MMs00559230 MOE2007 2D CORINA 3.40 0006 02.08.2006 38 39 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 -0.7413 -1.3040 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2412 -1.3141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9999 -0.0202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4999 -0.0302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2412 -1.3343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4824 -2.6283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9825 -2.6182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7411 -1.3444 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.1411 -0.3051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4824 -2.6484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7237 -3.9424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4649 -5.2464 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4998 -0.0504 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.9998 -0.0605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7411 -1.3645 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7585 1.2335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0173 2.5375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7760 3.8315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2759 3.8214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0172 2.5174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2585 1.2234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5172 2.5073 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0432 -0.5930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5930 1.0432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0432 0.5930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4069 1.0231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1069 1.0049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7789 -3.1499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3755 -3.6534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4068 -1.8833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3964 -3.4259 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9068 0.9928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8173 2.5456 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1830 4.8748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8829 4.8566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8515 0.1802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2237 -3.9323 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 2 0 0 0 0 12 38 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 37 1 0 0 0 0 M CHG 1 38 -1 M END