MMs02864394 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 39 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 0.7513 1.2983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0025 2.5981 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2513 1.2969 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0029 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6000 -1.0421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2513 1.2940 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.9529 2.0452 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5496 0.5427 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0025 2.5923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5025 2.5908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2538 3.8891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7538 3.8877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5025 2.5879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7513 1.2896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2513 1.2911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0025 2.5865 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 12.7512 1.2867 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7538 3.8848 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.2487 -1.3012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7487 -1.2998 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9975 -2.6010 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2462 -3.8993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0387 0.6010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6010 -1.0387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0387 -0.6010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8523 2.3355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2905 -1.1859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6272 -0.4159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8753 3.0038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2120 3.7738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6548 4.9290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3548 4.9263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3502 0.2498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6502 0.2524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2076 -3.2983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6452 -4.9379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2849 -4.5003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 21 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M END