@<TRIPOS>MOLECULE
DB03497
18 17 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	S1     2.2032    -0.9896     0.9322	S	1	noname	0.0197
2	O1     2.2699    -2.1681    -0.1330	O.2	1	noname	-0.1290
3	O2     3.6771    -0.5953     1.3795	O.2	1	noname	-0.1290
4	O3     1.4463     0.3535     0.2398	O.3	1	noname	-0.1058
5	O4     1.3223    -1.4991     2.2816	O.3	1	noname	-0.1169
6	C1     0.0471     0.2792     0.4698	C.3	1	noname	0.0971
7	C2    -0.6381     1.4952    -0.1571	C.3	1	noname	0.1168
8	N1    -2.0787     1.4187     0.0798	N.3	1	noname	-0.3174
9	C3    -0.3813     1.5113    -1.5942	C.2	1	noname	0.1449
10	O5     0.2112     2.4823    -2.1124	O.2	1	noname	-0.2488
11	O6    -0.7838     0.4775    -2.3635	O.3	1	noname	-0.2134
12	H1     1.3047    -2.4585     2.3086	H	1	noname	0.2408
13	H2    -0.2886    -0.6099    -0.0639	H	1	noname	0.0608
14	H3    -0.0737     0.3438     1.5512	H	1	noname	0.0608
15	H4    -0.2721     2.4317     0.2637	H	1	noname	0.0597
16	H5    -2.6227     2.2657     0.1616	H	1	noname	0.1192
17	H6    -2.5300     0.5188     0.1616	H	1	noname	0.1192
18	H7    -1.0664    -0.2481    -1.8020	H	1	noname	0.2213
@<TRIPOS>BOND
1	1	2	2
2	1	3	2
3	1	4	1
4	1	5	1
5	4	6	1
6	6	7	1
7	7	8	1
8	7	9	1
9	9	10	2
10	9	11	1
11	5	12	1
12	6	13	1
13	6	14	1
14	7	15	1
15	8	16	1
16	8	17	1
17	11	18	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1