@<TRIPOS>MOLECULE
118796495
13 13 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	S1     2.1565    -1.5708    -0.0000	S.2	1	noname	-0.1151
2	O1    -0.6772    -1.1226    -0.0000	O.3	1	noname	-0.3075
3	N1    -0.0202    -0.0009    -0.0000	N.3	1	noname	0.0305
4	C1     1.3599    -0.0690    -0.0000	C.2	1	noname	0.0255
5	C2    -0.7551     1.1703    -0.0000	C.2	1	noname	-0.0574
6	C3     2.1062     1.1593     0.0000	C.2	1	noname	-0.0048
7	C4    -0.0555     2.4229     0.0000	C.2	1	noname	-0.0416
8	C5     1.3738     2.3813     0.0000	C.2	1	noname	-0.0369
9	H1    -1.7748     1.1443    -0.0000	H	1	noname	0.0781
10	H2     3.1262     1.1562     0.0000	H	1	noname	0.0649
11	H3    -0.5589     3.3100     0.0000	H	1	noname	0.0633
12	H4     1.8894     3.2614     0.0000	H	1	noname	0.0623
13	H5    -1.6396    -0.9375    -0.0000	H	1	noname	0.2387
@<TRIPOS>BOND
1	1	4	2
2	2	3	1
3	2	13	1
4	3	4	1
5	3	5	1
6	4	6	1
7	5	7	2
8	5	9	1
9	6	8	2
10	6	10	1
11	7	8	1
12	7	11	1
13	8	12	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1