MMs03072719 MOE2007 2D CORINA 3.40 0006 02.08.2006 50 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 -0.7591 -1.2938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2590 -1.2833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9999 0.0210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2409 1.3148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9817 2.6190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4817 2.6295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2408 1.3358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4999 0.0315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2590 -1.2623 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.8590 -0.2230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5181 -2.5665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0181 -2.5770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2772 -3.8813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0363 -5.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5363 -5.1645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2772 -3.8603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7771 -3.8498 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -5.2953 -6.4583 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -7.4998 0.0525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9998 0.0630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7589 -1.2308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0180 -2.5350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5180 -2.5455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2588 -1.2203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9997 0.0840 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 -0.6073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6073 1.0350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0350 0.6073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3657 -1.7121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9757 -2.4740 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0409 1.3064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3745 3.6540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0744 3.6729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4407 1.3442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7145 -2.0595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0773 -3.8897 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4436 -6.2184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6999 1.2357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3693 0.4550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7831 1.2433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1245 0.4813 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3589 -0.1915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1484 -2.9375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8179 -3.7182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7346 -3.7258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3933 -2.9638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7589 -1.2518 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.0179 -2.5140 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.2179 -2.5056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 48 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 49 50 1 0 0 0 0 M END