MMs02941105 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 41 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 -1.3856 -0.5745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2674 -2.0699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1913 -2.4195 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9746 -1.1402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4076 -3.0445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1337 -4.5192 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8218 -2.5443 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9620 -3.5189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3762 -3.0187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6501 -1.5439 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5098 -0.5693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0957 -1.0695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0642 -1.0437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3381 0.4311 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.2045 -2.0183 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.6186 -1.5181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8925 -0.0433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3066 0.4569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4469 -0.5177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1730 -1.9925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7588 -2.4927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4850 -3.9675 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -14.8610 -0.0175 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.2797 1.1669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4090 0.0521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1709 -1.0457 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0358 -4.2818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5525 -4.5635 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5738 -4.2023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5761 -3.0296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4360 0.1936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9193 0.4753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8957 -1.0586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8980 0.1141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9853 -3.1981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9803 0.7363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5258 1.6367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0852 -2.7722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 5 27 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 36 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 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 M END