MMs00027238 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 57 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 -1.4693 0.3021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6360 1.7928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2698 2.4120 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7413 1.3040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9401 2.5341 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.6814 1.2300 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1988 3.8381 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2441 3.2754 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5381 2.5167 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.5381 3.7167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5280 1.0167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8220 0.2581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1261 0.9994 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.1361 2.4993 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.1361 3.6993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8421 3.2580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3146 3.4273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9895 4.8916 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.7751 3.0852 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.4159 1.7281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9124 1.8305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.7494 0.5858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.0899 -0.7615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5934 -0.8639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7564 0.3808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2921 0.0557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9487 -1.4044 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.9269 -2.0062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.4234 -1.9038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.2604 -3.1485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.6009 -4.4958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.1044 -4.5982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.2674 -3.3535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.4379 -5.7405 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.4954 -1.0930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3557 -0.5068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9339 1.4374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2521 4.4753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3477 1.2330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1101 -0.1081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0446 -0.6560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5872 -0.6663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0769 4.1824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6196 4.1721 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5295 4.0184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4400 2.9083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.9466 0.6677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0658 -1.9417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.9510 -0.8260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.4576 -3.0666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5768 -5.6760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0702 -3.4355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 36 1 0 0 0 0 2 3 2 0 0 0 0 2 37 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 5 38 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 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 24 25 2 0 0 0 0 24 29 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 50 1 0 0 0 0 31 32 1 0 0 0 0 31 51 1 0 0 0 0 32 33 2 0 0 0 0 32 35 1 0 0 0 0 33 34 1 0 0 0 0 33 52 1 0 0 0 0 34 53 1 0 0 0 0 M END