B3KX5B -OEChem-04022110192D 48 51 0 1 0 0 0 0 0999 V2000 2.0000 -0.2742 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.5301 -1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2622 1.7500 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 6.3961 0.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8602 1.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5301 1.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8602 -0.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9942 1.7500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.9942 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1282 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1282 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2622 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3961 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2622 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5301 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6641 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6641 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2622 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7702 -0.2847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7702 1.7847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1282 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3961 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8641 0.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8641 1.2708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1282 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3961 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2622 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9942 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9942 1.1300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7297 0.7751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5267 0.7751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6048 2.6423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2063 3.3326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5267 3.7250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7297 3.7250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0501 3.3326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6516 2.6423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3972 1.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8602 0.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8728 -0.3577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4742 0.3326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7773 -0.9046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7773 2.4046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8592 -1.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3284 1.5829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6651 -3.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8592 -3.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2622 -3.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 2 15 2 0 0 0 0 3 10 1 0 0 0 0 3 12 1 0 0 0 0 3 13 1 0 0 0 0 4 13 1 0 0 0 0 4 14 1 0 0 0 0 4 15 1 0 0 0 0 8 5 1 1 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 13 2 0 0 0 0 6 16 1 0 0 0 0 7 28 3 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 29 1 0 0 0 0 9 11 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 14 18 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 17 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 19 1 0 0 0 0 18 21 1 0 0 0 0 18 22 2 0 0 0 0 19 23 2 0 0 0 0 19 42 1 0 0 0 0 20 24 2 0 0 0 0 20 43 1 0 0 0 0 21 25 2 0 0 0 0 21 28 1 0 0 0 0 22 26 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 24 45 1 0 0 0 0 25 27 1 0 0 0 0 25 46 1 0 0 0 0 26 27 2 0 0 0 0 26 47 1 0 0 0 0 27 48 1 0 0 0 0 M END $$$$