@<TRIPOS>MOLECULE
DB02693
16 16 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	S1     1.7785    -0.4885    -0.8294	S.3	1	noname	-0.0912
2	S2    -0.2924    -0.0392    -0.7343	S.3	1	noname	-0.0912
3	C1     2.5950     0.9292     0.0045	C.3	1	noname	0.0324
4	C2    -0.4226     1.0349     0.7433	C.3	1	noname	0.0324
5	C3     1.8000     2.2469    -0.1224	C.3	1	noname	0.0907
6	C4     0.4682     2.3020     0.6750	C.3	1	noname	0.0907
7	O1     1.5426     2.5142    -1.4930	O.3	1	noname	-0.3894
8	O2     0.7230     2.7729     1.9902	O.3	1	noname	-0.3894
9	H1     2.5995     0.7557     1.0806	H	1	noname	0.0416
10	H2     3.5253     1.1606    -0.5141	H	1	noname	0.0416
11	H3    -1.4281     1.4533     0.7881	H	1	noname	0.0416
12	H4    -0.0146     0.5036     1.6032	H	1	noname	0.0416
13	H5     2.4418     3.0508     0.2382	H	1	noname	0.0636
14	H6    -0.1406     3.0467     0.1623	H	1	noname	0.0636
15	H7     1.4531     1.6856    -1.9693	H	1	noname	0.2105
16	H8     0.8375     2.0251     2.5812	H	1	noname	0.2105
@<TRIPOS>BOND
1	1	2	1
2	1	3	1
3	2	4	1
4	3	5	1
5	4	6	1
6	5	7	1
7	5	6	1
8	6	8	1
9	3	9	1
10	3	10	1
11	4	11	1
12	4	12	1
13	5	13	1
14	6	14	1
15	7	15	1
16	8	16	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1