@<TRIPOS>MOLECULE
DB02022
19 19 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -1.8918    -0.8024    -0.4171	O.3	1	noname	-0.3914
2	C1    -0.8471    -1.4348     0.3074	C.3	1	noname	0.0729
3	C2     0.2142    -0.4684     0.5747	C.2	1	noname	-0.0034
4	C3     0.9214     0.2043    -0.4650	C.2	1	noname	0.0472
5	C4     0.6249    -0.1230     1.8959	C.2	1	noname	0.0185
6	N1     1.9166     1.1100    -0.1896	N.2	1	noname	-0.2448
7	N2     0.6073    -0.0535    -1.7419	N.3	1	noname	-0.1133
8	N3     1.6261     0.7893     2.1233	N.2	1	noname	-0.2682
9	C5     2.2970     1.4284     1.0993	C.2	1	noname	0.0528
10	C6     3.3582     2.3948     1.3665	C.3	1	noname	0.0664
11	H1    -2.5223    -0.4206     0.1980	H	1	noname	0.2105
12	H2    -1.2723    -1.7223     1.2690	H	1	noname	0.0616
13	H3    -0.4327    -2.1953    -0.3545	H	1	noname	0.0616
14	H4     0.1538    -0.5754     2.7686	H	1	noname	0.0844
15	H5    -0.3604    -0.1507    -2.0142	H	1	noname	0.1258
16	H6     1.3383    -0.1507    -2.4320	H	1	noname	0.1258
17	H7     3.4832     2.5086     2.4433	H	1	noname	0.0312
18	H8     4.2911     2.0406     0.9279	H	1	noname	0.0312
19	H9     3.0926     3.3566     0.9279	H	1	noname	0.0312
@<TRIPOS>BOND
1	1	2	1
2	2	3	1
3	3	4	2
4	3	5	1
5	4	6	1
6	4	7	1
7	5	8	2
8	6	9	2
9	8	9	1
10	9	10	1
11	1	11	1
12	2	12	1
13	2	13	1
14	5	14	1
15	7	15	1
16	7	16	1
17	10	17	1
18	10	18	1
19	10	19	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1