MMs00217773 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 57 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 -0.7423 -1.3035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2423 -1.3123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9846 -2.6158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4845 -2.6247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2268 -3.9281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4692 -5.2227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2115 -6.5262 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9692 -5.2138 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3630 -6.2495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2269 -3.9104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7269 -3.9015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0154 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5154 -2.5892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7268 -3.9370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4845 -2.6424 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7422 -1.3390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4999 -0.0444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7576 1.2591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5152 2.5536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0152 2.5448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7575 1.2413 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.9998 -0.0533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9845 -2.6513 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.9933 -1.1513 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9756 -4.1513 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.4844 -2.6602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2267 -3.9636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7267 -3.9725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4844 -2.6779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7421 -1.3745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2421 -1.3656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.9844 -2.6868 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0428 -0.5938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5938 1.0428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0428 0.5938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8484 -0.2767 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0907 -1.5890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1208 -4.9371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5225 -3.7891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7153 -2.5820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5082 -1.3892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5114 -5.1175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8520 -4.3541 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8184 -2.1049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8275 -0.5622 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5576 1.2662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9214 3.5964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6214 3.5804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5937 -1.0960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6206 -4.9993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3205 -5.0153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3482 -0.3388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6483 -0.3228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 13 2 0 0 0 0 3 4 2 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 15 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 14 42 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 24 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 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 21 22 2 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 23 50 1 0 0 0 0 24 25 2 0 0 0 0 24 26 2 0 0 0 0 24 27 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 30 31 2 0 0 0 0 30 33 1 0 0 0 0 31 32 1 0 0 0 0 31 53 1 0 0 0 0 32 54 1 0 0 0 0 M END