BR5F4S
-OEChem-04022114063D
40 42 0 0 0 0 0 0 0999 V2000
-6.1020 1.6065 -0.1006 S 0 0 0 0 0 0 0 0 0 0 0 0
2.4043 -4.1439 0.1417 F 0 0 0 0 0 0 0 0 0 0 0 0
0.5476 -4.3523 1.2539 F 0 0 0 0 0 0 0 0 0 0 0 0
0.5296 -4.4651 -0.9119 F 0 0 0 0 0 0 0 0 0 0 0 0
5.0154 2.3638 0.8869 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.0398 3.0600 -0.0401 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.8290 0.9582 -1.1829 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8294 0.7557 -0.1160 N 0 0 0 0 0 0 0 0 0 0 0 0
0.4778 0.3845 -0.0806 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.3794 -1.8642 0.0450 N 0 0 0 0 0 0 0 0 0 0 0 0
-6.6961 1.0175 1.3893 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.8647 -0.0106 -0.0422 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5129 -0.5260 -0.0244 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4709 0.9838 -0.0781 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7251 -0.1296 -0.0633 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1823 0.3021 -0.0998 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8933 -0.7699 -0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1393 1.2458 0.4979 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1964 -0.2728 -0.6180 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4424 1.7431 0.4798 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8943 -2.3094 0.0584 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9965 -1.4808 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1299 1.4692 -0.1297 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0872 -3.7867 0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1298 1.8470 -0.9955 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6641 3.0508 -0.4776 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9524 3.3231 0.6678 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3928 -0.3330 -0.9689 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3983 -0.2698 0.8111 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7098 -1.7490 -1.0360 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3614 1.8566 0.9497 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6104 1.7443 -0.1677 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.9828 -0.8827 -1.0534 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6351 2.7203 0.9136 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9945 -1.8975 0.0191 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4370 1.3221 -1.8888 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4672 3.6458 -0.8876 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.8537 1.6983 2.1424 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.3913 0.2617 1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9886 4.1168 1.3995 H 0 0 0 0 0 0 0 0 0 0 0 0
1 6 2 0 0 0 0
1 7 2 0 0 0 0
1 11 1 0 0 0 0
1 14 1 0 0 0 0
2 24 1 0 0 0 0
3 24 1 0 0 0 0
4 24 1 0 0 0 0
5 23 1 0 0 0 0
5 27 1 0 0 0 0
8 15 1 0 0 0 0
8 16 1 0 0 0 0
8 32 1 0 0 0 0
9 13 1 0 0 0 0
9 15 2 0 0 0 0
10 13 2 0 0 0 0
10 21 1 0 0 0 0
11 38 1 0 0 0 0
11 39 1 0 0 0 0
12 13 1 0 0 0 0
12 17 2 0 0 0 0
12 18 1 0 0 0 0
14 19 2 0 0 0 0
14 20 1 0 0 0 0
15 22 1 0 0 0 0
16 23 1 0 0 0 0
16 28 1 0 0 0 0
16 29 1 0 0 0 0
17 19 1 0 0 0 0
17 30 1 0 0 0 0
18 20 2 0 0 0 0
18 31 1 0 0 0 0
19 33 1 0 0 0 0
20 34 1 0 0 0 0
21 22 2 0 0 0 0
21 24 1 0 0 0 0
22 35 1 0 0 0 0
23 25 2 0 0 0 0
25 26 1 0 0 0 0
25 36 1 0 0 0 0
26 27 2 0 0 0 0
26 37 1 0 0 0 0
27 40 1 0 0 0 0
M END
$$$$