D06EMC
-OEChem-10101305022D
40 41 0 1 0 0 0 0 0999 V2000
2.0000 -1.2702 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -3.2702 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.2298 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.2298 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.0981 2.7686 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 1.2298 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
3.7891 1.8176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4071 1.8176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0981 2.7686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -0.2702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 0.2298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -0.2702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 -0.2702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 1.2298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -1.2702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.7702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -1.7702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -2.7702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -2.7702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -3.2702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1505 0.9483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2227 2.0698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4791 1.2806 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7171 1.2806 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9735 2.0698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1629 3.3852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4916 2.8975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0656 -0.7452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8626 -0.7452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4625 3.2702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 0.5398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8862 -0.8072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 -0.5802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5062 0.2667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9501 1.2298 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 1.8498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7101 1.2298 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -1.4602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -3.0802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -3.8902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 16 1 0 0 0 0
2 18 1 0 0 0 0
3 12 2 0 0 0 0
6 4 1 1 0 0 0
4 10 1 0 0 0 0
4 12 1 0 0 0 0
5 8 1 0 0 0 0
5 9 1 0 0 0 0
5 30 1 0 0 0 0
6 7 1 0 0 0 0
6 8 1 0 0 0 0
6 21 1 0 0 0 0
7 9 1 0 0 0 0
7 22 1 0 0 0 0
7 23 1 0 0 0 0
8 24 1 0 0 0 0
8 25 1 0 0 0 0
9 26 1 0 0 0 0
9 27 1 0 0 0 0
10 11 1 0 0 0 0
10 28 1 0 0 0 0
10 29 1 0 0 0 0
11 13 1 0 0 0 0
11 14 1 0 0 0 0
11 31 1 0 0 0 0
12 15 1 0 0 0 0
13 32 1 0 0 0 0
13 33 1 0 0 0 0
13 34 1 0 0 0 0
14 35 1 0 0 0 0
14 36 1 0 0 0 0
14 37 1 0 0 0 0
15 16 2 0 0 0 0
15 17 1 0 0 0 0
16 18 1 0 0 0 0
17 19 2 0 0 0 0
17 38 1 0 0 0 0
18 20 2 0 0 0 0
19 20 1 0 0 0 0
19 39 1 0 0 0 0
20 40 1 0 0 0 0
M END
$$$$