MMs01381487 MOE2007 2D CORINA 3.40 0006 02.08.2006 60 63 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 1.5000 -0.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2428 -1.3114 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4856 -2.6063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0143 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7428 -1.3197 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7345 -2.8197 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7511 0.1803 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2428 -1.3280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9856 -2.6311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4856 -2.6394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2427 -1.3445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 -0.0331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7427 -1.3528 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4998 -0.0579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9998 -0.0662 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.3998 0.9730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7570 1.2287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2569 1.2204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0141 2.5153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2713 3.8185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7713 3.8267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0141 2.5318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5142 2.5401 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 15.0284 5.1133 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 12.7426 -1.3693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1250 -2.7363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2342 -3.7461 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.1021 -4.9388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5373 -3.0033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2335 -1.5344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3538 -0.5368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7778 -1.0082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0815 -2.4771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9613 -3.4747 0.0000 C 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 -0.0033 -0.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2981 1.1746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6299 0.3959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6110 -3.0229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2708 -3.7869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 -1.9980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2143 -2.5914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0209 -3.7980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3799 -3.6670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0798 -3.6819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4057 1.0094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3369 -2.3953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3745 0.3587 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7147 1.1227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8512 0.1779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2141 2.5087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1770 4.8693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9499 -2.9793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1108 0.6383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6740 -0.2102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2208 -2.8543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2043 -4.6498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4999 -0.0414 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 39 1 0 0 0 0 2 40 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 4 41 1 0 0 0 0 4 42 1 0 0 0 0 5 43 1 0 0 0 0 5 44 1 0 0 0 0 5 45 1 0 0 0 0 6 7 2 0 0 0 0 6 8 2 0 0 0 0 6 9 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 46 1 0 0 0 0 11 12 2 0 0 0 0 11 47 1 0 0 0 0 12 14 1 0 0 0 0 12 60 1 0 0 0 0 13 48 1 0 0 0 0 13 60 2 0 0 0 0 14 15 1 0 0 0 0 14 49 1 0 0 0 0 15 16 1 0 0 0 0 15 50 1 0 0 0 0 15 51 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 26 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 52 1 0 0 0 0 20 21 1 0 0 0 0 20 53 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 54 1 0 0 0 0 23 24 1 0 0 0 0 26 27 2 0 0 0 0 26 31 1 0 0 0 0 27 28 1 0 0 0 0 27 55 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 30 35 2 0 0 0 0 31 32 2 0 0 0 0 32 33 1 0 0 0 0 32 56 1 0 0 0 0 33 34 2 0 0 0 0 33 57 1 0 0 0 0 34 35 1 0 0 0 0 34 58 1 0 0 0 0 35 59 1 0 0 0 0 M END