MMs01447962 MOE2007 2D CORINA 3.40 0006 02.08.2006 50 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 -0.7452 1.3018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2451 1.3074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9903 2.6092 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5903 3.6485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2355 3.9055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4903 2.6148 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2451 1.3186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 0.0168 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7451 1.3242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4903 2.6260 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9903 2.6316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7451 1.3353 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7354 3.9334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5032 5.2220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5149 6.3504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1363 5.7592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2726 4.2654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1637 3.4752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7308 2.0865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.2170 1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.1361 3.0687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5690 4.4574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0828 4.6606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.6222 2.8655 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.0415 -0.5961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5961 -1.0415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0415 0.5961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3840 1.7080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9491 2.4844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0412 0.1249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3743 0.9012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1985 3.3016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6316 4.9425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2725 4.5093 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0864 3.6563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5411 0.1416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8743 0.9179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4642 4.5034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3183 6.1027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4953 7.0423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9292 7.3978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7812 6.9054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9592 5.5258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1308 3.0738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0727 4.2818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9955 1.1381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6706 0.7723 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3042 5.4058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6291 5.7716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 7 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 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 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 24 50 1 0 0 0 0 M END