MMs02399506 MOE2007 2D CORINA 3.40 0006 02.08.2006 83 88 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 1.4260 0.4652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7362 1.9328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5419 -0.5372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9680 -0.0720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0839 -1.0743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5099 -0.6091 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.6614 0.2394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8200 0.8585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6258 -1.6115 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5866 -2.2115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4708 -3.1035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8418 -3.7119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8442 -2.5960 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.1548 -3.7552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0927 -1.2979 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.8411 0.0020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3411 0.0038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0927 -1.2943 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.6927 -0.2551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3442 -2.5943 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.5442 -2.5943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0957 -3.8924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5957 -3.8906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3442 -2.5907 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.9442 -3.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5927 -1.2926 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.3411 0.0074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8411 0.0091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8435 1.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6849 2.6166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8974 3.4997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2685 2.8913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4270 1.3997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2145 0.5165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0595 -0.9754 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.9522 -1.7773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5927 -1.2890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8442 -2.5890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0924 -1.2646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2096 -0.0854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3722 1.1408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1408 -0.3722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3722 -1.1408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5775 1.3137 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9102 1.6847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9843 3.1069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5621 2.1809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5972 -1.2771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1066 -1.5960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4034 0.9869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9127 0.6680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1391 -1.8142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6485 -2.1332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9941 0.6104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0682 2.0325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6460 1.1066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2967 -2.8554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1013 -4.2452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2431 -4.7519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8135 -4.4161 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7130 0.4111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0481 1.1840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1314 1.1853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4683 0.4156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9686 -4.3042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3055 -5.0739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3888 -5.0727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7239 -4.2997 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2130 0.4164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5481 1.1894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5881 3.1034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7706 4.6930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.2385 3.5977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.5239 0.9129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6372 -3.7710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9723 -2.9980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1148 -2.4644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6923 -1.2534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0700 -0.0648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1795 0.6211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5031 0.8846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2396 -0.7919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 45 1 0 0 0 0 3 46 1 0 0 0 0 3 47 1 0 0 0 0 3 48 1 0 0 0 0 4 5 1 0 0 0 0 4 49 1 0 0 0 0 4 50 1 0 0 0 0 5 6 1 0 0 0 0 5 51 1 0 0 0 0 5 52 1 0 0 0 0 6 7 1 0 0 0 0 6 53 1 0 0 0 0 6 54 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 9 55 1 0 0 0 0 9 56 1 0 0 0 0 9 57 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 58 1 0 0 0 0 12 59 1 0 0 0 0 13 14 1 0 0 0 0 13 60 1 0 0 0 0 13 61 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 21 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 62 1 0 0 0 0 17 63 1 0 0 0 0 18 19 1 0 0 0 0 18 64 1 0 0 0 0 18 65 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 27 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 66 1 0 0 0 0 23 67 1 0 0 0 0 24 25 1 0 0 0 0 24 68 1 0 0 0 0 24 69 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 39 1 0 0 0 0 27 28 1 0 0 0 0 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