MMs02444096 MOE2007 2D CORINA 3.40 0006 02.08.2006 76 81 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 1.0059 -1.1127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5453 -2.5402 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4725 -0.7979 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4785 -1.9105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9451 -1.5957 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9510 -2.7084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4904 -4.1359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0238 -4.4508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0178 -3.3381 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5631 -5.8783 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.7057 -5.0151 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9174 -4.1310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4510 -2.7054 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3302 -1.4901 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.1711 -1.1795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8302 -1.4870 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.5196 -2.6462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2909 -0.0595 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.6015 1.0996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0756 0.8197 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.0363 1.4197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8638 -0.0644 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0725 2.3197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7720 3.0671 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7690 4.5671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4684 5.3144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1709 4.5618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8703 5.3092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8673 6.8092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1648 7.5618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4654 6.8144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7165 0.4069 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0254 1.8747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4511 2.3411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5678 1.3397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9935 1.8061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3024 3.2739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1856 4.2754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7600 3.8090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7144 -2.6988 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2058 -2.5390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0899 -3.7507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4826 -5.1223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3667 -6.3340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8582 -6.1742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4655 -4.8027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5814 -3.5909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8902 0.8048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8048 0.8902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8902 -0.8048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8410 0.3442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0594 -4.4995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2547 2.1137 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4807 3.4482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9512 4.3611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1771 5.6955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1733 3.3618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8323 4.7071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8269 7.4071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1624 8.7618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5034 7.4165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8261 1.9142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8560 3.0627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3207 0.1654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8869 1.0049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4429 3.6471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4327 5.4497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8666 4.6101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8727 -1.3861 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2833 -2.0108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2894 -5.2501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8809 -7.4313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5655 -7.1436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6587 -4.6748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0673 -2.4937 0.0000 H 0 0 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 52 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 14 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 53 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 23 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 41 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 33 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 54 1 0 0 0 0 24 55 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 56 1 0 0 0 0 26 57 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 58 1 0 0 0 0 29 30 1 0 0 0 0 29 59 1 0 0 0 0 30 31 2 0 0 0 0 30 60 1 0 0 0 0 31 32 1 0 0 0 0 31 61 1 0 0 0 0 32 62 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 34 63 1 0 0 0 0 34 64 1 0 0 0 0 35 36 1 0 0 0 0 35 40 2 0 0 0 0 36 37 2 0 0 0 0 36 65 1 0 0 0 0 37 38 1 0 0 0 0 37 66 1 0 0 0 0 38 39 2 0 0 0 0 38 67 1 0 0 0 0 39 40 1 0 0 0 0 39 68 1 0 0 0 0 40 69 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 42 70 1 0 0 0 0 42 71 1 0 0 0 0 43 44 1 0 0 0 0 43 48 2 0 0 0 0 44 45 2 0 0 0 0 44 72 1 0 0 0 0 45 46 1 0 0 0 0 45 73 1 0 0 0 0 46 47 2 0 0 0 0 46 74 1 0 0 0 0 47 48 1 0 0 0 0 47 75 1 0 0 0 0 48 76 1 0 0 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