BO47VL
-OEChem-04042103533D
43 46 0 0 0 0 0 0 0999 V2000
-3.7923 -4.3328 -1.8913 Br 0 0 0 0 0 0 0 0 0 0 0 0
0.1548 3.4650 -0.5429 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4778 -2.7259 0.7216 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.5663 0.7178 0.3832 O 0 0 0 0 0 0 0 0 0 0 0 0
6.7119 0.5613 -0.2862 O 0 5 0 0 0 0 0 0 0 0 0 0
6.1575 -1.5084 0.1909 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2449 -1.1594 0.4819 N 0 0 0 0 0 0 0 0 0 0 0 0
5.8475 -0.3164 -0.0483 N 0 3 0 0 0 0 0 0 0 0 0 0
-0.5871 0.1591 0.2165 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3443 1.0977 -0.0399 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9210 0.7738 0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7641 0.7837 -0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7619 2.1260 -0.1425 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2621 -2.1642 0.7580 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1434 -0.5413 0.2112 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3381 2.3884 -0.2808 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1063 -1.5754 0.4942 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9549 -2.6525 -0.5097 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2131 0.2999 0.3373 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7598 1.7327 -0.3144 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8056 3.0261 -0.2779 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4968 -0.9056 0.2122 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2964 1.1830 0.2079 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4756 0.0508 -0.0497 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0942 2.5362 -0.0974 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1079 1.3672 -0.3123 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9990 -3.7200 -0.2207 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.7107 -0.6666 0.6920 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9481 -1.7930 1.5244 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7866 -3.0323 1.2319 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1901 -3.0742 -1.1771 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3985 -1.8330 -1.0830 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3720 -0.7321 0.5906 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5150 2.7693 -0.5239 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6343 4.0698 -0.5142 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7721 -1.9370 0.4188 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.9439 3.2068 -0.1938 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8435 2.1401 -0.5207 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5618 -4.6009 0.2571 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8169 -3.3380 0.3953 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.7831 -0.8616 0.7981 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.2484 -0.9193 1.6523 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.3552 -1.3014 -0.1267 H 0 0 0 0 0 0 0 0 0 0 0 0
1 27 1 0 0 0 0
2 16 2 0 0 0 0
3 17 2 0 0 0 0
4 23 1 0 0 0 0
4 28 1 0 0 0 0
5 8 1 0 0 0 0
6 8 2 0 0 0 0
7 9 1 0 0 0 0
7 14 1 0 0 0 0
7 17 1 0 0 0 0
8 24 1 0 0 0 0
9 10 2 0 0 0 0
9 11 1 0 0 0 0
10 12 1 0 0 0 0
10 16 1 0 0 0 0
11 13 2 0 0 0 0
11 19 1 0 0 0 0
12 15 2 0 0 0 0
12 20 1 0 0 0 0
13 16 1 0 0 0 0
13 21 1 0 0 0 0
14 18 1 0 0 0 0
14 29 1 0 0 0 0
14 30 1 0 0 0 0
15 17 1 0 0 0 0
15 22 1 0 0 0 0
18 27 1 0 0 0 0
18 31 1 0 0 0 0
18 32 1 0 0 0 0
19 23 2 0 0 0 0
19 33 1 0 0 0 0
20 26 2 0 0 0 0
20 34 1 0 0 0 0
21 25 2 0 0 0 0
21 35 1 0 0 0 0
22 24 2 0 0 0 0
22 36 1 0 0 0 0
23 25 1 0 0 0 0
24 26 1 0 0 0 0
25 37 1 0 0 0 0
26 38 1 0 0 0 0
27 39 1 0 0 0 0
27 40 1 0 0 0 0
28 41 1 0 0 0 0
28 42 1 0 0 0 0
28 43 1 0 0 0 0
M CHG 2 5 -1 8 1
M END
$$$$