B7IZV6
-OEChem-04012115212D
45 45 0 1 0 0 0 0 0999 V2000
6.3301 0.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -1.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 4.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 4.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -0.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 2.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.7500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
3.7320 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -5.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 5.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 0.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 0.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3520 2.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 2.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1120 2.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5560 1.2869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3291 0.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1760 0.2131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -0.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9272 2.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5422 2.1674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9407 2.8577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6540 -1.6674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2554 -2.3577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -3.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -3.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -5.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -5.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -5.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.8162 5.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 5.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5762 5.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 12 2 0 0 0 0
2 13 1 0 0 0 0
2 15 1 0 0 0 0
3 13 2 0 0 0 0
4 17 1 0 0 0 0
4 23 1 0 0 0 0
5 17 2 0 0 0 0
9 6 1 1 0 0 0
6 13 1 0 0 0 0
6 32 1 0 0 0 0
7 12 1 0 0 0 0
7 14 1 0 0 0 0
7 33 1 0 0 0 0
8 9 1 0 0 0 0
8 10 1 0 0 0 0
8 11 1 0 0 0 0
8 24 1 0 0 0 0
9 12 1 0 0 0 0
9 25 1 0 0 0 0
10 26 1 0 0 0 0
10 27 1 0 0 0 0
10 28 1 0 0 0 0
11 29 1 0 0 0 0
11 30 1 0 0 0 0
11 31 1 0 0 0 0
14 17 1 0 0 0 0
14 34 1 0 0 0 0
14 35 1 0 0 0 0
15 16 1 0 0 0 0
15 36 1 0 0 0 0
15 37 1 0 0 0 0
16 18 2 0 0 0 0
16 19 1 0 0 0 0
18 20 1 0 0 0 0
18 38 1 0 0 0 0
19 21 2 0 0 0 0
19 39 1 0 0 0 0
20 22 2 0 0 0 0
20 40 1 0 0 0 0
21 22 1 0 0 0 0
21 41 1 0 0 0 0
22 42 1 0 0 0 0
23 43 1 0 0 0 0
23 44 1 0 0 0 0
23 45 1 0 0 0 0
M END
$$$$