BK4IA7 -OEChem-04012115042D 43 45 0 1 0 0 0 0 0999 V2000 2.5381 1.2741 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9343 0.7500 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 6.0682 -0.7500 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 6.9343 -0.2500 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.0682 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8003 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2022 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2022 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8003 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8003 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6663 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0682 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3083 1.2847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3083 -0.7847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8003 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6663 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4022 0.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4022 -0.2708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6663 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5323 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5323 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9343 -0.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4668 1.7250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6697 1.7250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3372 1.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4203 2.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8003 2.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1803 2.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3563 0.2131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2033 0.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9763 1.2869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4482 -1.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0682 -2.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6882 -1.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3154 1.9046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3154 -1.4046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2634 -2.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6663 0.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8665 -0.5829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6663 -2.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0693 -0.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0693 -2.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.9662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 1 43 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 3 12 1 0 0 0 0 4 9 1 0 0 0 0 4 22 1 0 0 0 0 5 7 1 0 0 0 0 5 23 1 0 0 0 0 5 24 1 0 0 0 0 6 10 1 0 0 0 0 6 11 1 0 0 0 0 6 25 1 0 0 0 0 7 8 2 0 0 0 0 7 13 1 0 0 0 0 8 14 1 0 0 0 0 9 15 2 0 0 0 0 9 16 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 17 2 0 0 0 0 13 35 1 0 0 0 0 14 18 2 0 0 0 0 14 36 1 0 0 0 0 15 19 1 0 0 0 0 15 37 1 0 0 0 0 16 20 2 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 18 39 1 0 0 0 0 19 21 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 42 1 0 0 0 0 M END $$$$