MMs02388746 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 42 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 -1.3694 0.6121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2105 2.1037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2572 2.4134 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0053 1.1133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4969 0.9543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1050 -0.4169 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5965 -0.5759 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6019 0.5374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9713 -0.0747 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.9713 1.1253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8123 -1.5663 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3446 -1.8760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7325 -3.2454 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2714 0.6734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8695 0.6696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1674 -0.0823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1652 -1.5823 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8651 -2.3304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5672 -1.5785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3237 3.1090 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.7510 2.6475 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0097 4.5757 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.2478 -1.1741 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4095 0.0136 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2036 1.9241 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6321 1.2441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2034 1.5757 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5014 1.5937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0441 1.5915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6422 1.5877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0995 1.5900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5795 1.0447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3489 -0.2924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6351 -3.2508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0924 -3.2485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1551 -2.7056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3857 -1.3684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5694 -0.0785 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 9.5694 1.1215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 15 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 39 40 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M CHG 1 39 1 M END