MMs02234847 MOE2007 2D CORINA 3.40 0006 02.08.2006 45 44 0 0 1 0 0 0 0 0999 V2000 0.0000 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3033 -0.7425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3119 -2.2425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5894 1.5149 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5894 2.7149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2861 2.2574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0086 1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8841 2.2723 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1875 1.5298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0298 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4822 2.2872 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.5214 2.8872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7855 1.5447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0802 2.3021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3835 1.5596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6782 2.3171 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9816 1.5745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2763 2.3320 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 1.0427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0427 0.5940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 -1.0427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2641 -1.3425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1119 -2.2494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3188 -3.4425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5119 -2.2356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0149 -1.1103 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7786 0.2301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8773 3.4723 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0194 0.6210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5621 0.6299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3036 3.2170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8463 3.2258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6175 0.6359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1601 0.6448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6714 3.5170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3189 1.7379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2694 3.5319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5093 4.3932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2775 3.7574 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9902 0.0745 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.0328 -0.5195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4736 3.7872 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4309 4.3812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2348 4.3514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 23 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 40 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 43 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 41 2 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 39 43 1 0 0 0 0 40 45 1 0 0 0 0 41 42 1 0 0 0 0 43 44 1 0 0 0 0 M END