MMs01263499 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 54 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 -0.0399 -1.4995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2387 -2.2838 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1730 -1.1102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7728 0.3354 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5778 -1.6362 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5117 -3.1347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6852 -4.0690 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0661 -3.5349 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8290 -0.8088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1711 -1.4787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2620 -2.9759 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4223 -0.6513 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8270 -1.1772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3762 -2.5731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8596 -2.7954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7939 -1.6219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2447 -0.2260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7613 -0.0037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9339 1.2475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4883 0.8473 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.7989 2.0064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3148 1.7815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 -3.0445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3593 -2.3053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6520 -3.0661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6396 -4.5660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3344 -5.3052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0416 -4.5445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3219 -6.8052 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.1996 -0.0319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0319 1.1996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1996 0.0319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6278 -1.3796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4802 -2.6158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6454 -4.6588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0033 0.0620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5432 0.1555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6288 -3.5119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2990 -3.9121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9806 -1.7998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9922 0.7128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9986 1.8012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4946 2.3642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0622 2.7203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3760 2.5290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5674 0.8427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3642 -1.7053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6962 -2.4747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6738 -5.1746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0026 -5.1358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 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 21 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 28 2 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 29 51 1 0 0 0 0 M END