@<TRIPOS>MOLECULE
DB03241
21 20 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     2.1644    -2.0389     0.9147	O.2	1	noname	-0.2997
2	C1     1.6530    -1.4681    -0.0346	C.2	1	noname	0.1345
3	C2     1.4044    -0.0612     0.0264	C.3	1	noname	0.0605
4	N1     2.1380     0.6102    -1.0453	N.3	1	noname	-0.3217
5	C3    -0.0939     0.1996    -0.1400	C.3	1	noname	-0.0311
6	C4    -0.3599     1.7049    -0.0747	C.3	1	noname	-0.0516
7	C5    -1.8583     1.9657    -0.2412	C.3	1	noname	-0.0561
8	C6    -2.1243     3.4710    -0.1759	C.3	1	noname	-0.0654
9	H1     1.4389    -2.1495    -0.8579	H	1	noname	0.1058
10	H2     1.7856     0.2892     0.9856	H	1	noname	0.0541
11	H3     1.6696     0.8421    -1.9095	H	1	noname	0.1190
12	H4     3.1132     0.8421    -0.9214	H	1	noname	0.1190
13	H5    -0.3597    -0.1235    -1.1465	H	1	noname	0.0287
14	H6    -0.5886    -0.2451     0.7235	H	1	noname	0.0287
15	H7    -0.0942     2.0280     0.9318	H	1	noname	0.0267
16	H8     0.1347     2.1496    -0.9383	H	1	noname	0.0267
17	H9    -2.1241     1.6426    -1.2477	H	1	noname	0.0264
18	H10    -2.3529     1.5211     0.6224	H	1	noname	0.0264
19	H11    -2.1798     3.7853     0.8663	H	1	noname	0.0230
20	H12    -1.3149     4.0049    -0.6737	H	1	noname	0.0230
21	H13    -3.0677     3.6952    -0.6737	H	1	noname	0.0230
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	3	4	1
4	3	5	1
5	5	6	1
6	6	7	1
7	7	8	1
8	2	9	1
9	3	10	1
10	4	11	1
11	4	12	1
12	5	13	1
13	5	14	1
14	6	15	1
15	6	16	1
16	7	17	1
17	7	18	1
18	8	19	1
19	8	20	1
20	8	21	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1
