MMs00157923 MOE2007 2D CORINA 3.40 0006 02.08.2006 36 37 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 0.0052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2455 1.3068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4911 2.6032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0089 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7545 1.2965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7634 3.8945 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -3.7455 1.3119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 0.0155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7544 -1.2862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0089 -2.5878 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0000 0.0206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7455 1.3222 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7544 -1.2759 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.2544 -1.2707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0089 -2.5672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5089 -2.5620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2544 -1.2604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4999 0.0361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9999 0.0309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7544 -1.2552 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -12.7492 0.2447 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.7595 -2.7552 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.2544 -1.2501 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5964 -1.0413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1036 -1.0320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0875 3.6445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9544 1.2923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3419 2.3532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1580 -2.3171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4124 -3.6084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1124 -3.5992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0964 1.0773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3964 1.0681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.8508 -0.2088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.8579 -2.2873 0.0000 H 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 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 8 1 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 28 1 0 0 0 0 8 9 2 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 3 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 30 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 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 20 34 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 35 1 0 0 0 0 24 36 1 0 0 0 0 M END