MMs01437306 MOE2007 2D CORINA 3.40 0006 02.08.2006 47 49 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 -1.2039 0.8948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4269 0.0263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9789 -1.4052 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4790 -1.4215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8484 0.5053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9739 -0.4862 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3954 -0.0072 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.9164 1.4142 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8744 -1.4287 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8169 0.4717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9424 -0.5198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3639 -0.0408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6598 1.4297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5343 2.4212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1128 1.9423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0813 1.9087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3772 3.3792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.2068 0.9171 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.6283 1.3961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7538 0.4046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.4579 -1.0659 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -17.1753 0.8836 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -18.3008 -0.1080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.0049 -1.5785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.1305 -2.5700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -20.5519 -2.0911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -20.8479 -0.6205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.7223 0.3710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -21.6775 -3.0826 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.1452 0.3584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1909 2.0947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2158 -2.3999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2735 1.5587 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7859 1.2543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7372 -1.6626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7057 -1.6962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2643 -0.8341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7710 3.5977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2124 2.7355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0535 2.4495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.5658 2.1451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.4120 2.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.8677 -1.9617 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.8937 -3.7465 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -21.9850 -0.2374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.9591 1.5474 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 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 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 46 1 0 0 0 0 29 47 1 0 0 0 0 M END