MMs01888474 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 55 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 1.5000 -0.0056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2548 1.2907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5511 0.5359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9586 2.0455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0096 2.5869 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4301 2.7422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2644 3.8887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0193 5.1850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5192 5.1794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2644 3.8776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7328 4.1840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8951 5.6752 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5271 6.2904 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2819 7.4651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8438 3.1762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5265 1.7102 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2721 3.6344 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3831 2.6266 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.8113 3.0849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9223 2.0770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6050 0.6110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7160 -0.3969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1443 0.0614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4616 1.5274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3506 2.5353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2553 -0.9464 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 15.9380 -2.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.6836 -0.4882 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 4.5096 2.5814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0022 0.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0045 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2872 -1.1866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0630 -0.2129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2491 0.0174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5880 -0.0680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8530 1.0544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2605 2.5640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0784 2.6493 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6566 1.5270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8034 3.5048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3481 4.6635 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8932 5.5996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2320 6.3660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5259 4.8073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0652 4.2577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4624 0.2444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4622 -1.5697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6043 1.8940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6045 3.7081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4032 1.9909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6357 2.1668 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 30 1 0 0 0 0 8 9 1 0 0 0 0 8 42 1 0 0 0 0 8 43 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 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M END