B6WES9 -OEChem-04022109102D 47 50 0 0 0 0 0 0 0999 V2000 5.4641 -5.0600 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 4.4400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.0600 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.0600 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4920 2.9747 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 1.4192 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 4.4400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4920 0.9053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -4.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -5.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 2.4608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2087 -0.6677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8101 0.0226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 0.0226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -0.6677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8101 -2.1426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2087 -1.4523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -1.4523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 -2.1426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 1.1300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -3.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 2.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -4.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -2.5231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -3.5969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4848 0.2854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -5.6800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9338 2.7729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 5.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 4.1300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 2 26 2 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 3 12 1 0 0 0 0 4 10 1 0 0 0 0 4 11 1 0 0 0 0 4 13 1 0 0 0 0 5 18 1 0 0 0 0 5 27 2 0 0 0 0 6 23 2 0 0 0 0 6 27 1 0 0 0 0 7 26 1 0 0 0 0 7 46 1 0 0 0 0 7 47 1 0 0 0 0 8 10 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 11 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 14 2 0 0 0 0 12 16 1 0 0 0 0 13 15 2 0 0 0 0 13 17 1 0 0 0 0 14 18 1 0 0 0 0 14 23 1 0 0 0 0 15 21 1 0 0 0 0 15 22 1 0 0 0 0 16 19 2 0 0 0 0 16 36 1 0 0 0 0 17 24 2 0 0 0 0 17 37 1 0 0 0 0 18 20 2 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 26 1 0 0 0 0 21 25 2 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 25 44 1 0 0 0 0 27 45 1 0 0 0 0 M END $$$$