@<TRIPOS>MOLECULE
DB01924
17 17 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -1.5102    -1.1530     0.5346	O.2	1	noname	-0.2839
2	C1    -0.9421    -1.4640    -0.5346	C.2	1	noname	0.0457
3	N1     0.1333    -2.2632    -0.5140	N.3	1	noname	0.0114
4	C2    -1.4258    -0.9806    -1.7447	C.2	1	noname	-0.0097
5	O2     0.9290    -2.2559     0.5140	O.3	1	noname	-0.3177
6	C3    -0.7940    -1.3264    -2.9336	C.2	1	noname	-0.0144
7	C4    -2.5413    -0.1516    -1.7661	C.2	1	noname	-0.0144
8	C5    -1.2777    -0.8431    -4.1438	C.2	1	noname	-0.0454
9	C6    -3.0250     0.3317    -2.9763	C.2	1	noname	-0.0454
10	C7    -2.3932    -0.0140    -4.1651	C.2	1	noname	-0.0412
11	H1     0.3472    -2.8801    -1.2846	H	1	noname	0.1644
12	H2     1.1280    -3.1592     0.7711	H	1	noname	0.2380
13	H3     0.0808    -1.9765    -2.9169	H	1	noname	0.0630
14	H4    -3.0367     0.1195    -0.8338	H	1	noname	0.0630
15	H5    -0.7822    -1.1142    -5.0761	H	1	noname	0.0622
16	H6    -3.8997     0.9818    -2.9930	H	1	noname	0.0622
17	H7    -2.7725     0.3650    -5.1141	H	1	noname	0.0622
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	2	4	1
4	3	5	1
5	4	6	2
6	4	7	1
7	6	8	1
8	7	9	2
9	8	10	2
10	9	10	1
11	3	11	1
12	5	12	1
13	6	13	1
14	7	14	1
15	8	15	1
16	9	16	1
17	10	17	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1