MMs00029825 MOE2007 2D CORINA 3.40 0006 02.08.2006 65 67 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 1.1813 -0.9244 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5725 -0.3635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7539 -1.2878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5440 -2.7731 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1451 -0.7269 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3264 -1.6513 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.6370 -0.4922 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2729 -3.1503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6821 -3.6644 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.8336 -4.5129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6065 -2.4831 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7686 -1.2389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1055 -2.5365 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8088 -3.8614 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9013 -1.2650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4004 -1.3185 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1962 -0.0470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6952 -0.1004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3985 -1.4254 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.4910 1.1711 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.9301 2.5623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0799 3.5256 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 17.1192 4.1256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3514 2.7298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9875 1.2746 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 18.1466 1.5852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9508 0.1248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4367 -1.2843 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.9764 5.0220 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.6287 5.6806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3845 4.8427 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5251 7.1770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6873 8.4212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1837 8.5247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0945 -5.1066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5497 -5.4705 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7395 0.9451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9451 0.7395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7395 -0.9451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9374 0.6547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4649 0.4388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3129 0.4613 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0847 -2.9825 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9818 -4.3145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3199 -0.1259 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8285 -0.6763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7890 -0.8147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1517 -0.0914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0839 0.4034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4465 1.1266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8702 1.9997 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2598 3.5576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8782 3.8080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4787 2.3185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9717 5.6923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3660 6.8664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5906 7.9339 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3978 9.5857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3369 8.1931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3100 9.7180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.4282 0.3842 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0517 -6.1848 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3817 -7.3386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.1989 -0.5356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 41 1 0 0 0 0 3 42 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 9 10 1 0 0 0 0 9 44 1 0 0 0 0 9 45 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 36 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 46 1 0 0 0 0 13 47 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 48 1 0 0 0 0 16 49 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 50 1 0 0 0 0 18 51 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 30 1 0 0 0 0 25 26 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 2 0 0 0 0 28 62 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 33 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 33 57 1 0 0 0 0 34 35 1 0 0 0 0 34 58 1 0 0 0 0 34 59 1 0 0 0 0 35 60 1 0 0 0 0 35 61 1 0 0 0 0 36 37 2 0 0 0 0 36 63 1 0 0 0 0 62 65 1 0 0 0 0 63 64 1 0 0 0 0 M END