@<TRIPOS>MOLECULE
DB03048
18 18 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -0.7960    -0.8908    -0.2380	O.2	1	noname	-0.2829
2	C1    -0.0624     0.1096    -0.0853	C.2	1	noname	0.0207
3	N1     1.3089     0.0120    -0.1816	N.3	1	noname	0.0768
4	N2    -0.5944     1.3516     0.1858	N.3	1	noname	0.0217
5	C2     2.1387     1.1023    -0.0169	C.2	1	noname	0.0617
6	C3     0.1954     2.4701     0.3582	C.2	1	noname	-0.0423
7	O2     3.3753     0.9493    -0.1164	O.2	1	noname	-0.2899
8	C4     1.6171     2.3999     0.2643	C.2	1	noname	0.0424
9	C5    -0.4383     3.7541     0.6431	C.3	1	noname	0.0692
10	C6    -1.3344     4.1086    -0.4537	C.2	1	noname	0.1376
11	O3    -1.1456     5.1622    -1.0994	O.2	1	noname	-0.2540
12	O4    -2.3668     3.2986    -0.7706	O.3	1	noname	-0.2174
13	H1     1.7195    -0.8892    -0.3797	H	1	noname	0.1417
14	H2    -1.5973     1.4453     0.2606	H	1	noname	0.1381
15	H3     2.2569     3.2723     0.3975	H	1	noname	0.0688
16	H4    -1.0625     3.6082     1.5247	H	1	noname	0.0433
17	H5     0.3555     4.5011     0.6549	H	1	noname	0.0433
18	H6    -2.7786     2.9754     0.0342	H	1	noname	0.2213
@<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	2
7	5	8	1
8	6	9	1
9	6	8	2
10	9	10	1
11	10	11	2
12	10	12	1
13	3	13	1
14	4	14	1
15	8	15	1
16	9	16	1
17	9	17	1
18	12	18	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1