MMs00245298 MOE2007 2D CORINA 3.40 0006 02.08.2006 57 60 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 1.3055 0.7387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9035 0.7162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9165 2.2161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6240 2.9773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3185 2.2386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 2.9999 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2795 2.2612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2925 0.7612 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5719 3.0224 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6112 3.6224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5589 4.5224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1699 3.0450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4754 2.3063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4884 0.8063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1960 0.0451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8905 0.7838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7939 0.0676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9637 -1.4227 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.0789 -2.2334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4335 -1.7219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1948 -3.0143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6947 -3.0013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4334 -1.6958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6722 -0.4033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1722 -0.4164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1589 0.6896 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.9334 -1.6828 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.6370 4.4773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5910 1.0444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0444 -0.5910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 -1.0444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5876 -1.2225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9375 0.1072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9609 2.8071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0364 4.1998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3590 4.5120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5485 5.7223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7589 4.5328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9333 3.9709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3906 3.9575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8760 3.4374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6590 2.1082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5277 1.4063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9752 -0.8674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4326 -0.8808 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4898 -0.3474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7069 0.9819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6038 -4.0587 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3037 -4.0353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2631 0.6411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8370 4.4669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6474 5.6772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4371 4.4877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8774 2.2837 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.8382 1.6837 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 56 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 14 56 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 18 56 1 0 0 0 0 19 20 1 0 0 0 0 19 28 2 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 25 26 2 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 56 1 M END