LBEM72 -OEChem-05032300062D 47 49 0 1 0 0 0 0 0999 V2000 5.5116 0.4615 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.6317 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.5656 -0.1270 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.6317 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.6317 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -0.6317 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7320 -0.6317 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6808 2.0707 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.3683 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7026 1.8628 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7631 1.9092 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.3563 2.8227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1753 1.1002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7576 1.8046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9441 3.6317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3618 2.9272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 1.2047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1643 0.8911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3454 2.6137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1588 0.7866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3399 2.5091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7466 1.5956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.8683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.6317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.1317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.1317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.1317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.1317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.6317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0152 1.3428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9919 2.3211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0044 0.5042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7325 0.8284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4457 3.2673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3085 4.1333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4425 3.9962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4266 3.5438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7452 2.9920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2970 2.3106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7999 0.3895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0932 3.1800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7043 3.0107 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3632 1.5308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 0.6783 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.8217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -1.8217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.2517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 1 23 1 0 0 0 0 2 6 2 0 0 0 0 2 7 2 0 0 0 0 2 9 1 0 0 0 0 2 24 1 0 0 0 0 3 20 1 0 0 0 0 4 27 1 0 0 0 0 5 28 1 0 0 0 0 8 10 1 0 0 0 0 8 17 2 0 0 0 0 9 23 1 0 0 0 0 9 44 1 0 0 0 0 10 23 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 6 0 0 0 11 14 1 0 0 0 0 11 30 1 0 0 0 0 12 15 1 0 0 0 0 12 16 1 0 0 0 0 12 31 1 0 0 0 0 13 17 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 18 2 0 0 0 0 14 19 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 18 20 1 0 0 0 0 18 40 1 0 0 0 0 19 21 2 0 0 0 0 19 41 1 0 0 0 0 20 22 2 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 43 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 25 28 1 0 0 0 0 25 45 1 0 0 0 0 26 27 2 0 0 0 0 26 46 1 0 0 0 0 27 29 1 0 0 0 0 28 29 2 0 0 0 0 29 47 1 0 0 0 0 M END $$$$