MMs01109942 MOE2007 2D CORINA 3.40 0006 02.08.2006 68 73 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 0.7581 -1.2943 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3581 -0.2551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2581 -1.2849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0162 -2.5793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2743 -3.8830 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4743 -3.8830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7744 -3.8923 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4256 -3.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0163 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0325 -5.1961 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4675 -5.2054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2256 -3.9111 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2093 -6.5091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7093 -6.5185 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7539 -7.7017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1712 -9.0839 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2907 -7.6254 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.4421 -6.7769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9417 -6.0436 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.2523 -4.8844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6855 -5.4403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3970 -3.9683 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0248 -7.5996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5749 -8.9962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1640 -9.1456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5967 -10.4548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4404 -11.6017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8531 -11.4397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4214 -10.1426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8628 -8.7042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3721 -8.0182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4886 -6.9444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9793 -5.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3547 -5.4182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2358 -6.4969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7435 -7.8025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9516 -9.7360 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -7.3739 -6.1408 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.0325 -5.1773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2906 -6.4810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5324 -5.1679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0355 0.6065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6065 1.0355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0355 -0.6065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0423 -0.1045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3831 -0.8675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9306 -1.8022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9403 -3.3448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9078 -1.8324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8982 -3.3751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0791 -6.9125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4103 -7.6922 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4534 -8.1785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4043 -10.5898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9608 -12.7016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5659 -12.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2175 -4.7227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7768 -4.2949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4200 -6.3032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5010 -8.7332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6325 -6.2165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2476 -5.8875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6971 -7.5239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3336 -7.0745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5399 -6.3679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7324 -5.1604 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5249 -3.9679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 1 45 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 10 1 0 0 0 0 4 5 1 0 0 0 0 4 46 1 0 0 0 0 4 47 1 0 0 0 0 5 6 1 0 0 0 0 5 48 1 0 0 0 0 5 49 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 40 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 10 50 1 0 0 0 0 10 51 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 52 1 0 0 0 0 14 53 1 0 0 0 0 15 16 1 0 0 0 0 15 22 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 31 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 24 1 0 0 0 0 22 23 2 0 0 0 0 24 25 1 0 0 0 0 24 33 1 0 0 0 0 24 39 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 27 55 1 0 0 0 0 28 29 2 0 0 0 0 28 56 1 0 0 0 0 29 30 1 0 0 0 0 29 57 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 38 1 0 0 0 0 32 33 1 0 0 0 0 32 37 2 0 0 0 0 33 34 2 0 0 0 0 34 35 1 0 0 0 0 34 58 1 0 0 0 0 35 36 2 0 0 0 0 35 59 1 0 0 0 0 36 37 1 0 0 0 0 36 60 1 0 0 0 0 37 61 1 0 0 0 0 40 41 1 0 0 0 0 40 42 1 0 0 0 0 40 62 1 0 0 0 0 41 63 1 0 0 0 0 41 64 1 0 0 0 0 41 65 1 0 0 0 0 42 66 1 0 0 0 0 42 67 1 0 0 0 0 42 68 1 0 0 0 0 M END