MMs00574579 MOE2007 2D CORINA 3.40 0006 02.08.2006 29 31 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 -1.5000 -0.0046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2460 -1.3060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4920 -2.6027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 -1.2967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2540 -1.2921 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -2.0350 -4.0010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4665 -4.4490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7083 -3.6075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9448 -4.4566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2985 -3.8090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4156 -2.3135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1791 -1.4644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8254 -2.1107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7298 -1.0863 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.7692 -1.6672 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -10.0057 -2.5163 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.8863 -0.1718 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -8.5350 -4.6581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4179 -6.1535 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.5968 1.0411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1032 1.0327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6112 -3.6354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2154 -4.8775 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6412 -5.6362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8516 -5.6530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2727 -0.2681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8887 -4.0118 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 16 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 8 9 2 0 0 0 0 8 25 1 0 0 0 0 9 10 1 0 0 0 0 9 26 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 12 13 2 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 14 28 1 0 0 0 0 15 16 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 20 21 1 0 0 0 0 20 29 2 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M CHG 1 21 -1 M END