MMs01102669 MOE2007 2D CORINA 3.40 0006 02.08.2006 65 68 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 1.3055 -0.7388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3184 -2.2387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6239 -2.9774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9164 -2.2163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9034 -0.7163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 0.0449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1830 1.5448 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5014 -0.6939 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7939 0.0673 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.7939 -1.1327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7810 1.5673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4755 2.3060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0735 2.3285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0994 -0.6714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1124 -2.1714 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3919 0.0898 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3790 1.5897 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6715 2.3509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9769 1.6121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1466 0.1218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3552 1.1281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3419 2.2341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7931 3.6646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2576 3.9891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2709 2.8831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8197 1.4526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2384 -1.5424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7315 -1.6863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6026 -0.4652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0957 -0.6091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7176 -1.9741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8465 -3.1952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3534 -3.0513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4822 -4.2724 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 21.2107 -2.1180 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 1.0444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0444 0.5910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5910 -1.0444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2844 -2.8476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6343 -4.1774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9608 -2.8073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5876 1.2224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5118 -1.8938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7810 2.7673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0665 3.3504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4311 2.8970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8845 1.2616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6824 1.2944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1075 2.9374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4645 3.3625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4363 -0.5012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6611 3.5509 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2618 -0.6889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9825 4.5494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6185 5.1336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4425 3.1427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6303 0.5678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3324 -2.7387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0766 -1.8428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1051 0.6268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.7926 0.3678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.3440 -4.2872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6165 -0.1774 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 41 1 0 0 0 0 4 5 1 0 0 0 0 4 42 1 0 0 0 0 5 6 2 0 0 0 0 5 43 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 44 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 45 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 46 1 0 0 0 0 14 47 1 0 0 0 0 14 48 1 0 0 0 0 14 49 1 0 0 0 0 15 50 1 0 0 0 0 15 51 1 0 0 0 0 15 52 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 53 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 54 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 55 1 0 0 0 0 22 65 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 23 65 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 56 1 0 0 0 0 26 27 2 0 0 0 0 26 57 1 0 0 0 0 27 28 1 0 0 0 0 27 58 1 0 0 0 0 28 59 1 0 0 0 0 29 30 1 0 0 0 0 29 60 1 0 0 0 0 29 61 1 0 0 0 0 29 65 1 0 0 0 0 30 31 1 0 0 0 0 30 35 2 0 0 0 0 31 32 2 0 0 0 0 31 62 1 0 0 0 0 32 33 1 0 0 0 0 32 63 1 0 0 0 0 33 34 2 0 0 0 0 33 37 1 0 0 0 0 34 35 1 0 0 0 0 34 64 1 0 0 0 0 35 36 1 0 0 0 0 M END