BEUB15 -OEChem-04012114272D 45 47 0 0 0 0 0 0 0999 V2000 2.0000 -3.5580 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.9420 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.1097 3.0353 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3301 1.9420 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3301 1.9420 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.0580 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.9420 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.0580 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 3.7784 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.5580 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.9420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 3.4420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3007 4.4365 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.4420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.4420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.0580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2788 4.6444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.5580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.5580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5575 5.1057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6856 5.5580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.5580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -4.0580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.5580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -5.0580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.0580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -5.5580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -5.0580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 3.2520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 0.7520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 0.7520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 -0.8680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -0.8680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9724 5.5664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0968 5.5205 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1427 4.6449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -2.3680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2520 5.3058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9377 6.1244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1192 5.8102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -3.8680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.9380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -5.3680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -6.1780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -5.3680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 2 4 2 0 0 0 0 2 5 2 0 0 0 0 2 7 1 0 0 0 0 2 11 1 0 0 0 0 3 9 1 0 0 0 0 3 12 1 0 0 0 0 6 22 2 0 0 0 0 7 12 1 0 0 0 0 7 29 1 0 0 0 0 8 16 1 0 0 0 0 8 22 1 0 0 0 0 8 37 1 0 0 0 0 9 17 2 0 0 0 0 10 22 1 0 0 0 0 10 23 1 0 0 0 0 10 41 1 0 0 0 0 11 14 2 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 13 17 1 0 0 0 0 13 20 1 0 0 0 0 14 18 1 0 0 0 0 14 30 1 0 0 0 0 15 19 2 0 0 0 0 15 31 1 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 17 21 1 0 0 0 0 18 32 1 0 0 0 0 19 33 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 24 26 1 0 0 0 0 24 42 1 0 0 0 0 25 27 2 0 0 0 0 25 43 1 0 0 0 0 26 28 2 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 28 45 1 0 0 0 0 M END $$$$