BW84EB -OEChem-04022116473D 30 31 0 0 0 0 0 0 0999 V2000 -1.0601 -0.8853 1.9300 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4191 -1.4842 -1.2007 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4137 -3.0865 -0.2513 O 0 5 0 0 0 0 0 0 0 0 0 0 0.3155 -2.8021 0.3281 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6400 2.6975 -0.3050 O 0 5 0 0 0 0 0 0 0 0 0 0 5.3710 0.6629 -0.6858 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4542 -2.3466 0.0694 N 0 3 0 0 0 0 0 0 0 0 0 0 4.4533 1.4584 -0.3706 N 0 3 0 0 0 0 0 0 0 0 0 0 0.6504 -0.0679 0.4912 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6650 -0.9414 0.1428 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8618 1.2985 0.5619 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7072 -0.5689 0.8033 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9318 -0.4333 -0.1446 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1637 0.9406 -0.0785 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1286 1.8065 0.2746 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9886 0.0314 -0.2502 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7392 -0.7115 -0.2893 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2527 0.8969 0.8115 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9232 -0.1215 -1.2741 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4513 1.6093 0.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1218 0.5910 -1.2367 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3859 1.4563 -0.1751 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0614 1.9797 0.8365 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7416 -1.1048 -0.4203 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2725 2.8822 0.3362 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5499 1.0617 1.6214 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7378 -0.7905 -2.1104 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6558 2.2864 1.6734 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8496 0.4722 -2.0341 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3187 2.0117 -0.1464 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 2 0 0 0 0 2 17 2 0 0 0 0 3 7 1 0 0 0 0 4 7 2 0 0 0 0 5 8 1 0 0 0 0 6 8 2 0 0 0 0 7 10 1 0 0 0 0 8 14 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 10 13 1 0 0 0 0 11 15 2 0 0 0 0 11 23 1 0 0 0 0 12 17 1 0 0 0 0 13 14 2 0 0 0 0 13 24 1 0 0 0 0 14 15 1 0 0 0 0 15 25 1 0 0 0 0 16 17 1 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 18 20 1 0 0 0 0 18 26 1 0 0 0 0 19 21 2 0 0 0 0 19 27 1 0 0 0 0 20 22 2 0 0 0 0 20 28 1 0 0 0 0 21 22 1 0 0 0 0 21 29 1 0 0 0 0 22 30 1 0 0 0 0 M CHG 4 3 -1 5 -1 7 1 8 1 M END $$$$