@<TRIPOS>MOLECULE
DB02856
16 15 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     1.5326    -0.7170     0.5108	O.2	1	noname	-0.2537
2	C1     1.8691    -0.0801    -0.5108	C.2	1	noname	0.0460
3	O2     2.0849    -0.7330    -1.6726	O.3	1	noname	-0.2016
4	N1     2.0155     1.2506    -0.4528	N.3	1	noname	-0.0406
5	C2     2.4672    -0.0096    -2.8331	C.3	1	noname	0.0549
6	C3     1.2429     2.0061     0.4528	C.3	1	noname	-0.0066
7	C4     2.6466    -0.9796    -4.0027	C.3	1	noname	-0.0409
8	H1     2.6900     1.6727    -1.0749	H	1	noname	0.1331
9	H2     1.6233     0.6416    -3.0610	H	1	noname	0.0570
10	H3     3.4407     0.4215    -2.5996	H	1	noname	0.0570
11	H4     1.5157     1.7393     1.4739	H	1	noname	0.0397
12	H5     1.4300     3.0678     0.2924	H	1	noname	0.0397
13	H6     0.1856     1.7952     0.2924	H	1	noname	0.0397
14	H7     2.5904    -2.0047    -3.6364	H	1	noname	0.0254
15	H8     1.8589    -0.8125    -4.7374	H	1	noname	0.0254
16	H9     3.6183    -0.8125    -4.4674	H	1	noname	0.0254
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	2	4	1
4	3	5	1
5	4	6	1
6	5	7	1
7	4	8	1
8	5	9	1
9	5	10	1
10	6	11	1
11	6	12	1
12	6	13	1
13	7	14	1
14	7	15	1
15	7	16	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1
