BR5F4S
-OEChem-04022100592D
40 42 0 0 0 0 0 0 0999 V2000
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2.0000 -2.2094 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
2.3660 -0.8434 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
3.3660 -2.5754 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
2.9230 3.3784 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.4282 -4.0754 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
9.4282 -2.3434 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 1.2906 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -0.2094 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -1.7094 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
9.7942 -3.7094 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -1.7094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -1.2094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 -2.7094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.2906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 1.7906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 -1.2094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -2.7094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 -1.7094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 -3.2094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -1.2094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -0.2094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 2.7906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.7094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5411 3.3784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2320 4.3294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2320 4.3294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1215 1.8982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5200 1.2080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 -0.5894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7932 -3.0194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 1.6006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.5991 -1.3994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 -3.8294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1951 0.1006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1307 3.1868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5965 4.8310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.7942 -4.3294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.3312 -3.3994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8676 4.8310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 6 2 0 0 0 0
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26 27 2 0 0 0 0
26 37 1 0 0 0 0
27 40 1 0 0 0 0
M END
$$$$