MMs03652769 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 51 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 1.4999 0.0124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2607 -1.2803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7606 -1.2679 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5214 -2.5607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7822 -3.8659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5429 -5.1587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4998 0.0373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7391 1.3301 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9998 0.0497 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3998 1.0890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7390 1.3550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9783 2.6477 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7605 -1.2430 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2605 -1.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9997 0.0746 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0212 -2.5234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5212 -2.5109 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2604 -1.2057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7603 -1.1933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5211 -2.4861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0210 -2.4736 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7819 -3.7913 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.3905 -4.8255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2819 -3.8037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5427 -5.1089 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4995 0.1119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0099 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0099 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2818 1.1924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6241 0.4322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1365 -1.7001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4789 -2.4603 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4342 -1.7817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4470 -3.3244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8566 -3.1022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8694 -4.6448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5087 -5.7673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1515 -6.1929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5771 -4.5501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6646 0.5913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6518 2.1339 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5696 3.6919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1692 -2.2872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8970 -2.9431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2394 -3.7034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6518 -0.1715 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5437 -0.4794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0909 1.1561 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4554 0.7033 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 39 1 0 0 0 0 7 40 1 0 0 0 0 7 41 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 14 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 45 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 46 1 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 25 1 0 0 0 0 19 20 2 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 27 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 M END