MMs00958512 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 57 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 1.3014 0.7460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8994 0.7379 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4975 0.7298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7895 -1.5242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4882 -2.2702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1915 -1.5162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0862 -2.2783 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.0470 -2.8783 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3876 -1.5323 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6843 -2.2864 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.8434 -2.5969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8021 -1.2861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1963 0.0861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7040 -0.0661 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9503 1.3828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4503 1.3781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2044 2.6748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4584 3.9762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9584 3.9808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2044 2.6841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2124 5.2729 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 11.6796 -3.7864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9763 -4.5404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9716 -6.0404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6703 -6.7863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3736 -6.0323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3783 -4.5323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0816 -3.7783 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5968 1.0411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0411 -0.5968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5968 -1.0411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5329 1.6676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0756 1.6628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8239 -0.9249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3665 -0.9297 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5012 1.9298 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8353 0.5725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4844 -3.4702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1504 -2.1129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5044 -2.2592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8432 -0.6894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0471 0.3370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4043 2.6711 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3616 5.0219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0044 2.6879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0174 -3.9436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0090 -6.6436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6666 -7.9863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3325 -6.6291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 32 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 26 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 24 49 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 29 30 2 0 0 0 0 29 52 1 0 0 0 0 30 31 1 0 0 0 0 30 53 1 0 0 0 0 31 32 1 0 0 0 0 M END