B8LC1Y
-OEChem-04012116152D
47 49 0 1 0 0 0 0 0999 V2000
2.0000 -0.4196 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 1.5804 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
10.7340 1.5429 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
11.5865 -1.9604 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.3981 0.0596 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0
10.7224 -1.4571 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.3981 1.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4920 -0.4542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4920 1.6151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.0804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 1.0804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2622 -0.4437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -0.4196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 1.5804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1301 0.0529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.0804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 1.0804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9942 -0.4504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1340 1.0529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.8622 0.0462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.0019 1.5496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.8660 1.0462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.4196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 2.5804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.7263 -0.4571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0089 0.9951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6071 1.6849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0874 -0.9240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8856 -0.9333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8856 2.0941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0874 2.0849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8618 -0.9171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.6589 -0.9202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -1.0396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 2.2004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9918 -1.0704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5982 1.3650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.0043 2.1696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3800 -1.4196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.0396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6200 -1.4196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6200 2.5804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 3.2004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3800 2.5804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.2644 -0.1492 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.7364 2.1629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.5841 -2.5804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 16 1 0 0 0 0
1 23 1 0 0 0 0
2 17 1 0 0 0 0
2 24 1 0 0 0 0
3 22 1 0 0 0 0
3 46 1 0 0 0 0
4 6 1 0 0 0 0
4 47 1 0 0 0 0
5 7 1 0 0 0 0
5 8 1 0 0 0 0
5 12 1 0 0 0 0
6 25 2 0 0 0 0
7 9 1 0 0 0 0
7 26 1 0 0 0 0
7 27 1 0 0 0 0
8 10 1 0 0 0 0
8 28 1 0 0 0 0
8 29 1 0 0 0 0
9 11 1 0 0 0 0
9 30 1 0 0 0 0
9 31 1 0 0 0 0
10 11 1 0 0 0 0
10 13 2 0 0 0 0
11 14 2 0 0 0 0
12 15 1 0 0 0 0
12 32 1 0 0 0 0
12 33 1 0 0 0 0
13 16 1 0 0 0 0
13 34 1 0 0 0 0
14 17 1 0 0 0 0
14 35 1 0 0 0 0
15 18 2 0 0 0 0
15 19 1 0 0 0 0
16 17 2 0 0 0 0
18 20 1 0 0 0 0
18 36 1 0 0 0 0
19 21 2 0 0 0 0
19 37 1 0 0 0 0
20 22 2 0 0 0 0
20 25 1 0 0 0 0
21 22 1 0 0 0 0
21 38 1 0 0 0 0
23 39 1 0 0 0 0
23 40 1 0 0 0 0
23 41 1 0 0 0 0
24 42 1 0 0 0 0
24 43 1 0 0 0 0
24 44 1 0 0 0 0
25 45 1 0 0 0 0
M END
$$$$