B1DTQ6 -OEChem-04012112592D 46 47 0 1 0 0 0 0 0999 V2000 2.8660 -0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.7500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5981 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.2500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7320 -0.7500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8660 -3.2500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7320 -3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4682 -1.3250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2087 -2.3577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8101 -1.6674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.1300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3335 -4.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1306 -4.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8101 -0.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2087 -0.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1541 -4.2869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -4.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7741 -3.2131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 0.6674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 1.3577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 1.3577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 0.6674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -3.2131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -4.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -4.2869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -0.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2181 3.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 4.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9781 3.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9 1 1 6 0 0 0 1 43 1 0 0 0 0 2 12 2 0 0 0 0 3 19 2 0 0 0 0 4 20 2 0 0 0 0 5 19 1 0 0 0 0 5 20 1 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 6 12 1 0 0 0 0 6 22 1 1 0 0 0 7 8 1 0 0 0 0 7 23 1 0 0 0 0 7 24 1 0 0 0 0 8 11 1 0 0 0 0 8 15 1 1 0 0 0 8 25 1 0 0 0 0 9 13 1 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 6 0 0 0 10 27 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 14 32 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 19 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 20 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 M END $$$$