MMs02555613 MOE2007 2D CORINA 3.40 0006 02.08.2006 49 52 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 -0.0082 -1.5000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0310 -0.9000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2867 -2.2571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2785 -3.7570 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5898 -1.5142 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8848 -2.2712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8766 -3.7712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1715 -4.5283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4746 -3.7854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4828 -2.2854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1879 -1.5283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7859 -1.5425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9509 -0.0516 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4198 0.2522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1768 1.5472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6768 1.5390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4197 0.2359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6626 -1.0591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1627 -1.0509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1529 -2.1601 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.3113 -2.2429 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6062 -1.4858 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.8491 -0.1909 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3633 -2.7807 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9012 -0.7287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8930 0.7713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1879 1.5283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4910 0.7854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4992 -0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2043 -1.4716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8023 -1.4574 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -0.0066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0066 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5964 -0.3142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8341 -4.3655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1650 -5.7283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5106 -4.3911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1944 -0.3284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5825 2.5897 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2825 2.5749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6197 0.2293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2570 -2.1016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3179 -3.4429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8505 1.3656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1813 2.7283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5269 1.3911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2108 -2.6716 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 4 1 0 0 0 0 2 22 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 36 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 40 1 0 0 0 0 13 14 2 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 29 30 2 0 0 0 0 29 48 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 31 49 1 0 0 0 0 M END