MMs01452583 MOE2007 2D CORINA 3.40 0006 02.08.2006 59 61 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 0.7556 -1.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0112 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2556 -1.2894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0111 -2.5852 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2667 -3.8874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0223 -5.1832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2779 -6.4855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5223 -5.1768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5111 -2.5787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2667 -3.8745 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2555 -1.2765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7555 -1.2700 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6320 -0.0527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1623 1.3718 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0605 -0.5101 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.0605 0.6899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0670 -2.0101 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6424 -2.4798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1850 -3.9083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2703 0.3767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6432 -0.2275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9614 -1.6933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4538 -1.8437 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.0583 -2.8804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0580 -0.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9390 0.5281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2446 1.9966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6691 2.4663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7882 1.4674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4826 -0.0012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0366 0.6045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6045 1.0366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0366 -0.6045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4444 -1.2958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0306 -2.0025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5844 -3.6398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5321 -2.8958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0421 -0.1085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3814 -0.8741 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8054 -3.5037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3508 -4.6627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6223 -6.2225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2361 -5.8899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6823 -7.5273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3197 -7.0810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5274 -6.3768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7223 -5.1716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5171 -3.9768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1261 -0.8709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4588 -0.0938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0408 -2.7113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4035 1.2066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9370 1.3745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1622 -2.5886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3493 2.7958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9136 3.6411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9278 1.8431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3778 -0.8003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 43 1 0 0 0 0 8 44 1 0 0 0 0 8 45 1 0 0 0 0 8 46 1 0 0 0 0 9 47 1 0 0 0 0 9 48 1 0 0 0 0 9 49 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 50 1 0 0 0 0 12 51 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 21 1 0 0 0 0 18 19 1 0 0 0 0 18 52 1 0 0 0 0 19 20 2 0 0 0 0 21 22 1 0 0 0 0 21 53 1 0 0 0 0 21 54 1 0 0 0 0 22 23 2 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 55 1 0 0 0 0 24 25 1 0 0 0 0 24 26 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 28 29 1 0 0 0 0 28 56 1 0 0 0 0 29 30 2 0 0 0 0 29 57 1 0 0 0 0 30 31 1 0 0 0 0 30 58 1 0 0 0 0 31 59 1 0 0 0 0 M END