MMs01442383 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 43 0 0 0 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 0.0131 1.4999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3186 2.2386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6110 1.4773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2925 -0.7613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9165 2.2160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2815 1.5940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2949 2.6999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5562 4.0054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0863 3.7064 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.3175 5.2979 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8174 5.2849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5561 3.9793 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7948 2.6869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5335 1.3814 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.0334 1.3683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7721 0.0628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0108 -1.2297 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2720 0.0497 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.0107 -1.2558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2494 -2.5482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9881 -3.8538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4880 -3.8668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2493 -2.5744 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.5106 -1.2688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2719 0.0236 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.0444 -0.5909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0209 2.1090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3290 3.4386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6319 -0.6316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2820 -1.9612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5208 0.4181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4264 6.3188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8353 2.5518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1646 1.7689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8810 1.0837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0495 -2.5378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3791 -4.8877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0790 -4.9112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 15 2 0 0 0 0 10 11 1 0 0 0 0 10 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 24 25 2 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 M END