B1MAJ8 -OEChem-04012114373D 31 32 0 0 0 0 0 0 0999 V2000 2.7968 -0.4775 0.6779 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6199 2.1236 -1.0196 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4257 2.5397 1.2064 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6262 0.9258 -0.5126 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5542 -1.3323 -0.2637 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7266 -1.0343 -1.3142 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2005 0.6684 0.1041 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7646 0.3077 0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3182 -0.9930 0.2242 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6214 0.4735 0.3077 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4498 -0.6273 0.5277 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4692 -2.0895 0.4462 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7043 -1.1586 0.0704 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6134 1.4042 -0.0683 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9056 -1.9063 0.5968 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5327 -0.0578 -0.1495 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9882 1.2211 -0.2187 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2465 1.7946 0.2439 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9661 -0.2468 -0.3069 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6312 -1.1500 -0.2623 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9130 -0.3852 -0.4437 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8729 -3.0981 0.5058 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1319 -2.1585 0.1241 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2301 2.4200 -0.1291 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5366 -2.7726 0.7765 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5965 2.1051 -0.3885 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8685 -2.1459 0.1256 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1384 -1.2225 -1.2393 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0389 3.0098 -1.0581 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5919 0.7876 -0.6168 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5722 -0.5562 -1.4508 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 20 1 0 0 0 0 2 18 1 0 0 0 0 2 29 1 0 0 0 0 3 18 2 0 0 0 0 4 19 1 0 0 0 0 4 30 1 0 0 0 0 5 19 2 0 0 0 0 6 21 1 0 0 0 0 6 31 1 0 0 0 0 7 21 2 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 9 12 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 11 15 1 0 0 0 0 12 15 2 0 0 0 0 12 22 1 0 0 0 0 13 16 2 0 0 0 0 13 23 1 0 0 0 0 14 17 2 0 0 0 0 14 24 1 0 0 0 0 15 25 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 26 1 0 0 0 0 20 21 1 0 0 0 0 20 27 1 0 0 0 0 20 28 1 0 0 0 0 M END $$$$