MMs02722462 MOE2007 2D CORINA 3.40 0006 02.08.2006 52 55 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 -0.7433 -1.3029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0133 -2.5980 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7300 -3.9009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2300 -3.9086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9733 -5.2115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2166 -6.5067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7166 -6.4990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0267 -5.1961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5267 -5.1884 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2833 -6.4835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7833 -6.4758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5400 -7.7710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0400 -7.7633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7833 -6.4604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0266 -5.1653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5266 -5.1730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9599 -7.8095 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -4.4732 -5.2192 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8732 -4.1800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2299 -3.9240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7737 -2.4951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9918 -1.6197 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2007 -2.5076 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.3439 -2.1426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7299 -3.9317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4732 -5.2346 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7165 -6.5298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2166 -6.5221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4599 -7.8172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7032 -9.1124 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4599 -7.8327 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3495 -2.0242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0423 -0.5947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5947 1.0423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0423 0.5947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6665 -0.5363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6586 -2.0789 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5326 -3.3906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1113 -7.5351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1578 -6.8998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4978 -7.6642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9453 -8.8133 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6453 -8.7994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9833 -6.4543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6213 -4.1230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9213 -4.1368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6598 -7.8388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8545 -8.8688 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1612 -2.5939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2102 -1.6476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7262 -0.8849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 37 1 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 19 1 0 0 0 0 7 8 2 0 0 0 0 7 18 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 11 42 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 43 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 15 16 2 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 17 47 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 29 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 33 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 28 32 1 0 0 0 0 29 30 1 0 0 0 0 30 31 3 0 0 0 0 32 48 1 0 0 0 0 32 49 1 0 0 0 0 33 50 1 0 0 0 0 33 51 1 0 0 0 0 33 52 1 0 0 0 0 M END