MMs02375008 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 56 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 1.5000 -0.0045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2539 1.2923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7539 1.2879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7461 -1.3102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2461 -1.3057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -0.0179 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.9955 -1.5179 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0044 1.4821 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 -0.0223 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2461 -1.3236 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.8461 -0.2844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6319 -2.6921 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.3213 -3.8512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7436 -3.6991 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.7829 -4.2991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0449 -2.9530 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7374 -1.4848 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.8965 -1.7954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7444 -0.3731 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.2357 -0.5343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8499 0.8342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7382 1.8412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4369 1.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0684 1.7092 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 11.8994 3.3325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6885 4.2178 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2715 3.9385 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.3421 0.9865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2202 -0.2296 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.6060 -1.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1138 -1.7505 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.9563 2.3550 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5824 -5.1904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7933 -6.0757 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1638 -2.9996 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0036 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0036 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6570 2.3333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3569 2.3253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3430 -2.3512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6430 -2.3432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7559 3.5844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4005 5.1315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3085 -2.5710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1501 2.4769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6051 2.8415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4299 -4.8562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0532 -6.2674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6643 -7.2687 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7896 -4.1397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 41 1 0 0 0 0 4 5 1 0 0 0 0 4 42 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 43 1 0 0 0 0 7 44 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 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 37 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 35 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 33 2 0 0 0 0 23 24 1 0 0 0 0 23 30 2 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 45 1 0 0 0 0 29 46 1 0 0 0 0 30 31 1 0 0 0 0 30 34 1 0 0 0 0 31 32 2 0 0 0 0 32 33 1 0 0 0 0 32 47 1 0 0 0 0 34 48 1 0 0 0 0 34 49 1 0 0 0 0 35 36 1 0 0 0 0 35 50 1 0 0 0 0 35 51 1 0 0 0 0 36 52 1 0 0 0 0 37 53 1 0 0 0 0 M END