MMs03335472 MOE2007 2D CORINA 3.40 0006 02.08.2006 65 66 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 0.7419 -1.3037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2419 -1.3130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9837 -2.6167 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5837 -1.5775 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4745 -2.7828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7772 -4.2520 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.6258 -3.4034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3651 -3.9832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3074 -6.4846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9333 -7.0862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1437 -4.8706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2912 -6.3633 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3627 -3.9965 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7292 -4.6152 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.7684 -5.2152 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9482 -3.7411 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.9090 -3.1411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8007 -2.2483 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.4901 -1.0892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0197 -1.3742 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.8682 -0.5257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3862 -1.9929 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.5453 -2.3035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5337 -3.4856 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.5337 -4.6856 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3147 -4.3597 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9002 -4.1043 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.0477 -5.5970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6052 -1.1188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4872 0.0754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8722 0.1185 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7790 0.6134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4342 -1.6297 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3162 -0.4355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8767 -6.1079 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.8767 -7.3079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6577 -6.9820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2432 -6.7265 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3612 -7.9207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0430 0.5935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5935 1.0430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 -0.5935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3883 -1.7071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9429 -2.4867 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0409 -0.1300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3720 -0.9097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4820 -1.5829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6687 -2.6648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3296 -3.3768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6537 -4.9496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5905 -7.6508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5050 -6.4084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4521 -5.9869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8341 -7.5674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4146 -8.1855 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2447 -2.8023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8535 -5.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1656 -6.7912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2418 -5.4790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9584 -6.0068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6825 -7.6813 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3570 -7.9572 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4735 -4.9939 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.3144 -5.3044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 2 3 1 0 0 0 0 2 44 1 0 0 0 0 2 45 1 0 0 0 0 3 4 1 0 0 0 0 3 46 1 0 0 0 0 3 47 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 9 1 0 0 0 0 6 7 1 0 0 0 0 6 48 1 0 0 0 0 6 49 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 7 64 1 0 0 0 0 9 50 1 0 0 0 0 9 51 1 0 0 0 0 9 64 1 0 0 0 0 10 11 1 0 0 0 0 10 52 1 0 0 0 0 10 53 1 0 0 0 0 10 64 1 0 0 0 0 11 54 1 0 0 0 0 11 55 1 0 0 0 0 11 56 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 57 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 36 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 27 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 34 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 32 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 30 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 28 29 1 0 0 0 0 29 58 1 0 0 0 0 29 59 1 0 0 0 0 29 60 1 0 0 0 0 30 31 1 0 0 0 0 32 33 1 0 0 0 0 34 35 1 0 0 0 0 36 37 1 0 0 0 0 36 38 1 0 0 0 0 36 39 1 0 0 0 0 38 61 1 0 0 0 0 38 62 1 0 0 0 0 38 63 1 0 0 0 0 39 40 1 0 0 0 0 64 65 1 0 0 0 0 M CHG 1 64 1 M END