MMs01126613 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 57 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 -1.4507 0.3816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2618 -0.8801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3125 -2.0415 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0854 -1.4976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7594 -0.9655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4343 -2.3051 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6116 -3.5594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2864 -4.8990 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.0864 -4.8990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5993 -6.2324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6551 -7.2979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9947 -6.6230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7669 -5.1404 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9318 -2.3905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6067 -3.7301 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7545 -1.1362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2521 -1.2216 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.9270 -2.5612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1812 -3.3839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8416 -4.0588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0748 0.0326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4000 1.3723 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.5724 -0.0527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3951 1.2015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8927 1.1162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5675 -0.2234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7448 -1.4777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2473 -1.3923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.0651 -0.3088 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.9291 0.7594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8858 1.4999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0948 -2.1465 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6186 0.2262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9086 -0.6199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7377 -2.7370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6499 -4.2772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5959 -5.5742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8399 -7.1615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7191 -8.0488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3041 -8.3073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4196 -7.7453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1552 -6.3177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6521 -0.6623 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0298 0.0318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9662 -1.9612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5924 -2.9470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8990 -4.3456 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6499 -4.1996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1872 -5.2079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8552 2.2732 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5508 2.1196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2847 -2.5494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9182 -1.8940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 15 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 22 23 2 0 0 0 0 22 24 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 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 29 54 1 0 0 0 0 M END