@<TRIPOS>MOLECULE
DB03201
14 13 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	S1     2.0266    -1.2208     0.7262	S.3	1	noname	-0.1771
2	C1     1.0575    -0.7831    -0.7261	C.3	1	noname	0.0151
3	C2    -0.1831    -0.1375    -0.3069	C.3	1	noname	0.1001
4	N1     0.1295     1.0718     0.4529	N.3	1	noname	-0.3187
5	C3    -1.0068     0.2345    -1.5414	C.2	1	noname	0.1441
6	O1    -2.1523    -0.2416    -1.6951	O.2	1	noname	-0.2494
7	O2    -0.4965     1.0770    -2.4646	O.3	1	noname	-0.2138
8	H1     2.0956    -2.5349     0.8295	H	1	noname	0.1022
9	H2     1.5624    -0.0015    -1.2937	H	1	noname	0.0399
10	H3     0.7081    -1.6839    -1.2307	H	1	noname	0.0399
11	H4    -0.7183    -0.8241     0.3490	H	1	noname	0.0580
12	H5     1.0844     1.2706     0.7154	H	1	noname	0.1192
13	H6    -0.6093     1.7084     0.7154	H	1	noname	0.1192
14	H7    -0.0549     1.8061    -2.0231	H	1	noname	0.2213
@<TRIPOS>BOND
1	1	2	1
2	2	3	1
3	3	4	1
4	3	5	1
5	5	6	2
6	5	7	1
7	1	8	1
8	2	9	1
9	2	10	1
10	3	11	1
11	4	12	1
12	4	13	1
13	7	14	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1
