B6ODA5
-OEChem-04012119172D
42 44 0 0 0 0 0 0 0999 V2000
5.1736 2.0256 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 1.0408 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.5000 -1.8252 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.0000 1.0408 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.5000 0.1748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3660 -0.3252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6340 -0.3252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3660 -1.3252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6340 -1.3252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0000 1.0408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2660 0.8176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5000 1.9069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5000 0.1748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2057 0.4756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0924 1.8024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5000 1.9069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5000 0.1748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.9718 1.1184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8584 2.4452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7981 2.1032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.9766 -0.4329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5781 0.2574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4219 0.2574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0234 -0.4329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5781 -1.9078 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9766 -1.2175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0234 -1.2175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4219 -1.9078 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5000 -2.4452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0826 2.1189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3923 2.5174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3923 -0.4358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0826 -0.0372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3134 -0.1350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5098 2.0145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6077 2.5174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9174 2.1189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9174 -0.0372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6077 -0.4358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.5544 0.9063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7508 3.0558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.2731 2.5017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 10 2 0 0 0 0
2 16 1 0 0 0 0
2 17 1 0 0 0 0
3 8 1 0 0 0 0
3 9 1 0 0 0 0
3 29 1 0 0 0 0
4 10 1 0 0 0 0
4 12 1 0 0 0 0
4 13 1 0 0 0 0
5 6 1 0 0 0 0
5 7 1 0 0 0 0
5 10 1 0 0 0 0
5 11 1 0 0 0 0
6 8 1 0 0 0 0
6 21 1 0 0 0 0
6 22 1 0 0 0 0
7 9 1 0 0 0 0
7 23 1 0 0 0 0
7 24 1 0 0 0 0
8 25 1 0 0 0 0
8 26 1 0 0 0 0
9 27 1 0 0 0 0
9 28 1 0 0 0 0
11 14 2 0 0 0 0
11 15 1 0 0 0 0
12 16 1 0 0 0 0
12 30 1 0 0 0 0
12 31 1 0 0 0 0
13 17 1 0 0 0 0
13 32 1 0 0 0 0
13 33 1 0 0 0 0
14 18 1 0 0 0 0
14 34 1 0 0 0 0
15 19 2 0 0 0 0
15 35 1 0 0 0 0
16 36 1 0 0 0 0
16 37 1 0 0 0 0
17 38 1 0 0 0 0
17 39 1 0 0 0 0
18 20 2 0 0 0 0
18 40 1 0 0 0 0
19 20 1 0 0 0 0
19 41 1 0 0 0 0
20 42 1 0 0 0 0
M END
$$$$