MMs01762608 MOE2007 2D CORINA 3.40 0006 02.08.2006 65 66 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 0.0077 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2538 -1.2924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0089 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6000 -1.0304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2461 1.3146 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7461 1.3190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 0.0222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 0.0266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7461 1.3279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9923 2.6247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4923 2.6202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7384 3.9171 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 11.2461 1.3323 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.2417 2.8323 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2505 -0.1677 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7461 1.3367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4923 2.6380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9923 2.6424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7461 1.3456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9999 0.0443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4999 0.0399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7538 -1.2525 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 17.2461 1.3500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.9922 2.6513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4922 2.6557 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 18.8922 3.6949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.2461 1.3589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.4922 2.6646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.4999 0.0665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2384 3.9570 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.6353 4.9944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2461 1.3057 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8431 2.3467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 0.6031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6031 1.0375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0375 -0.6031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0333 -2.0011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5892 -3.6391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0487 -3.1950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3827 -1.6995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0489 -2.4748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2951 -1.1691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6288 -0.3938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9030 -1.0188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6030 -1.0108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5892 3.6657 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8892 3.6754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5892 3.6834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9030 -1.0011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8634 3.0584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1971 3.8337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.1197 0.9451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.4579 0.1777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.5332 2.0677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.0891 3.7056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.4512 3.2615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.4624 -0.5366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.1030 -0.9709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.5374 0.6696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7538 -1.2968 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.4462 -1.2968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.7461 1.3633 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 22.9461 1.3633 0.0000 H 0 0 0 0 0 0 0 0 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 1 62 1 0 0 0 0 2 39 1 0 0 0 0 2 40 1 0 0 0 0 2 41 1 0 0 0 0 2 62 1 0 0 0 0 3 4 1 0 0 0 0 3 42 1 0 0 0 0 3 43 1 0 0 0 0 3 62 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 34 1 0 0 0 0 6 7 1 0 0 0 0 6 44 1 0 0 0 0 6 45 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 46 1 0 0 0 0 10 11 1 0 0 0 0 10 47 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 48 1 0 0 0 0 13 14 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 51 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 32 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 29 64 1 0 0 0 0 30 56 1 0 0 0 0 30 57 1 0 0 0 0 30 58 1 0 0 0 0 30 64 1 0 0 0 0 31 59 1 0 0 0 0 31 60 1 0 0 0 0 31 61 1 0 0 0 0 31 64 1 0 0 0 0 32 33 1 0 0 0 0 34 35 1 0 0 0 0 62 63 1 0 0 0 0 64 65 1 0 0 0 0 M CHG 1 62 1 M CHG 1 64 1 M END