B7V3WA
-OEChem-04012113362D
33 35 0 1 0 0 0 0 0999 V2000
5.7253 1.9508 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
2.7443 0.2111 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.9010 1.5002 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.4391 -0.1461 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.1334 1.6184 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.3853 -1.4508 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
5.3853 -0.4508 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
4.4391 -1.7556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2514 -1.9508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8555 -0.9508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2514 0.0492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1174 -1.4508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1174 -0.4508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6948 0.5217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2353 1.0907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0274 0.0560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0354 1.0976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.8789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2954 -2.2961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2954 0.3944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9017 -2.0648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6902 -2.3225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8528 -2.4258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6499 -2.4258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3946 -0.5361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3946 -1.3656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3294 -2.0335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7280 -1.3432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.5607 -0.2602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.5735 1.4055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4141 1.3404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5385 1.2930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5859 0.4174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 15 1 0 0 0 0
2 14 1 0 0 0 0
2 18 1 0 0 0 0
3 14 2 0 0 0 0
4 7 1 0 0 0 0
4 10 1 0 0 0 0
4 14 1 0 0 0 0
5 15 2 0 0 0 0
5 17 1 0 0 0 0
6 7 1 0 0 0 0
6 8 1 0 0 0 0
6 9 1 0 0 0 0
6 19 1 6 0 0 0
7 11 1 0 0 0 0
7 20 1 6 0 0 0
8 10 1 0 0 0 0
8 21 1 0 0 0 0
8 22 1 0 0 0 0
9 12 1 0 0 0 0
9 23 1 0 0 0 0
9 24 1 0 0 0 0
10 25 1 0 0 0 0
10 26 1 0 0 0 0
11 13 2 0 0 0 0
11 15 1 0 0 0 0
12 13 1 0 0 0 0
12 27 1 0 0 0 0
12 28 1 0 0 0 0
13 16 1 0 0 0 0
16 17 2 0 0 0 0
16 29 1 0 0 0 0
17 30 1 0 0 0 0
18 31 1 0 0 0 0
18 32 1 0 0 0 0
18 33 1 0 0 0 0
M END
$$$$