MMs00899557 MOE2007 2D CORINA 3.40 0006 02.08.2006 52 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 1.5000 0.0026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2523 -1.2951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5046 -2.5954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0046 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7477 -1.3004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7431 -3.8984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2098 -4.2129 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3640 -5.7049 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3640 -6.9049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9926 -6.3126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6781 -7.7793 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0092 -5.1961 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5092 -5.1935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2569 -3.8931 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2614 -6.4912 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7614 -6.4886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5137 -7.7863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0137 -7.7836 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7660 -9.0866 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6617 -6.4572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9620 -5.7095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2598 -6.4618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2571 -7.9618 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5601 -5.7141 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.8578 -6.4664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1582 -5.7187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4559 -6.4710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7563 -5.7232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7589 -4.2232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4612 -3.4710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1608 -4.2187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.0593 -3.4755 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.6018 1.0382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0982 1.0429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4523 -1.2930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9477 -1.3025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5510 -5.3072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8883 -6.0762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5660 -9.0888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3678 -10.1248 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8887 -7.3751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4314 -7.3778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1923 -4.7889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7350 -4.7916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5622 -4.5141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0849 -7.3843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6276 -7.3870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4538 -7.6710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7944 -6.3251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4633 -2.2710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1227 -3.6168 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 34 1 0 0 0 0 2 3 2 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 4 5 2 0 0 0 0 4 15 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 2 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 21 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 30 31 2 0 0 0 0 30 33 1 0 0 0 0 31 32 1 0 0 0 0 31 51 1 0 0 0 0 32 52 1 0 0 0 0 M END