BCQ79Y -OEChem-04022103032D 49 52 0 1 0 0 0 0 0999 V2000 4.6783 -3.2438 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.3211 0.0604 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9313 2.0361 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 12.9156 3.4391 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2566 0.6791 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 9.7783 0.0989 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.0185 2.4444 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 8.8655 0.5072 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.9986 0.0087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6593 1.4857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6649 1.5919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2781 0.4729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 -0.4776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5884 0.6853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 -0.6839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -1.6344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4855 1.6800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5012 0.2769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.9391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2956 2.2663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3112 0.8633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -2.4391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.9391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2084 1.8580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.4391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.4391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.9391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.9391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3480 0.8965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5371 -0.4054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3622 -0.4935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2760 1.5494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6603 2.1057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7949 2.1982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0756 1.7846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2575 1.0925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6643 0.5602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8421 -0.5178 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9880 -1.0973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5812 -0.5650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9196 1.9331 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5649 -0.3398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2318 2.8830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8772 0.6102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8819 -2.4391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.8191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.0591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.6291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.2491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 15 2 0 0 0 0 3 7 1 0 0 0 0 4 7 2 0 0 0 0 5 9 1 0 0 0 0 5 11 1 0 0 0 0 5 12 1 0 0 0 0 8 6 1 1 0 0 0 6 14 1 0 0 0 0 6 38 1 0 0 0 0 7 24 1 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 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 15 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 17 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 16 19 1 0 0 0 0 16 22 2 0 0 0 0 17 20 1 0 0 0 0 17 41 1 0 0 0 0 18 21 2 0 0 0 0 18 42 1 0 0 0 0 19 23 1 0 0 0 0 19 25 2 0 0 0 0 20 24 2 0 0 0 0 20 43 1 0 0 0 0 21 24 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 23 26 2 0 0 0 0 25 27 1 0 0 0 0 25 46 1 0 0 0 0 26 28 1 0 0 0 0 26 47 1 0 0 0 0 27 28 2 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 M CHG 2 3 -1 7 1 M END $$$$