@<TRIPOS>MOLECULE
DB02085
14 14 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -1.3389    -1.0282    -1.5423	O.2	1	noname	-0.2484
2	C1    -0.2028    -0.5498    -1.3351	C.2	1	noname	0.1453
3	O2     0.6843    -0.4541    -2.3482	O.3	1	noname	-0.2131
4	C2     0.1647    -0.0944     0.0025	C.3	1	noname	0.1026
5	N1    -0.7494    -0.1889     1.1395	N.3	1	noname	-0.3168
6	C3     0.5139     1.3945    -0.0437	C.3	1	noname	-0.0231
7	C4     1.6292     0.3482     0.0061	C.3	1	noname	-0.0231
8	H1     0.9368    -1.3343    -2.6366	H	1	noname	0.2213
9	H2    -0.3835    -0.2215     2.0804	H	1	noname	0.1194
10	H3    -1.7469    -0.2215     0.9843	H	1	noname	0.1194
11	H4     0.3684     1.8838    -1.0067	H	1	noname	0.0291
12	H5     0.3444     1.9479     0.8800	H	1	noname	0.0291
13	H6     2.1478     0.2562     0.9604	H	1	noname	0.0291
14	H7     2.1718     0.1921    -0.9263	H	1	noname	0.0291
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	2	4	1
4	4	5	1
5	4	6	1
6	4	7	1
7	6	7	1
8	3	8	1
9	5	9	1
10	5	10	1
11	6	11	1
12	6	12	1
13	7	13	1
14	7	14	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1