DCA13V -OEChem-01102402162D 46 48 0 1 0 0 0 0 0999 V2000 3.6636 0.5412 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.9073 -1.3656 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2158 -1.5292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9695 0.1344 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.0975 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4945 -1.0680 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.3714 -1.3656 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5772 0.1344 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4432 0.6344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3092 0.1344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4727 -0.8601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1753 0.6344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3092 -0.8656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6394 -1.3656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0413 -0.8656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7734 -0.8656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5054 -0.8656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0413 0.1344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1753 -1.3656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2375 0.1344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9945 -0.2020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1035 0.6344 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.5054 0.1344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3714 0.6344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2375 -0.8656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1035 1.6344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5447 0.7536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8418 1.1094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0447 1.1094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1753 1.2544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7723 -1.1756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2408 -1.8405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0379 -1.8405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1719 -0.3906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3748 -0.3906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5782 0.4444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1753 -1.9856 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2424 -1.6344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6404 0.9444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9685 0.4444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3714 1.2544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7744 -1.1756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7235 1.6344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1035 2.2544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4835 1.6344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5064 0.4444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 21 1 0 0 0 0 2 15 1 0 0 0 0 2 16 1 0 0 0 0 3 11 2 0 0 0 0 4 22 1 0 0 0 0 4 46 1 0 0 0 0 5 21 2 0 0 0 0 6 11 1 0 0 0 0 6 21 1 0 0 0 0 6 38 1 0 0 0 0 7 17 2 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 8 27 1 0 0 0 0 9 10 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 12 18 1 0 0 0 0 12 30 1 0 0 0 0 13 19 2 0 0 0 0 13 31 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 18 2 0 0 0 0 15 19 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 23 1 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 20 22 1 0 0 0 0 20 24 1 0 0 0 0 20 25 2 0 0 0 0 22 26 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 M END $$$$