@<TRIPOS>MOLECULE
DB03209
14 14 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -0.6250    -1.0825     0.0000	O.2	1	noname	-0.2465
2	C1     0.0000     0.0000     0.0000	C.2	1	noname	0.1224
3	N1     1.3400     0.0000     0.0000	N.2	1	noname	-0.1136
4	N2    -0.6700     1.1605     0.0000	N.3	1	noname	0.1068
5	C2     2.0100     1.1605     0.0000	C.2	1	noname	0.0995
6	C3     0.0000     2.3209     0.0000	C.2	1	noname	0.0434
7	N3     1.3400     2.3209     0.0000	N.3	1	noname	0.0777
8	C4     3.4000     1.1605     0.0000	C.2	1	noname	0.1308
9	O2    -0.6250     3.4035     0.0000	O.2	1	noname	-0.2790
10	O3     4.0250     2.2430     0.0000	O.2	1	noname	-0.2411
11	O4     4.0750    -0.0087     0.0000	O.3	1	noname	-0.2058
12	H1    -1.6800     1.1605     0.0000	H	1	noname	0.1434
13	H2     1.8450     3.1956     0.0000	H	1	noname	0.1402
14	H3     4.2350    -0.2858     0.9051	H	1	noname	0.2217
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	2	4	1
4	3	5	2
5	4	6	1
6	5	7	1
7	5	8	1
8	6	9	2
9	6	7	1
10	8	10	2
11	8	11	1
12	4	12	1
13	7	13	1
14	11	14	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1
