BCU94P
-OEChem-04022109163D
35 37 0 1 0 0 0 0 0999 V2000
4.2081 3.7144 -0.2883 Br 0 0 0 0 0 0 0 0 0 0 0 0
-0.3624 -0.7740 -2.0677 S 0 0 0 0 0 0 0 0 0 0 0 0
-3.2961 -0.2502 -2.5637 S 0 0 0 0 0 0 0 0 0 0 0 0
-0.5131 -0.3958 1.7959 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.6494 -2.3000 0.3219 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.3722 -0.9302 0.8612 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5424 -3.3737 0.1190 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.0939 3.4691 -0.5110 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8803 2.6055 1.2022 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9833 -0.2833 -0.1145 N 0 0 0 0 0 0 0 0 0 0 0 0
3.5487 -2.2116 0.3363 N 0 0 0 0 0 0 0 0 0 0 0 0
-3.1441 0.0167 0.7192 C 0 0 1 0 0 0 0 0 0 0 0 0
0.2490 -0.7461 -0.4434 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7220 -0.4776 0.4413 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7777 1.3527 0.3213 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6279 -0.9887 -0.1636 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6385 -0.1206 -0.0896 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0109 -0.4040 -1.5102 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8052 -0.9504 0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1774 -1.0953 0.6461 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1942 -2.3406 0.1078 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7594 1.2979 -0.2457 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8083 2.5126 0.4111 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1040 -0.2655 0.3739 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9684 1.8705 -0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1456 1.0680 0.2146 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8629 0.0902 1.7735 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5853 1.5886 1.0281 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2598 1.3487 -0.6555 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8723 1.8772 -0.4786 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9853 -0.8497 0.6064 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2674 -0.8185 2.2364 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0990 1.5773 0.3232 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3337 -3.0016 0.2818 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4702 4.2245 -0.4588 H 0 0 0 0 0 0 0 0 0 0 0 0
1 25 1 0 0 0 0
2 13 1 0 0 0 0
2 18 1 0 0 0 0
3 18 2 0 0 0 0
4 14 1 0 0 0 0
4 32 1 0 0 0 0
5 20 1 0 0 0 0
5 34 1 0 0 0 0
6 20 2 0 0 0 0
7 21 2 0 0 0 0
8 23 1 0 0 0 0
8 35 1 0 0 0 0
9 23 2 0 0 0 0
10 12 1 0 0 0 0
10 14 1 0 0 0 0
10 18 1 0 0 0 0
11 19 2 0 0 0 0
11 21 1 0 0 0 0
12 15 1 0 0 0 0
12 20 1 0 0 0 0
12 27 1 0 0 0 0
13 14 2 0 0 0 0
13 16 1 0 0 0 0
15 23 1 0 0 0 0
15 28 1 0 0 0 0
15 29 1 0 0 0 0
16 17 2 0 0 0 0
16 21 1 0 0 0 0
17 19 1 0 0 0 0
17 22 1 0 0 0 0
19 24 1 0 0 0 0
22 25 2 0 0 0 0
22 30 1 0 0 0 0
24 26 2 0 0 0 0
24 31 1 0 0 0 0
25 26 1 0 0 0 0
26 33 1 0 0 0 0
M END
$$$$