BB4I2P
-OEChem-04022102333D
38 39 0 1 0 0 0 0 0999 V2000
4.2508 -0.7182 1.8760 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.3678 1.3536 0.3854 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2537 1.7321 1.1089 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8343 0.0094 0.0433 C 0 0 1 0 0 0 0 0 0 0 0 0
4.2505 -0.2903 0.5276 C 0 0 1 0 0 0 0 0 0 0 0 0
3.0888 0.8609 -1.1972 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9642 1.0469 0.3643 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3000 1.7213 -0.8361 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0195 -1.2416 -0.2456 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5423 -0.9502 -0.2926 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2080 -1.0397 0.8708 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0456 -0.5975 -1.4988 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1789 -0.4152 -0.3794 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5760 -0.7709 0.8272 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4137 -0.3286 -1.5425 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6416 -0.1275 -0.4265 C 0 0 1 0 0 0 0 0 0 0 0 0
-4.5275 -1.3222 -0.0186 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0376 1.0777 0.4338 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3216 0.6153 0.8046 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7299 -1.0608 -0.0876 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2259 1.4782 -1.4659 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3342 0.2348 -2.0639 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0395 0.9083 0.2099 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8539 1.6699 1.2602 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9878 1.7993 -1.6846 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9897 2.7383 -0.5712 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1969 -1.9932 0.5354 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3391 -1.7205 -1.1802 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8166 -0.0346 2.4140 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2521 -1.3136 1.8159 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5406 -0.5290 -2.4107 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1548 -0.8444 1.7441 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8671 -0.0535 -2.4910 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9129 0.1485 -1.4548 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2501 -2.2200 -0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.4324 -1.5499 1.0490 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.5853 -1.1191 -0.2176 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.6014 2.1241 0.9458 H 0 0 0 0 0 0 0 0 0 0 0 0
1 5 1 0 0 0 0
1 29 1 0 0 0 0
2 18 1 0 0 0 0
2 38 1 0 0 0 0
3 18 2 0 0 0 0
4 5 1 0 0 0 0
4 6 1 0 0 0 0
4 9 1 0 0 0 0
4 19 1 0 0 0 0
5 7 1 0 0 0 0
5 20 1 0 0 0 0
6 8 1 0 0 0 0
6 21 1 0 0 0 0
6 22 1 0 0 0 0
7 8 1 0 0 0 0
7 23 1 0 0 0 0
7 24 1 0 0 0 0
8 25 1 0 0 0 0
8 26 1 0 0 0 0
9 10 1 0 0 0 0
9 27 1 0 0 0 0
9 28 1 0 0 0 0
10 11 2 0 0 0 0
10 12 1 0 0 0 0
11 14 1 0 0 0 0
11 30 1 0 0 0 0
12 15 2 0 0 0 0
12 31 1 0 0 0 0
13 14 2 0 0 0 0
13 15 1 0 0 0 0
13 16 1 0 0 0 0
14 32 1 0 0 0 0
15 33 1 0 0 0 0
16 17 1 0 0 0 0
16 18 1 0 0 0 0
16 34 1 0 0 0 0
17 35 1 0 0 0 0
17 36 1 0 0 0 0
17 37 1 0 0 0 0
M END
$$$$