D5NAL9 -OEChem-01102402172D 45 48 0 1 0 0 0 0 0999 V2000 4.0015 4.8688 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3381 -2.9918 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9720 2.3742 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1925 3.4675 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5233 4.2106 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6166 5.9902 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3381 1.0082 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.8381 1.8742 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.8381 1.8742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3381 0.0082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9720 3.3742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4720 -0.4918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2041 -0.4918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4720 -1.4918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2041 -1.4918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1060 3.8742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3381 -1.9918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2041 -3.4918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0233 5.0767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2041 -4.4918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0701 -4.9918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3381 -4.9918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0701 -5.9918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3381 -5.9918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2041 -6.4918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9369 0.8477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3997 1.4358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4207 1.6622 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9457 2.4848 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4351 2.0642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5826 3.2666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1841 3.9568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9351 -0.1818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7410 -0.1818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9351 -1.8018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7410 -1.8018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8147 -3.5995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4161 -2.9092 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 6.0550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9810 6.4918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6070 -4.6818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8011 -4.6818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6070 -6.3018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8011 -6.3018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2041 -7.1118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 1 19 1 0 0 0 0 2 17 1 0 0 0 0 2 18 1 0 0 0 0 8 3 1 6 0 0 0 3 11 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 16 2 0 0 0 0 5 19 2 0 0 0 0 6 19 1 0 0 0 0 6 39 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 1 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 11 16 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 14 1 0 0 0 0 12 33 1 0 0 0 0 13 15 2 0 0 0 0 13 34 1 0 0 0 0 14 17 2 0 0 0 0 14 35 1 0 0 0 0 15 17 1 0 0 0 0 15 36 1 0 0 0 0 18 20 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 21 23 1 0 0 0 0 21 41 1 0 0 0 0 22 24 2 0 0 0 0 22 42 1 0 0 0 0 23 25 2 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 M END $$$$