B7TK4I -OEChem-04022117593D 42 44 0 0 0 0 0 0 0999 V2000 -1.4728 -4.8029 0.0981 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.5242 -1.3519 -0.2436 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2432 2.1663 0.8819 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7687 0.8029 -0.3296 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6323 2.1394 0.9056 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6378 1.0367 0.0026 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2542 -0.2019 -0.1753 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2121 1.1394 0.1195 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7941 -2.3481 0.7399 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4097 2.1967 0.0689 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6423 -0.2805 -0.2869 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8481 0.4229 -0.3694 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5198 -3.1457 0.9898 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9706 1.0896 0.1514 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4141 0.8795 -0.2207 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7979 2.1182 -0.0428 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3502 0.7488 -0.0548 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0004 -3.8671 -0.2465 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7154 -0.5807 -0.2653 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3248 1.7466 -0.0449 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0554 -0.9127 -0.4661 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6647 1.4148 -0.2456 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0299 0.0852 -0.4563 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3329 -0.4953 -0.5099 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1196 -1.8901 1.6825 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5888 -3.0086 0.3754 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9580 3.1773 0.1982 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0712 -1.2653 -0.4372 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8150 -0.4406 -1.0183 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2595 -2.4628 1.3512 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7105 -3.8731 1.7879 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3941 3.0252 0.0077 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2478 -3.1589 -1.0428 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7492 -4.5654 -0.6311 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9806 -1.3821 -0.2682 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0706 2.7927 0.1082 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3403 -1.9482 -0.6278 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4237 2.1917 -0.2398 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0732 -0.1731 -0.6125 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1372 -1.1431 0.3514 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0087 -0.9477 -1.4533 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4188 -0.3692 -0.5736 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 2 7 1 0 0 0 0 2 9 1 0 0 0 0 3 5 1 0 0 0 0 3 8 1 0 0 0 0 4 15 1 0 0 0 0 4 24 1 0 0 0 0 5 14 2 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 7 11 1 0 0 0 0 8 12 2 0 0 0 0 9 13 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 10 16 2 0 0 0 0 10 27 1 0 0 0 0 11 15 2 0 0 0 0 11 28 1 0 0 0 0 12 14 1 0 0 0 0 12 29 1 0 0 0 0 13 18 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 16 32 1 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 21 1 0 0 0 0 19 35 1 0 0 0 0 20 22 2 0 0 0 0 20 36 1 0 0 0 0 21 23 2 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 M END $$$$