.2	1	noname	-0.0850
8	C6     1.3900     2.4076     0.0000	C.2	1	noname	-0.0770
9	H1    -0.8350    -1.4463     0.9051	H	1	noname	0.2182
10	H2    -1.7850     1.2038     0.0000	H	1	noname	0.0650
11	H3     1.5550    -2.0352     0.0000	H	1	noname	0.1243
12	H4     3.0700    -1.1605     0.0000	H	1	noname	0.1243
13	H5     3.1750     1.2038     0.0000	H	1	noname	0.0640
14	H6    -0.5450     3.3515     0.0000	H	1	noname	0.0623
15	H7     1.9350     3.3515     0.0000	H	1	noname	0.0623
@<TRIPOS>BOND
1	1	2	1
2	2	3	2
3	2	4	1
4	3	5	1
5	3	6	1
6	4	7	2
7	6	8	2
8	7	8	1
9	1	9	1
10	4	10	1
11	5	11	1
12	5	12	1
13	6	13	1
14	7	14	1
15	8	15	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1
