MMs00915268 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 1.4881 -0.1882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2920 -2.8540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2720 -3.9896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6549 -3.4085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5296 -1.9138 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2190 -0.7547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6652 -0.9338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0817 -1.4273 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2173 -0.4473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9364 1.0262 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6338 -0.9408 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.7853 -1.7893 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9147 -2.4143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7791 -3.3942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0599 -4.8677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4764 -5.3612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6121 -4.3812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -2.9077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4668 -1.9278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8833 -2.4213 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1859 -0.4543 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7694 0.0392 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.6180 0.8877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4885 1.5127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0720 2.0061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7912 3.4796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9268 4.4596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3433 3.9661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6242 2.4926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6459 5.9331 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 12.3215 0.5257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7380 0.0322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8737 1.0122 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.2902 0.5187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1506 1.1905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1905 0.1506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1506 -1.1905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4297 1.0104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6584 0.0775 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4705 -3.7287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3363 -2.1284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2865 -4.6744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8500 -5.0413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0016 -4.5574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8337 -3.1838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7354 -0.1752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2508 0.1136 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3064 -2.6061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6459 -2.9995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1514 -5.6517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7011 -6.5400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7453 -4.7760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6178 1.6142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6580 3.8744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2518 4.7501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7574 2.0978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3917 1.2842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9071 1.5731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1525 -1.0152 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6679 -0.7264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8954 -0.6145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4234 0.1239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6850 1.6519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0692 -1.5711 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 0.8692 -1.5711 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 39 1 0 0 0 0 2 40 1 0 0 0 0 2 65 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 3 65 1 0 0 0 0 4 5 1 0 0 0 0 4 43 1 0 0 0 0 4 44 1 0 0 0 0 5 6 1 0 0 0 0 5 45 1 0 0 0 0 5 46 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 65 1 0 0 0 0 8 9 1 0 0 0 0 8 47 1 0 0 0 0 8 48 1 0 0 0 0 9 10 1 0 0 0 0 9 49 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 23 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 50 1 0 0 0 0 16 17 1 0 0 0 0 16 51 1 0 0 0 0 17 18 2 0 0 0 0 17 52 1 0 0 0 0 18 19 1 0 0 0 0 18 53 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 32 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 27 55 1 0 0 0 0 28 29 2 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 29 56 1 0 0 0 0 30 57 1 0 0 0 0 32 33 1 0 0 0 0 32 58 1 0 0 0 0 32 59 1 0 0 0 0 33 34 1 0 0 0 0 33 60 1 0 0 0 0 33 61 1 0 0 0 0 34 35 1 0 0 0 0 35 62 1 0 0 0 0 35 63 1 0 0 0 0 35 64 1 0 0 0 0 65 66 1 0 0 0 0 M CHG 1 65 1 M END