MMs01102938 MOE2007 2D CORINA 3.40 0006 02.08.2006 63 66 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 1.2992 0.7498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8972 0.7493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1962 -0.0009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4953 0.7489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0014 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0934 0.7484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 -0.0018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6915 0.7480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6917 2.2480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3928 2.9982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0937 2.2484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9909 2.9977 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.1480 4.4895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0334 5.4934 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6152 4.8011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3650 3.5019 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 15.9650 4.5412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3611 2.3874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6727 0.9201 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.7386 4.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2304 4.4012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8403 3.0308 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.9584 1.8174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4666 1.9745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.3320 2.8737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9419 1.5033 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 23.4336 1.3463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.3155 2.5596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.7057 3.9300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.2139 4.0871 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5998 1.0393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0393 -0.5998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5998 -1.0393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5280 1.6692 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0707 1.6689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8266 -0.9196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3693 -0.9198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1261 1.6687 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6687 1.6684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4246 -0.9200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9673 -0.9203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7241 1.6683 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2668 1.6680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3921 -1.2018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7306 0.1478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3930 4.1982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0545 2.8486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2446 5.9424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7116 5.2890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0696 5.7117 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6602 5.0845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.1469 5.5983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.3948 4.6913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.0368 1.2912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.6274 0.6640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.5501 0.7774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3022 1.6844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.9215 0.2499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 25.5089 2.4340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.4112 4.9007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8568 3.3449 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 6 7 1 0 0 0 0 6 44 1 0 0 0 0 6 45 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 46 1 0 0 0 0 10 11 1 0 0 0 0 10 47 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 48 1 0 0 0 0 13 49 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 50 1 0 0 0 0 17 51 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 63 1 0 0 0 0 20 21 2 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 22 63 1 0 0 0 0 23 24 1 0 0 0 0 23 54 1 0 0 0 0 23 55 1 0 0 0 0 24 25 1 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 56 1 0 0 0 0 25 57 1 0 0 0 0 26 58 1 0 0 0 0 26 59 1 0 0 0 0 26 63 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 29 30 1 0 0 0 0 29 60 1 0 0 0 0 30 31 2 0 0 0 0 30 61 1 0 0 0 0 31 32 1 0 0 0 0 31 62 1 0 0 0 0 M END