MMs02865330 MOE2007 2D CORINA 3.40 0006 02.08.2006 66 69 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 -1.2932 0.7600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2816 2.2600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0232 2.9999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3164 2.2399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3048 0.7399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0201 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.3580 1.2731 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8380 -1.3133 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8912 -0.7802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4892 -0.8003 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6344 -2.2933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5120 -3.2883 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0992 -2.6165 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8592 -1.3233 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8642 -0.2008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1874 1.2639 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3592 -1.3349 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.5592 -1.3349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0991 -2.6397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3390 -3.9329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8391 -3.9213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1192 -0.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3793 1.2631 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6192 -0.0534 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.3792 1.2398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8792 1.2282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6392 2.5214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1392 2.5098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8791 1.2050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1190 -0.0882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6191 -0.0766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3790 1.1933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.1391 2.4865 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 21.3390 2.4772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.5471 3.5304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5748 3.0200 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.0093 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3370 0.1681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0325 4.1999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3603 2.8318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1127 -1.6934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6554 -1.7054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4318 0.8849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9744 0.8730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2990 -2.6490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9310 -4.9768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7083 -4.3230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0383 -5.1046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2111 -1.0972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2548 1.6590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5967 2.4199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2792 2.2674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5148 2.9405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8567 3.7015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9400 3.6931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2699 2.9114 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4791 2.2442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2435 -0.5074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9015 -1.2684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4883 -0.4783 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8183 -1.2600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.1189 -0.1115 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 19.5109 -1.1460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.3189 -0.1208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 39 1 0 0 0 0 2 3 2 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 4 5 2 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 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 43 1 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 11 45 1 0 0 0 0 11 46 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 2 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 24 1 0 0 0 0 21 22 2 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 33 1 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 30 31 1 0 0 0 0 30 57 1 0 0 0 0 30 58 1 0 0 0 0 31 32 1 0 0 0 0 31 34 1 0 0 0 0 31 59 1 0 0 0 0 32 33 1 0 0 0 0 32 60 1 0 0 0 0 32 61 1 0 0 0 0 33 62 1 0 0 0 0 33 63 1 0 0 0 0 34 35 2 0 0 0 0 34 64 1 0 0 0 0 35 36 1 0 0 0 0 35 37 1 0 0 0 0 64 65 1 0 0 0 0 64 66 1 0 0 0 0 M CHG 1 35 1 M END