MMs03225245 MOE2007 2D CORINA 3.40 0006 02.08.2006 75 79 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 -0.7580 -1.2944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0161 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7741 -3.8924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2741 -3.8831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0160 -2.5795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2580 -1.2851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0321 -5.1775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5321 -5.1682 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2902 -6.4811 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0482 -7.7755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3062 -9.0792 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5062 -9.0792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9248 -10.4457 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.2354 -11.6048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8163 -11.4563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5127 -10.7143 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3358 -9.8658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8155 -9.2452 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8538 -11.3329 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0728 -10.4587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4393 -11.0773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5869 -12.5700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9534 -13.1886 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3679 -13.4442 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4859 -14.6384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0014 -12.8256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2176 -13.6998 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6583 -10.2032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0248 -10.8217 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2437 -9.9476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6103 -10.5662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8292 -9.6920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1957 -10.3106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3433 -11.8033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1243 -12.6775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7578 -12.0589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3940 -10.7485 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8663 -12.1721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8695 -13.2931 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3354 -12.4749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8078 -13.8986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2769 -14.2014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2737 -13.0805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8013 -11.6568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3322 -11.3540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7428 -13.3833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0355 -0.6064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6064 1.0355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0355 0.6064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1839 -2.6055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1806 -4.9353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2160 -2.5720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8516 -0.2422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9627 -6.9985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9722 -8.5411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7131 -12.2537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1170 -12.4314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9547 -9.2646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8002 -9.3643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3354 -9.2125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3857 -9.1087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9209 -8.9569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7112 -8.4978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1709 -9.6113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4365 -12.2982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2424 -13.8717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7826 -12.7582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0103 -14.7953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6548 -15.3403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5987 -10.7601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9543 -10.2151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9850 -12.2080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9181 -13.6255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5006 -14.5586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 48 1 0 0 0 0 1 49 1 0 0 0 0 1 50 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 51 1 0 0 0 0 4 5 1 0 0 0 0 4 52 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 53 1 0 0 0 0 7 54 1 0 0 0 0 8 9 2 0 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