B9QOR2 -OEChem-04022104323D 47 51 0 0 0 0 0 0 0999 V2000 -2.6592 2.0410 -0.0003 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8198 2.3462 -0.0272 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9009 0.9877 -0.0558 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1569 3.8965 -0.0395 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1932 3.2580 -0.0676 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1836 0.3404 -0.0059 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4573 1.5555 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5143 0.6899 0.0101 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7242 -1.0189 -0.0008 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4042 2.5748 -0.0236 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8807 1.9416 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7504 -0.0449 0.0341 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4821 -1.6696 1.2096 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5189 -1.6914 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3357 -0.3928 1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3712 -0.4147 -1.1617 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0351 -2.9910 1.2147 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0721 -3.0129 -1.2008 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1691 4.1412 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2633 1.2538 -0.0439 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5341 -1.1062 1.2782 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5696 -1.1282 -1.1374 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1698 -3.6625 0.0096 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1509 -1.4739 0.0826 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1266 0.0433 -0.0197 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3824 0.1338 0.5422 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6423 -1.1293 -0.5595 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1922 -1.0017 0.5652 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4522 -2.2649 -0.5364 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7271 -2.2009 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6359 -1.1604 2.1581 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7014 -1.1993 -2.1585 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5866 0.0266 0.0008 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8674 -0.1143 2.1953 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9307 -0.1535 -2.1211 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1542 -3.4967 2.1571 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0889 -3.5355 -2.1391 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 5.1877 -0.0749 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9866 -1.3758 2.2279 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0500 -1.4148 -2.0684 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5190 -4.6909 0.0135 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0839 -2.0296 0.1013 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7586 1.0571 0.9722 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6802 -1.2153 -1.0516 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1846 -0.9524 1.0039 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0945 -3.1962 -0.9659 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3584 -3.0845 0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 10 1 0 0 0 0 2 20 2 0 0 0 0 3 11 1 0 0 0 0 3 20 1 0 0 0 0 3 33 1 0 0 0 0 4 10 2 0 0 0 0 4 19 1 0 0 0 0 5 11 1 0 0 0 0 5 19 2 0 0 0 0 6 7 1 0 0 0 0 6 8 2 0 0 0 0 6 9 1 0 0 0 0 7 10 1 0 0 0 0 7 11 2 0 0 0 0 8 12 1 0 0 0 0 9 13 2 0 0 0 0 9 14 1 0 0 0 0 12 15 2 0 0 0 0 12 16 1 0 0 0 0 13 17 1 0 0 0 0 13 31 1 0 0 0 0 14 18 2 0 0 0 0 14 32 1 0 0 0 0 15 21 1 0 0 0 0 15 34 1 0 0 0 0 16 22 2 0 0 0 0 16 35 1 0 0 0 0 17 23 2 0 0 0 0 17 36 1 0 0 0 0 18 23 1 0 0 0 0 18 37 1 0 0 0 0 19 38 1 0 0 0 0 20 25 1 0 0 0 0 21 24 2 0 0 0 0 21 39 1 0 0 0 0 22 24 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 24 42 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 26 28 1 0 0 0 0 26 43 1 0 0 0 0 27 29 2 0 0 0 0 27 44 1 0 0 0 0 28 30 2 0 0 0 0 28 45 1 0 0 0 0 29 30 1 0 0 0 0 29 46 1 0 0 0 0 30 47 1 0 0 0 0 M END $$$$