@<TRIPOS>MOLECULE
109374148
16 15 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	S1     2.0240    -0.3127     0.6100	S.3	1	noname	-0.0829
2	S2     0.0504     0.3118     0.6091	S.3	1	noname	-0.0829
3	O1     4.2010    -2.5021    -1.8724	O.3	1	noname	-0.2159
4	O2    -2.1230     2.5052    -1.8729	O.3	1	noname	-0.2159
5	O3     4.4916    -1.4152     0.0786	O.2	1	noname	-0.2520
6	O4    -2.4164     1.4152     0.0760	O.2	1	noname	-0.2520
7	C1    -0.2646     1.3030    -0.8600	C.3	1	noname	0.0898
8	C2     2.3411    -1.3015    -0.8603	C.3	1	noname	0.0898
9	C3    -1.6566     1.7434    -0.8607	C.2	1	noname	0.1404
10	C4     3.7331    -1.7419    -0.8597	C.2	1	noname	0.1404
11	H1    -0.0726     0.7042    -1.7504	H	1	noname	0.0496
12	H2     0.3918     2.1732    -0.8589	H	1	noname	0.0496
13	H3     1.6847    -2.1716    -0.8615	H	1	noname	0.0496
14	H4     2.1503    -0.7013    -1.7499	H	1	noname	0.0496
15	H5     4.9219    -3.1456    -1.7095	H	1	noname	0.2213
16	H6    -3.0656     2.4481    -2.1350	H	1	noname	0.2213
@<TRIPOS>BOND
1	1	2	1
2	1	8	1
3	2	7	1
4	3	10	1
5	3	15	1
6	4	9	1
7	4	16	1
8	5	10	2
9	6	9	2
10	7	9	1
11	7	11	1
12	7	12	1
13	8	10	1
14	8	13	1
15	8	14	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1