MMs03080895 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 1.3444 -0.6652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4406 -2.1621 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7850 -2.8273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0333 -1.9956 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8811 -4.3242 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9204 -3.7242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7266 -5.2819 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8781 -6.1304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2806 -6.6758 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8806 -7.7151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7775 -6.5797 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9366 -6.2691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1487 -5.1263 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7351 -7.7342 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3640 -9.1876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6315 -9.9897 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7861 -9.0320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2321 -7.6381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1623 -6.4614 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6464 -6.6785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2004 -8.0725 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2703 -9.2492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8242 -10.6432 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.5766 -5.5018 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.0608 -5.7190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9910 -4.5422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4752 -4.7594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0292 -6.1534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5134 -6.3706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4436 -5.1938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8896 -3.7999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4054 -3.5827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9278 -5.4110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8580 -4.2343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.3422 -4.4515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.2724 -3.2747 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4785 -7.9434 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2732 -4.9107 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5322 1.0755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0755 0.5322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5322 -1.0755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6817 0.4864 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5371 -0.7974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4419 -2.8275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2488 -9.6308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0801 -11.5846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0116 -10.8169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1334 -4.3866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6835 -6.8581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1172 -6.2884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9347 -3.9729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3683 -3.4031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2851 -7.0948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9566 -7.4857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6338 -2.8585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9622 -2.4675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.5505 -6.5502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9841 -5.9804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8017 -3.6649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2353 -3.0951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2795 -7.8947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0510 -3.7554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.8962 -5.8454 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.0835 -6.0192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 2 3 1 0 0 0 0 2 43 1 0 0 0 0 2 44 1 0 0 0 0 3 4 1 0 0 0 0 3 45 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 14 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 39 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 38 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 2 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 54 1 0 0 0 0 30 31 1 0 0 0 0 30 55 1 0 0 0 0 31 32 2 0 0 0 0 31 34 1 0 0 0 0 32 33 1 0 0 0 0 32 56 1 0 0 0 0 33 57 1 0 0 0 0 34 35 1 0 0 0 0 34 58 1 0 0 0 0 34 59 1 0 0 0 0 35 36 1 0 0 0 0 35 60 1 0 0 0 0 35 61 1 0 0 0 0 36 37 2 0 0 0 0 36 64 1 0 0 0 0 38 62 1 0 0 0 0 39 63 1 0 0 0 0 64 65 1 0 0 0 0 M END