@<TRIPOS>MOLECULE
91618135
26 26 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	As1     2.7549     3.1670    -1.8253	As	1	noname	0.1810
2	O1     1.8672     3.3875    -3.4449	O.3	1	noname	-0.2384
3	O2     2.8087     4.7919    -0.9216	O.3	1	noname	-0.2384
4	O3     4.3966     2.6091    -2.1274	O.2	1	noname	-0.2959
5	O4    -3.0694    -1.3636     3.0182	O.2	1	noname	-0.2935
6	N1    -0.1612    -0.8968     1.5246	N.3	1	noname	-0.1368
7	N2    -1.1544    -1.9922     4.0034	N.3	1	noname	-0.0862
8	C1     0.4879     0.0078     0.7789	C.2	1	noname	-0.0156
9	C2     1.8345     1.8844    -0.7681	C.2	1	noname	-0.0357
10	C3     1.6401     0.6129     1.2671	C.2	1	noname	-0.0518
11	C4     0.0090     0.3410    -0.4827	C.2	1	noname	-0.0518
12	C5     2.3134     1.5513     0.4936	C.2	1	noname	-0.0125
13	C6     0.6823     1.2793    -1.2562	C.2	1	noname	-0.0125
14	C7    -1.1247    -0.2448     2.3214	C.3	1	noname	0.0737
15	C8    -1.8319    -1.2304     3.1338	C.2	1	noname	0.0397
16	H1     1.9915     0.3684     2.1929	H	1	noname	0.0639
17	H2    -0.8365    -0.1031    -0.8409	H	1	noname	0.0639
18	H3     3.1590     1.9953     0.8518	H	1	noname	0.0631
19	H4     0.3309     1.5238    -2.1820	H	1	noname	0.0631
20	H5    -0.6013    -1.5379     0.9448	H	1	noname	0.1286
21	H6    -1.8360     0.2745     1.6792	H	1	noname	0.0528
22	H7    -0.6301     0.4756     2.9729	H	1	noname	0.0528
23	H8     2.3419     4.0491    -3.9902	H	1	noname	0.2162
24	H9    -0.1941    -1.8889     4.0932	H	1	noname	0.1271
25	H10    -1.6243    -2.6470     4.5432	H	1	noname	0.1271
26	H11     1.8946     5.1025    -0.7534	H	1	noname	0.2162
@<TRIPOS>BOND
1	1	2	1
2	1	3	1
3	1	4	2
4	1	9	1
5	2	23	1
6	3	26	1
7	5	15	2
8	6	8	1
9	6	14	1
10	6	20	1
11	7	15	1
12	7	24	1
13	7	25	1
14	8	10	2
15	8	11	1
16	9	12	2
17	9	13	1
18	10	12	1
19	10	16	1
20	11	13	2
21	11	17	1
22	12	18	1
23	13	19	1
24	14	15	1
25	14	21	1
26	14	22	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1