B4XHE1 -OEChem-04022106422D 48 51 0 0 0 0 0 0 0999 V2000 2.0000 1.2741 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.2622 2.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5301 2.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3244 -2.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8602 -0.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1282 0.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5301 -0.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9942 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8602 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1282 -0.2500 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 10.7263 -0.7500 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 6.3961 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5923 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7263 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5301 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3961 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6641 0.7500 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 12.4583 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5923 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4583 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7702 1.2847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7702 -0.7847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8641 0.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8641 -0.2708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1904 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5957 -1.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3928 -1.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4708 0.6423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0723 1.3326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5176 -0.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9162 -0.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3928 1.7250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5957 1.7250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5923 0.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1893 -2.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9331 -0.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9953 -0.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5923 -2.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5301 -1.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7773 1.9046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7773 -1.4046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3284 -0.5829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5004 -2.2869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7273 -1.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8804 -1.2131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 2 13 2 0 0 0 0 3 17 2 0 0 0 0 4 23 1 0 0 0 0 4 28 1 0 0 0 0 5 8 1 0 0 0 0 5 9 1 0 0 0 0 5 12 1 0 0 0 0 6 10 1 0 0 0 0 6 11 1 0 0 0 0 6 13 1 0 0 0 0 7 18 1 0 0 0 0 7 20 1 0 0 0 0 7 42 1 0 0 0 0 8 10 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 9 11 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 15 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 14 17 1 0 0 0 0 14 18 2 0 0 0 0 15 21 1 0 0 0 0 15 37 1 0 0 0 0 16 22 2 0 0 0 0 16 38 1 0 0 0 0 17 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 24 1 0 0 0 0 20 25 1 0 0 0 0 21 23 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 24 26 2 0 0 0 0 24 43 1 0 0 0 0 25 27 2 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 27 45 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 M END $$$$