@<TRIPOS>MOLECULE
67521674
19 19 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -1.7957     3.6542    -0.0492	O.2	1	noname	-0.2969
2	N1    -0.1207    -0.1162     0.3121	N.2	1	noname	-0.2525
3	C1     0.0329     2.2801    -0.0442	C.2	1	noname	0.0017
4	C2     1.2470    -0.3038     0.1965	C.2	1	noname	0.0149
5	C3     1.4487     2.1151    -0.1681	C.2	1	noname	-0.0043
6	C4     2.0817     0.8373    -0.0524	C.2	1	noname	-0.0227
7	C5    -0.7589     1.1088     0.2045	C.2	1	noname	0.0330
8	C6    -0.5566     3.5335    -0.1610	C.2	1	noname	0.0999
9	C7     1.8285    -1.6369     0.3254	C.3	1	noname	0.0333
10	C8     0.2715     4.7090    -0.4141	C.3	1	noname	-0.0009
11	H1     2.0266     2.9368    -0.3449	H	1	noname	0.0631
12	H2     3.0930     0.7403    -0.1438	H	1	noname	0.0641
13	H3    -1.7721     1.1771     0.3002	H	1	noname	0.0847
14	H4     1.4136    -2.2900    -0.4423	H	1	noname	0.0295
15	H5     1.5959    -2.0410     1.3107	H	1	noname	0.0295
16	H6     2.9099    -1.5748     0.2041	H	1	noname	0.0295
17	H7     0.1489     5.4222     0.4010	H	1	noname	0.0313
18	H8    -0.0335     5.1732    -1.3520	H	1	noname	0.0313
19	H9     1.3174     4.4092    -0.4803	H	1	noname	0.0313
@<TRIPOS>BOND
1	1	8	2
2	2	4	2
3	2	7	1
4	3	5	1
5	3	7	2
6	3	8	1
7	4	6	1
8	4	9	1
9	5	6	2
10	5	11	1
11	6	12	1
12	7	13	1
13	8	10	1
14	9	14	1
15	9	15	1
16	9	16	1
17	10	17	1
18	10	18	1
19	10	19	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1