@<TRIPOS>MOLECULE
DB02105
18 18 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -2.1425    -1.1860    -1.0927	O.2	1	noname	-0.1415
2	N1    -1.7647    -0.1137    -1.3471	N.2	1	noname	-0.0001
3	O2    -2.2135     0.4905    -2.3638	O.3	1	noname	-0.1415
4	C1    -0.8784     0.4641    -0.5831	C.2	1	noname	0.0904
5	C2     0.0535    -0.3046     0.1044	C.2	1	noname	0.1300
6	C3    -0.8664     1.8483    -0.4568	C.2	1	noname	0.1027
7	O3     0.0419    -1.6490    -0.0183	O.3	1	noname	-0.2561
8	C4     0.9975     0.3109     0.9181	C.2	1	noname	0.0747
9	C5     0.0776     2.4638     0.3570	C.2	1	noname	0.0531
10	O4     1.9027    -0.4357     1.5858	O.3	1	noname	-0.2709
11	C6     1.0095     1.6951     1.0444	C.2	1	noname	0.0903
12	N2     0.0888     3.7634     0.4755	N.2	1	noname	-0.0134
13	O5    -0.2708     4.4320    -0.4081	O.2	1	noname	-0.1444
14	O6     0.4903     4.2970     1.5499	O.3	1	noname	-0.1444
15	H1    -1.5973     2.4511    -0.9959	H	1	noname	0.0672
16	H2     0.0384    -2.0499     0.8540	H	1	noname	0.2183
17	H3     1.7719    -0.3278     2.5307	H	1	noname	0.2183
18	H4     1.7498     2.1777     1.6825	H	1	noname	0.0675
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	2	4	1
4	4	5	2
5	4	6	1
6	5	7	1
7	5	8	1
8	6	9	2
9	8	10	1
10	8	11	2
11	9	12	1
12	9	11	1
13	12	13	2
14	12	14	1
15	6	15	1
16	7	16	1
17	10	17	1
18	11	18	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1
