MMs03080346 MOE2007 2D CORINA 3.40 0006 02.08.2006 36 38 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 1.1959 -0.9055 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5065 0.2536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1662 -2.4052 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1662 -3.6052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5834 -2.8968 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7425 -3.2074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4889 -1.7009 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.0889 -0.6617 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6313 -0.4702 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9886 -1.7306 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8941 -0.5347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3112 -1.0263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4455 -0.0448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8627 -0.5365 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1627 1.4283 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7456 1.9199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6112 0.9384 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0702 2.2134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4627 3.3930 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2816 -2.5260 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8461 -2.9613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3545 -4.3784 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.0186 -4.3323 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1982 -5.2080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0645 -3.2627 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1509 -2.7531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3821 -0.5829 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5780 0.3226 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 -3.4835 -0.8733 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8795 0.8164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6512 1.0079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3702 4.1782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3290 3.7863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7738 1.2280 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.6725 1.5184 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 10 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 26 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 24 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 22 1 0 0 0 0 12 13 2 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 13 21 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 19 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 24 25 1 0 0 0 0 26 27 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 29 35 1 0 0 0 0 29 36 1 0 0 0 0 M CHG 1 35 -1 M CHG 1 36 -1 M END