MMs00892856 MOE2007 2D CORINA 3.40 0006 02.08.2006 61 63 0 0 0 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 -0.3242 -1.4646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7821 -2.4776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2125 -2.0260 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4579 -3.9421 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9174 -4.5407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7732 -6.0338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6914 -6.3579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4523 -5.0652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9522 -5.0778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6913 -6.3831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9304 -7.6758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4305 -7.6632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6695 -8.9811 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.7131 -3.7851 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.0058 -4.5460 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4204 -3.0242 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4739 -2.4924 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9739 -2.5050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7347 -1.2123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2347 -1.2248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9738 -2.5301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4737 -2.5427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2346 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4955 0.0553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9956 0.0679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2564 1.3480 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5173 2.6533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2782 3.9460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7345 -1.2626 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4736 -2.5679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9736 -2.5804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1716 -0.2593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2593 1.1716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1716 0.2593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -1.0057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9686 -2.4768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2787 -3.3964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0933 -4.7804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9731 -6.0237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9086 -7.2261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8912 -6.3931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8218 -8.6974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8827 -1.4482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7556 -3.6849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0980 -2.9248 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6106 -0.7924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9530 -0.0323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3651 -3.5643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0650 -3.5869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4043 1.1121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5916 1.8897 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6045 3.4323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3123 3.3373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8869 4.9801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2440 4.5547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3426 -2.9688 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6721 -3.7513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9635 -3.7804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1735 -2.5905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9836 -1.3805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 2 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 43 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 20 48 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 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 24 25 2 0 0 0 0 24 30 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 32 59 1 0 0 0 0 32 60 1 0 0 0 0 32 61 1 0 0 0 0 M END