MMs03929949 MOE2007 2D CORINA 3.40 0006 02.08.2006 48 50 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 0.7473 1.3006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2473 1.3037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2527 -1.2944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7527 -1.2975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2473 1.3099 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8473 2.3492 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4946 2.6074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2419 3.9080 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7473 1.3131 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 0.0156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7527 -1.2850 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 0.0187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7527 -1.2788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2527 -1.2757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0054 -2.5731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5054 -2.5700 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.2581 -3.8675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7581 -3.8644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5108 -5.1619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9773 -4.8469 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.8708 -5.6480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1310 -3.3548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7594 -2.7476 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.7635 -6.4624 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2635 -6.4656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5108 -5.1681 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1451 2.3386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5462 1.8239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8549 -2.3323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1549 -2.3380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2941 -1.1728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6285 -0.3987 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3451 2.3535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7891 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1268 0.4315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6259 -1.6915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9635 -2.4601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0418 -0.0943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3795 -0.8629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8786 -2.9859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2162 -3.7545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.1690 -2.7527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6656 -7.5060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9946 2.6043 0.0000 O 0 5 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 10 11 2 0 0 0 0 10 48 1 0 0 0 0 12 13 1 0 0 0 0 12 37 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 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 29 2 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 25 46 1 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 M CHG 1 48 -1 M END