@<TRIPOS>MOLECULE
DB04346
20 20 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     0.2617     0.3494     0.0700	O.3	1	noname	-0.3426
2	C1     1.5968    -0.1258     0.1306	C.3	1	noname	0.2206
3	C2    -0.2102    -0.3150    -1.0882	C.3	1	noname	0.0818
4	O2     1.5934    -1.5055     0.4662	O.3	1	noname	-0.3613
5	C3     2.1053     0.0493    -1.2993	C.3	1	noname	0.2472
6	C4     2.4500     0.6093     1.1663	C.3	1	noname	-0.0049
7	C5     0.8990    -0.2795    -2.1628	C.3	1	noname	0.1365
8	O3     2.4804     1.4032    -1.5058	O.3	1	noname	-0.3593
9	O4     3.2171    -0.7966    -1.5537	O.3	1	noname	-0.3593
10	O5     1.0569    -1.5746    -2.7231	O.3	1	noname	-0.3847
11	H1    -0.3641    -1.3511    -0.7866	H	1	noname	0.0597
12	H2    -1.0517     0.2803    -1.4424	H	1	noname	0.0597
13	H3     1.5932    -1.6026     1.4213	H	1	noname	0.2138
14	H4     2.1257     0.3299     2.1686	H	1	noname	0.0287
15	H5     3.4971     0.3367     1.0340	H	1	noname	0.0287
16	H6     2.3353     1.6852     1.0340	H	1	noname	0.0287
17	H7     0.7377     0.3546    -3.0346	H	1	noname	0.0684
18	H8     2.6001     1.8352    -0.6569	H	1	noname	0.2139
19	H9     3.5967    -1.0855    -0.7207	H	1	noname	0.2139
20	H10     1.1357    -2.2211    -2.0178	H	1	noname	0.2108
@<TRIPOS>BOND
1	1	2	1
2	1	3	1
3	2	4	1
4	2	5	1
5	2	6	1
6	3	7	1
7	5	8	1
8	5	9	1
9	5	7	1
10	7	10	1
11	3	11	1
12	3	12	1
13	4	13	1
14	6	14	1
15	6	15	1
16	6	16	1
17	7	17	1
18	8	18	1
19	9	19	1
20	10	20	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1
