MMs02391209 MOE2007 2D CORINA 3.40 0006 02.08.2006 72 71 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 1.3042 0.7410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5877 -1.5179 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9022 0.7231 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0359 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1960 1.1641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1857 -1.5358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4795 -2.2948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4691 -3.7947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7837 -1.5538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5002 0.7051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5106 2.2051 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 -0.0538 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0982 0.6872 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.0590 1.2872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1086 2.1872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4128 2.9282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7066 2.1692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4231 4.4282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3921 -0.0717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6962 0.6693 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3817 -1.5717 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6755 -2.3307 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.6363 -2.9307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9797 -1.5896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2735 -2.3486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5777 -1.6076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8716 -2.3665 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.1757 -1.6255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1861 -0.1255 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 19.2294 0.4673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1510 0.4816 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6652 -3.8306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9590 -4.5896 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5928 1.0433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0433 -0.5928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5928 -1.0433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5392 1.6656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0819 1.6549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9105 1.9231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0054 -1.3193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7675 -2.6606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4403 -2.8948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2692 -3.7865 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4609 -4.9947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6691 -3.8030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3765 -2.5971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8270 -0.9610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1909 -0.5104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7899 -0.6538 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9254 1.9870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7060 3.3176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4520 3.5282 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0994 1.1342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7417 1.5621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3138 3.2043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6231 4.4199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4314 5.6281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2232 4.4364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3384 -2.1645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2147 -0.6651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7574 -0.6757 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4959 -3.2625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0385 -3.2731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8128 -0.6830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3554 -0.6937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8633 -3.5665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6218 -4.4234 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.4696 -2.3845 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 19.4613 -3.5844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.5129 -1.7916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 39 1 0 0 0 0 2 40 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 12 1 0 0 0 0 8 9 1 0 0 0 0 8 42 1 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 44 1 0 0 0 0 10 45 1 0 0 0 0 10 46 1 0 0 0 0 10 47 1 0 0 0 0 11 48 1 0 0 0 0 11 49 1 0 0 0 0 11 50 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 51 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 21 1 0 0 0 0 17 18 1 0 0 0 0 17 52 1 0 0 0 0 17 53 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 54 1 0 0 0 0 19 55 1 0 0 0 0 19 56 1 0 0 0 0 19 57 1 0 0 0 0 20 58 1 0 0 0 0 20 59 1 0 0 0 0 20 60 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 61 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 34 1 0 0 0 0 26 27 1 0 0 0 0 26 62 1 0 0 0 0 26 63 1 0 0 0 0 27 28 1 0 0 0 0 27 64 1 0 0 0 0 27 65 1 0 0 0 0 28 29 1 0 0 0 0 28 66 1 0 0 0 0 28 67 1 0 0 0 0 29 30 1 0 0 0 0 29 68 1 0 0 0 0 30 31 2 0 0 0 0 30 70 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 34 35 2 0 0 0 0 34 69 1 0 0 0 0 70 71 1 0 0 0 0 70 72 1 0 0 0 0 M CHG 1 31 1 M END