@<TRIPOS>MOLECULE
92135711
20 20 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	S1    -0.8093    -0.7209    -0.7568	S	1	noname	-0.0394
2	O1     2.0492    -1.4382    -0.6679	O.3	1	noname	-0.2705
3	O2    -1.5309    -2.2412    -0.9113	O.3	1	noname	-0.1472
4	O3    -1.9379     0.3882    -0.6017	O.2	1	noname	-0.1667
5	O4     0.0614    -0.4135    -2.0513	O.2	1	noname	-0.1667
6	C1     0.2102    -0.7057     0.6408	C.2	1	noname	0.0352
7	C2     1.8484    -0.6813     2.8867	C.2	1	noname	-0.0132
8	C3     1.5467    -1.0713     0.5302	C.2	1	noname	0.0712
9	C4     2.3658    -1.0591     1.6531	C.2	1	noname	-0.0139
10	C5    -0.3072    -0.3279     1.8743	C.2	1	noname	0.0269
11	C6     0.5119    -0.3157     2.9973	C.2	1	noname	-0.0534
12	C7     2.7088    -0.6685     4.0662	C.3	1	noname	0.0050
13	H1     3.3465    -1.3274     1.5720	H	1	noname	0.0653
14	H2    -1.2879    -0.0596     1.9555	H	1	noname	0.0640
15	H3     0.1323    -0.0384     3.9025	H	1	noname	0.0625
16	H4     2.3096    -1.3531     4.8146	H	1	noname	0.0279
17	H5     2.7449     0.3398     4.4786	H	1	noname	0.0279
18	H6     3.7142    -0.9826     3.7860	H	1	noname	0.0279
19	H7     2.9980    -1.6626    -0.5693	H	1	noname	0.2182
20	H8    -0.8350    -2.9289    -0.9680	H	1	noname	0.2388
@<TRIPOS>BOND
1	1	3	1
2	1	4	2
3	1	5	2
4	1	6	1
5	2	8	1
6	2	19	1
7	3	20	1
8	6	8	2
9	6	10	1
10	7	9	2
11	7	11	1
12	7	12	1
13	8	9	1
14	9	13	1
15	10	11	2
16	10	14	1
17	11	15	1
18	12	16	1
19	12	17	1
20	12	18	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1