MMs01839862 MOE2007 2D CORINA 3.40 0006 02.08.2006 37 39 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 -0.7576 1.2946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0152 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4848 2.6068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2424 1.3122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 0.0088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7423 1.3209 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 0.0263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8978 -1.3476 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0184 -2.3447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3130 -1.5871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9926 -0.1218 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.6869 -2.1892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8524 -3.6801 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8952 -1.3005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7297 0.1904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9381 1.0791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3120 0.4770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4775 -1.0138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2691 -1.9026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5203 1.3658 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 4.8703 -3.8374 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7728 3.8927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0674 3.1351 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.5219 4.6502 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.5303 5.1873 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.5939 -1.0427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9576 1.2876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0787 3.6495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1060 -1.0269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3363 2.3637 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6306 0.6720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8057 2.2718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5765 -1.4955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4015 -3.0952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7769 -4.3319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8453 -4.5371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 20 35 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 M END