MMs01804990 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 47 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 1.2943 -0.7581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0162 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8924 -0.7743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8830 -2.2743 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4904 -0.7906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8035 1.4513 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5091 2.2094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2054 1.4675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1072 2.1931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4015 1.4350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7052 2.1769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8136 1.1662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3063 1.3137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1804 0.0947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5618 -1.2718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0690 -1.4193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1949 -0.2002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7042 -0.0341 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8957 -0.9209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6731 0.2422 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 11.7146 3.6769 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4202 4.4350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1165 3.6931 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6065 1.0355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0355 0.6065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6065 -1.0355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5172 -1.6725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0599 -1.6822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -1.2325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7133 -1.7050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2560 -1.7146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1974 -1.1789 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9771 0.1523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2862 3.1238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7435 3.1334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0224 1.2665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8021 2.5977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8013 2.4069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2610 -2.2470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5741 -2.5124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4277 5.6349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 26 2 0 0 0 0 13 14 2 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 14 24 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 M END