B8PXB5
-OEChem-04012112112D
37 38 0 1 0 0 0 0 0999 V2000
2.8660 -3.6012 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0
7.1753 2.6307 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 2.3988 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 2.3988 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.3988 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.5116 1.9920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7026 3.3933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1808 2.7352 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
5.6808 3.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 0.8988 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
2.8660 0.3988 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
3.7320 1.8988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.8988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -1.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -2.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -2.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2016 1.4551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0132 1.6276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6378 4.0099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0826 3.3933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4029 2.1564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.2472 3.8534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4892 4.1909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 0.2788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 1.0188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3100 1.4357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 1.2088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6900 0.3618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 0.7088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -0.2212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -0.7912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -0.7912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -2.4112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -2.4112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 19 1 0 0 0 0
8 2 1 6 0 0 0
3 12 2 0 0 0 0
4 6 1 0 0 0 0
4 7 1 0 0 0 0
4 12 1 0 0 0 0
10 5 1 1 0 0 0
5 32 1 0 0 0 0
5 33 1 0 0 0 0
6 8 1 0 0 0 0
6 20 1 0 0 0 0
6 21 1 0 0 0 0
7 9 1 0 0 0 0
7 22 1 0 0 0 0
7 23 1 0 0 0 0
8 9 1 0 0 0 0
8 24 1 0 0 0 0
9 25 1 0 0 0 0
9 26 1 0 0 0 0
10 11 1 0 0 0 0
10 12 1 0 0 0 0
10 27 1 0 0 0 0
11 13 1 0 0 0 0
11 14 1 6 0 0 0
11 28 1 0 0 0 0
13 15 2 0 0 0 0
13 16 1 0 0 0 0
14 29 1 0 0 0 0
14 30 1 0 0 0 0
14 31 1 0 0 0 0
15 17 1 0 0 0 0
15 34 1 0 0 0 0
16 18 2 0 0 0 0
16 35 1 0 0 0 0
17 19 2 0 0 0 0
17 36 1 0 0 0 0
18 19 1 0 0 0 0
18 37 1 0 0 0 0
M END
$$$$