MMs02390199 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 53 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 0.7434 -1.3028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5595 -2.0462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0462 -0.5595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4868 -2.6057 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9867 -2.6133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7433 -1.3181 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7301 -3.9161 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2301 -3.9238 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6301 -4.9630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9867 -2.6286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4867 -2.6362 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.2433 -1.3410 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.7433 -1.3486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4999 -0.0534 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.0999 0.9858 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7565 1.2494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2565 1.2571 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9998 -0.0610 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7432 -1.3639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9866 -2.6591 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2432 -1.3715 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9866 -2.6743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6838 -3.4177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7300 -3.9772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2894 -1.9309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9735 -5.2266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2169 -6.5218 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5211 0.2974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5947 1.0423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5211 -0.2974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8568 -1.5251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6017 -2.6409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0353 -3.0885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6409 -1.6017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0885 0.0353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7489 -0.0383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1249 -4.9523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8612 -2.2124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2011 -1.4479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5289 -2.5293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8688 -1.7648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6051 0.9751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0891 -2.3754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6415 -4.0124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9811 -3.9388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2088 -4.2745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3247 -5.0194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2511 -3.6798 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5868 -2.4521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3317 -1.3362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6947 -0.8887 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5131 2.5446 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 7.4735 -5.2342 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 27 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 19 1 0 0 0 0 17 18 2 0 0 0 0 17 53 1 0 0 0 0 19 20 1 0 0 0 0 19 43 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 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 27 28 2 0 0 0 0 27 54 1 0 0 0 0 M CHG 1 53 -1 M CHG 1 54 -1 M END