MMs01047246 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 55 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 -0.7575 1.2947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2575 1.2860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2424 -1.3120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7425 -1.3034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4999 -0.0260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2574 1.2686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7574 1.2599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5149 2.5546 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0149 2.5459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7574 1.2426 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7724 3.8406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2724 3.8319 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.0148 2.5286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5148 2.5199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2573 1.2165 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.2723 3.8146 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -15.7413 4.1179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.9067 5.6088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.5400 6.2268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5298 5.1179 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -13.2193 6.2770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0299 5.1266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2874 6.4300 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9148 0.7767 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9237 -0.7660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3677 1.7116 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9727 2.4752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0559 2.4689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3875 1.6899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0272 -2.4926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3677 -1.7290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3875 -1.7072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9440 -2.4863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6252 -0.4430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2847 -1.2066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1322 1.6856 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4726 2.4492 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5422 0.0794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8826 0.8430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9209 3.5973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6472 4.2576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9876 5.0212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8848 2.1247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2164 1.3456 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.8598 2.9238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.9413 4.1110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.0791 5.3525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.2842 6.7479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.1460 7.2626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5733 6.9378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9999 -0.0174 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.5999 -1.0566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 52 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 4 52 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 6 52 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 41 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 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 23 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 52 1 M END