MMs02731289 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 57 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 0.7422 -1.3035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2421 -1.3126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 -0.0181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2578 1.2854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7578 1.2945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2682 2.3941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6348 1.7757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4690 0.2849 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9383 2.5179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9474 4.0178 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2328 1.7601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3806 0.2674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8459 -0.0534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4478 -1.4273 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6038 1.2411 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6068 2.3619 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.7659 2.6725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9275 3.8272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8189 4.8376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1396 6.3029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5689 6.7578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6776 5.7474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3569 4.2821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8897 8.2231 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 11.0965 1.3889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9708 0.1701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4635 0.3179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3379 -0.9009 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.8378 -0.9100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2927 -2.3393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0739 -3.2137 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.8657 -2.3247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2599 -0.7296 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1359 -2.3391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8358 -2.3554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1641 2.3373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0258 3.5693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6754 4.4737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2527 7.1112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8211 6.1113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2438 3.4738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7727 2.5444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1782 1.9084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8891 -0.3494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2946 -0.9854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1397 1.4734 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5452 0.8374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5490 0.0566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4317 -2.7170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7222 -2.6886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5023 -1.9049 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 35 1 0 0 0 0 2 3 2 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 34 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 26 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 33 1 0 0 0 0 30 31 2 0 0 0 0 30 50 1 0 0 0 0 31 32 1 0 0 0 0 31 51 1 0 0 0 0 32 33 2 0 0 0 0 33 52 1 0 0 0 0 34 53 1 0 0 0 0 M END