@<TRIPOS>MOLECULE
DB01808
17 16 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	As1     2.7829    -1.6860     1.0296	As	1	noname	0.0666
2	S1     1.4937     0.1300     0.7891	S.3	1	noname	-0.1123
3	O1     3.9097    -1.8457    -0.4416	O.3	1	noname	-0.3147
4	C1     0.5069    -0.0287    -0.7079	C.3	1	noname	0.0194
5	C2    -0.3736     1.2117    -0.8721	C.3	1	noname	0.1003
6	N1    -1.1751     1.0828    -2.0880	N.3	1	noname	-0.3187
7	C3     0.4709     2.3986    -0.9695	C.2	1	noname	0.1441
8	O2     0.3583     3.3165    -0.1284	O.2	1	noname	-0.2494
9	O3     1.3734     2.5049    -1.9678	O.3	1	noname	-0.2138
10	H1     2.8850    -2.7266     2.1051	H	1	noname	0.0750
11	H2     4.0562    -2.7749    -0.6330	H	1	noname	0.2054
12	H3     1.1616    -0.0024    -1.5790	H	1	noname	0.0401
13	H4    -0.2075    -0.8431    -0.5874	H	1	noname	0.0401
14	H5    -1.0514     1.3454    -0.0290	H	1	noname	0.0580
15	H6    -2.1823     1.0382    -2.0267	H	1	noname	0.1192
16	H7    -0.7217     1.0382    -2.9894	H	1	noname	0.1192
17	H8     1.6351     1.6278    -2.2573	H	1	noname	0.2213
@<TRIPOS>BOND
1	1	2	1
2	1	3	1
3	2	4	1
4	4	5	1
5	5	6	1
6	5	7	1
7	7	8	2
8	7	9	1
9	1	10	1
10	3	11	1
11	4	12	1
12	4	13	1
13	5	14	1
14	6	15	1
15	6	16	1
16	9	17	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1
