@<TRIPOS>MOLECULE
DB04538
19 18 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     1.6815    -2.4823    -0.2006	O.2	1	noname	-0.2494
2	C1     1.7592    -1.2534    -0.4159	C.2	1	noname	0.1441
3	O2     2.4454    -0.7976    -1.4854	O.3	1	noname	-0.2138
4	C2     1.1078    -0.3111     0.4892	C.3	1	noname	0.1032
5	N1     2.1107     0.5818     1.0675	N.3	1	noname	-0.3187
6	C3     0.0783     0.5128    -0.2868	C.3	1	noname	0.0667
7	C4    -0.5731     1.4552     0.6184	C.2	1	noname	0.1373
8	C5     0.7809     1.2836    -1.4062	C.3	1	noname	-0.0511
9	O3    -1.8104     1.4044     0.7890	O.2	1	noname	-0.2542
10	O4     0.1608     2.3814     1.2710	O.3	1	noname	-0.2175
11	H1     2.7731    -1.5415    -1.9961	H	1	noname	0.2213
12	H2     0.6493    -0.8793     1.2985	H	1	noname	0.0580
13	H3     3.0388     0.2369     1.2672	H	1	noname	0.1192
14	H4     1.8755     1.5435     1.2672	H	1	noname	0.1192
15	H5    -0.7029    -0.1299    -0.6928	H	1	noname	0.0427
16	H6     1.2230     0.5789    -2.1105	H	1	noname	0.0239
17	H7     0.0564     1.9105    -1.9259	H	1	noname	0.0239
18	H8     1.5640     1.9105    -0.9796	H	1	noname	0.0239
19	H9     0.0630     2.2580     2.2180	H	1	noname	0.2213
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	2	4	1
4	4	5	1
5	4	6	1
6	6	7	1
7	6	8	1
8	7	9	2
9	7	10	1
10	3	11	1
11	4	12	1
12	5	13	1
13	5	14	1
14	6	15	1
15	8	16	1
16	8	17	1
17	8	18	1
18	10	19	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1