MMs02528313 MOE2007 2D CORINA 3.40 0006 02.08.2006 61 64 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 -0.3036 -1.4689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6705 -2.0867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5054 -3.5776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0364 -3.8812 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4578 -4.9747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7063 -2.5780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1972 -2.4129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7996 -1.0391 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0856 -3.6214 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5765 -3.4563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6144 -4.5875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9737 -1.3440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2685 -2.1013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6423 -1.4989 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.8014 -1.1883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6397 -2.6192 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8824 -3.9140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4848 -5.2877 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4170 -3.5939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2966 -4.5914 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.1323 -2.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0072 -3.6892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3747 -4.7593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8673 -4.6108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4851 -3.2440 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.6102 -2.0255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1176 -2.1739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9624 -0.0334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3361 0.5690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1876 2.0616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7222 2.3817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9649 1.0869 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.9821 0.1560 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1752 -0.2429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2429 1.1752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1752 0.2429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7086 -4.6490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7692 -3.3242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4444 -2.2636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4224 -3.7003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5017 -5.3955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8065 -5.4748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8080 -1.3154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2138 -1.9508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9257 -4.2092 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3315 -4.8446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6990 -5.9146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2932 -5.2792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7769 -5.8074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0300 -4.9077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6917 -1.5055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2860 -0.8702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2080 -0.9773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9549 -1.8771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3719 -0.0368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0839 2.8596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2403 3.4807 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9463 0.7618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4998 -3.5408 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -10.1892 -4.6999 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 2 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 29 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 23 60 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 24 60 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 28 60 1 0 0 0 0 29 30 2 0 0 0 0 29 33 1 0 0 0 0 30 31 1 0 0 0 0 30 56 1 0 0 0 0 31 32 2 0 0 0 0 31 57 1 0 0 0 0 32 33 1 0 0 0 0 32 58 1 0 0 0 0 34 59 1 0 0 0 0 60 61 1 0 0 0 0 M CHG 1 60 1 M END