MMs02444242 MOE2007 2D CORINA 3.40 0006 02.08.2006 63 63 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 1.4151 0.4976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5535 -0.4791 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9686 0.0185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2452 1.4928 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1070 -0.9582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5221 -0.4606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6606 -1.4372 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.5091 -2.2858 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3840 -2.9115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5224 -3.8882 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9689 -3.4091 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6923 -4.8834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2773 -5.3810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0756 -0.9396 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3522 0.5346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2138 1.5113 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7673 1.0322 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.7673 -0.1678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0439 2.5065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9054 3.4832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1820 4.9575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0436 5.9342 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9058 0.0556 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.3208 0.5532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5974 2.0274 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4593 -0.4235 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.8743 0.0741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0128 -0.9026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7362 -2.3769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8747 -3.3536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2897 -2.8560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5663 -1.3817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4279 -0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3981 1.1320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1320 -0.3981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3981 -1.1320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8265 1.5433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3427 1.2589 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1794 -1.7194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6957 -2.0039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9335 0.5852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4497 0.3007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8922 -4.8965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8878 -6.0674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8792 -4.2489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1452 -5.7791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6753 -6.5130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9864 -1.7210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1670 2.0838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6552 3.5391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2941 2.4506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7823 3.9059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6845 -1.1239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2857 1.1198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8020 0.8353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6042 -2.7750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6534 -4.5330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.2005 -3.6373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.6984 -0.9836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.6491 0.7744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5971 5.4551 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8184 6.6345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 38 1 0 0 0 0 2 39 1 0 0 0 0 3 4 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 40 1 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 15 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 13 14 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 14 48 1 0 0 0 0 15 16 1 0 0 0 0 15 49 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 20 1 0 0 0 0 18 24 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 52 1 0 0 0 0 21 53 1 0 0 0 0 22 23 2 0 0 0 0 22 62 1 0 0 0 0 24 25 1 0 0 0 0 24 54 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 57 1 0 0 0 0 31 32 1 0 0 0 0 31 58 1 0 0 0 0 32 33 2 0 0 0 0 32 59 1 0 0 0 0 33 34 1 0 0 0 0 33 60 1 0 0 0 0 34 61 1 0 0 0 0 62 63 1 0 0 0 0 M END