MMs02829968 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 58 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 0.7546 -1.2964 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4454 -1.2964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0092 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7638 -3.8944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2638 -3.8891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0092 -2.5874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2546 -1.2910 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2454 1.3070 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2546 -1.2804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7546 -1.2751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 0.0266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7453 1.3230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2454 1.3177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 0.0319 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7453 1.3336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1304 2.7018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2415 3.7094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0794 5.2006 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5432 2.9640 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2365 1.4957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2442 0.3845 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9114 3.5790 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.9114 2.3790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2130 2.8336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3242 3.8412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7092 5.2094 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.6254 6.7070 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.9922 5.9865 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2180 5.0473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6621 3.0084 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0371 0.6037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6037 1.0371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0371 -0.6037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9128 -1.8300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9073 -3.3727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3624 -4.3089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9764 -5.0755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0596 -5.0716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3929 -4.2955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9312 -3.3555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9257 -1.8128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6583 -2.3218 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3582 -2.3122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3417 2.3643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6417 2.3547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6036 -1.0052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5112 1.8603 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1077 2.0338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0330 2.8729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3613 4.4449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0242 5.1685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2138 6.2473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 43 1 0 0 0 0 7 44 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 13 46 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 47 1 0 0 0 0 16 48 1 0 0 0 0 17 18 1 0 0 0 0 17 49 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 33 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 25 1 0 0 0 0 23 24 2 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 32 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 29 30 2 0 0 0 0 29 31 2 0 0 0 0 29 32 1 0 0 0 0 32 54 1 0 0 0 0 32 55 1 0 0 0 0 M END