MMs02419102 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 53 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 0.7428 -1.3031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0143 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7285 -3.9012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2285 -3.9094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9857 -2.6145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2428 -1.3114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4856 -2.6228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2285 -3.9259 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.7285 -3.9342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4713 -5.2373 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.0713 -6.2766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7142 -6.5322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2142 -6.5240 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4570 -7.8354 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6999 -9.1303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4427 -10.4334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9427 -10.4417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9713 -5.2456 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7284 -3.9507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9856 -2.6476 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2284 -3.9589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9855 -2.6641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4855 -2.6723 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.6855 -2.6723 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2426 -1.3774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7426 -1.3857 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0425 0.5943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5943 1.0425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0425 -0.5943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2143 -2.5914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1228 -4.9371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8228 -4.9519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8485 -0.2755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2838 -1.4399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6155 -2.2186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5266 -2.7513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8583 -3.5300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6570 -7.8420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7849 -8.3539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7764 -9.8965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5656 -6.2881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0135 -5.1396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3537 -4.3756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8602 -2.2474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2004 -1.4835 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6226 -5.0114 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6856 -11.7283 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4998 -0.0743 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2283 -3.9755 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.4283 -3.9821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1055 0.9616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2799 -12.7708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 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 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 8 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 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 19 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 48 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 50 1 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 47 50 1 0 0 0 0 48 53 1 0 0 0 0 49 52 1 0 0 0 0 50 51 1 0 0 0 0 M END