BXP65Y
-OEChem-04012113292D
43 45 0 1 0 0 0 0 0999 V2000
10.7404 2.0547 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 1.7500 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
13.3241 1.2500 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
12.3241 2.2500 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
12.3241 0.2500 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -2.2500 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 -0.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 0.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
10.7404 0.4453 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -0.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 0.2500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
6.3301 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.7942 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.7942 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.3241 1.2500 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
3.7320 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.3241 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.8501 2.3326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4516 1.6423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.5297 -0.2249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.3267 -0.2249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.3267 2.7250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.5297 2.7250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -0.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7287 1.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9316 1.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9966 1.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1996 1.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -1.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9272 -1.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -1.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 0.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -1.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 17 1 0 0 0 0
1 21 1 0 0 0 0
2 22 1 0 0 0 0
3 24 1 0 0 0 0
4 24 1 0 0 0 0
5 24 1 0 0 0 0
6 25 1 0 0 0 0
7 18 2 0 0 0 0
8 11 1 0 0 0 0
8 12 1 0 0 0 0
8 18 1 0 0 0 0
9 16 1 0 0 0 0
9 21 2 0 0 0 0
14 10 1 6 0 0 0
10 39 1 0 0 0 0
10 40 1 0 0 0 0
11 13 1 0 0 0 0
11 28 1 0 0 0 0
11 29 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 15 1 0 0 0 0
14 19 1 0 0 0 0
14 34 1 0 0 0 0
15 18 1 0 0 0 0
15 35 1 0 0 0 0
15 36 1 0 0 0 0
16 17 2 0 0 0 0
19 20 1 0 0 0 0
19 37 1 0 0 0 0
19 38 1 0 0 0 0
20 22 2 0 0 0 0
20 23 1 0 0 0 0
21 24 1 0 0 0 0
22 26 1 0 0 0 0
23 25 2 0 0 0 0
23 41 1 0 0 0 0
25 27 1 0 0 0 0
26 27 2 0 0 0 0
26 42 1 0 0 0 0
27 43 1 0 0 0 0
M END
$$$$