MMs00904981 MOE2007 2D CORINA 3.40 0006 02.08.2006 56 59 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 1.2949 -0.7572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2865 -2.2572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5814 -3.0144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8846 -2.2716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8929 -0.7716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1794 -3.0288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4826 -2.2860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7775 -3.0432 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0806 -2.3004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0890 -0.8004 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3755 -3.0576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3672 -4.5576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6621 -5.3148 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9652 -4.5720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2601 -5.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5633 -4.5864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5716 -3.0864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2767 -2.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9735 -3.0720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6787 -2.3148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6870 -0.8148 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 16.8748 -2.3436 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 16.1320 -1.0404 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.6175 -3.6468 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.1779 -1.6008 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.1863 -0.1009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4894 0.6419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7843 -0.1153 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.7760 -1.6152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4728 -2.3580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6058 1.0359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0359 0.6058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6058 -1.0359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 -2.8514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5747 -4.2143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9354 -0.1774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6047 1.1856 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 -3.9437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9457 -3.9523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7164 -1.3625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2590 -1.3710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7708 -4.2432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3246 -5.1518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2534 -6.5291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5992 -5.1921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2834 -1.1292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0033 -0.3027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7821 1.0290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.7232 1.5655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.2659 1.5569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.9589 -1.4134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.1801 -2.7451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.6964 -3.2730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.2390 -3.2815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 9 43 1 0 0 0 0 10 11 1 0 0 0 0 10 44 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 22 2 0 0 0 0 14 15 2 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 47 1 0 0 0 0 19 20 2 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 24 25 2 0 0 0 0 24 26 2 0 0 0 0 24 27 1 0 0 0 0 27 28 1 0 0 0 0 27 32 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 32 55 1 0 0 0 0 32 56 1 0 0 0 0 M END