MMs00865872 MOE2007 2D CORINA 3.40 0006 02.08.2006 60 64 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 1.5000 0.0063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -1.2896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7554 -1.2833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7445 1.3148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2445 1.3085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4891 2.6043 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 0.0252 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8765 1.2424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3050 0.7848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3113 -0.7151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8867 -1.1846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5810 -2.6532 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6999 -3.6522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1245 -3.1827 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4303 -1.7141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8549 -1.2446 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.9738 -2.2437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3984 -1.7741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5173 -2.7732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9420 -2.3037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0609 -3.3027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7552 -4.7712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3306 -5.2407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2116 -4.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8741 -5.7702 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 16.8751 -6.8891 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.8731 -4.6513 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.9930 -6.7692 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.5149 1.6716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8877 1.0673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0975 1.9540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9345 3.4451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5616 4.0495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3518 3.1627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6598 -2.3313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3598 -2.3200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3402 2.3565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5009 2.3821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4553 -4.8270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9772 -0.6572 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0313 -2.9864 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5416 -3.3008 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8306 -0.7170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3409 -1.0314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1865 -1.1288 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2006 -2.9271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0860 -6.4155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0719 -4.6173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.7485 -7.9440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.1327 -6.3936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9529 0.4708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1958 1.4705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9023 4.1545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4312 5.2424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2535 3.6462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 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 40 1 0 0 0 0 4 5 1 0 0 0 0 4 41 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 23 51 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 26 53 1 0 0 0 0 27 28 2 0 0 0 0 27 29 2 0 0 0 0 27 30 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 31 32 1 0 0 0 0 31 36 2 0 0 0 0 32 33 2 0 0 0 0 32 56 1 0 0 0 0 33 34 1 0 0 0 0 33 57 1 0 0 0 0 34 35 2 0 0 0 0 34 58 1 0 0 0 0 35 36 1 0 0 0 0 35 59 1 0 0 0 0 36 60 1 0 0 0 0 M END