MMs01238682 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 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 0.7528 1.2974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2528 1.2942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2472 -1.3038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7472 -1.3006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0096 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5032 1.4904 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4968 -1.5096 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -0.0128 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7528 1.2846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2528 1.2814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 -0.0192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2472 -1.3166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7472 -1.3134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5000 -0.0224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2472 -1.3230 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2527 1.2750 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7527 1.2719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5000 -0.0288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0000 -0.0320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7527 1.2655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0055 2.5661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5055 2.5693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7583 3.8699 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 15.7472 -1.3326 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1550 2.3379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8550 2.3322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8450 -2.3443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 -2.3386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6260 1.6975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9637 2.4660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0469 2.4637 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3813 1.6895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6000 -1.0584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3740 -1.7295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0363 -2.4979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6187 -1.7214 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9531 -2.4956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6550 2.3156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8978 -1.0667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9527 1.2629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6077 3.6040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 M END