MMs02202003 MOE2007 2D CORINA 3.40 0006 02.08.2006 47 50 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 -0.7741 -1.2848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2739 -1.2568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1327 -0.0270 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5677 -0.4638 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5957 -1.9636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1781 -2.4536 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.8255 -2.8224 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.1842 -2.1868 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.8198 -3.5455 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5486 -0.8282 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.5429 -1.5512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6718 -0.0568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0305 0.5788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2603 -0.2801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1313 -1.7745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7727 -2.4101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6189 0.3555 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.8487 -0.5034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.7198 -1.9978 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -15.2074 0.1322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.3363 1.6267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.6950 2.2623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.8239 3.7567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.1826 4.3923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.4124 3.5335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.2835 2.0390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.9248 1.4034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.7959 -0.0910 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -16.4372 -0.7266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.3083 -2.2211 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -18.3115 5.8868 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0278 -0.6193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6193 1.0278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0278 0.6193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3456 -1.7162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0045 -2.4625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7224 -4.0180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6880 0.6303 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1336 1.7743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1152 -2.4616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6695 -3.6057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7221 1.5511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3525 2.3138 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.8401 4.4438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -20.4993 4.0419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -20.2673 1.3519 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 7 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 30 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 32 1 0 0 0 0 26 27 2 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 2 0 0 0 0 M END