MMs00029910 MOE2007 2D CORINA 3.40 0006 02.08.2006 80 84 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 0.4635 -1.4266 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4182 -2.6401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4635 -3.8536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8901 -3.3901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8901 -1.8901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1036 -1.0084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9468 0.4834 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4740 -1.6185 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6875 -0.7369 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.6875 -1.9369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6875 0.7631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1141 1.2267 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.2655 2.0752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9957 0.0131 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1141 -1.2004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4957 0.0131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2457 1.3122 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2457 -1.2859 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.0457 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0 0 0 0 0 20.1014 -1.8901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.1014 -3.3901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.5280 -3.8536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.4096 -2.6401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.5280 -1.4266 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 21.9915 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5776 2.6533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0448 2.9651 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1413 0.3708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3708 1.1413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1413 -0.3708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6182 -2.6401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0927 -4.9949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8609 -4.0955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5994 -2.8120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4941 0.6377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4380 1.9369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6260 -2.2966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6337 -1.5004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0361 -2.1993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5765 -3.3563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1181 -4.2944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4541 -5.0657 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5374 -5.0657 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8734 -4.2944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4150 -3.3563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9554 -2.1993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3578 -1.5004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3655 -2.2966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4974 0.6377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5535 1.9369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3921 -2.8120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.1306 -4.0955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.8988 -4.9949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.6096 -2.6401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.1328 -0.3708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.3623 1.1413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.8502 0.3708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4176 3.7680 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 6.5739 3.7680 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 49 1 0 0 0 0 1 50 1 0 0 0 0 1 51 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 3 4 2 0 0 0 0 3 52 1 0 0 0 0 4 5 1 0 0 0 0 4 53 1 0 0 0 0 5 6 2 0 0 0 0 5 54 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 55 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 56 1 0 0 0 0 12 57 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 47 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 58 1 0 0 0 0 16 59 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 21 1 0 0 0 0 19 25 1 0 0 0 0 21 22 1 0 0 0 0 21 60 1 0 0 0 0 21 61 1 0 0 0 0 22 23 1 0 0 0 0 22 62 1 0 0 0 0 22 63 1 0 0 0 0 23 24 1 0 0 0 0 23 64 1 0 0 0 0 23 65 1 0 0 0 0 24 25 1 0 0 0 0 24 66 1 0 0 0 0 24 67 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 34 1 0 0 0 0 30 31 1 0 0 0 0 30 68 1 0 0 0 0 30 69 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 38 1 0 0 0 0 33 34 1 0 0 0 0 33 70 1 0 0 0 0 33 71 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 36 37 2 0 0 0 0 36 79 1 0 0 0 0 38 39 1 0 0 0 0 38 72 1 0 0 0 0 39 40 2 0 0 0 0 39 41 1 0 0 0 0 41 42 2 0 0 0 0 41 45 1 0 0 0 0 42 43 1 0 0 0 0 42 73 1 0 0 0 0 43 44 2 0 0 0 0 43 74 1 0 0 0 0 44 45 1 0 0 0 0 44 75 1 0 0 0 0 45 46 1 0 0 0 0 46 76 1 0 0 0 0 46 77 1 0 0 0 0 46 78 1 0 0 0 0 47 48 2 0 0 0 0 47 80 1 0 0 0 0 M CHG 1 79 -1 M CHG 1 80 -1 M END