MMs02457409 MOE2007 2D CORINA 3.40 0006 02.08.2006 59 62 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 0.0078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2432 1.3108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4864 2.6059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0135 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7568 1.2951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2567 1.2873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0135 2.5824 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0156 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0235 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8999 -1.0627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2567 1.2716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7567 1.2638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5134 2.5589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7702 3.8619 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2432 -1.3264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4864 -2.6215 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7432 1.3186 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4999 0.0235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9999 0.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7431 1.3342 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.2431 1.3420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9999 0.0469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2567 -1.2560 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.4999 0.0547 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.1053 -0.9813 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2431 1.3577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4863 2.6528 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.9863 2.6450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2296 3.9401 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7296 3.9323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9864 2.6293 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.3864 3.6686 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4864 2.6215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7431 1.3655 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5946 -1.0423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1054 -1.0283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0810 3.6482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6190 3.6341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3945 -1.0517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1312 1.6879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4712 2.4523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5421 0.0832 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8822 0.8475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3745 -0.3928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7145 -1.1572 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7977 -1.1516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1297 -0.3733 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8241 4.9824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9318 5.1151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5998 4.3368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3566 3.0260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6886 3.8043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3376 2.4078 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3485 0.3294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0134 2.5511 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7431 -1.3342 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3377 -2.3766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6188 3.5872 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 36 1 0 0 0 0 2 3 2 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 18 1 0 0 0 0 4 5 2 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 15 2 0 0 0 0 14 56 1 0 0 0 0 16 17 2 0 0 0 0 16 57 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 32 1 0 0 0 0 22 23 1 0 0 0 0 22 29 2 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 2 0 0 0 0 27 35 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 49 1 0 0 0 0 31 32 1 0 0 0 0 31 50 1 0 0 0 0 31 51 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 34 52 1 0 0 0 0 34 53 1 0 0 0 0 35 54 1 0 0 0 0 35 55 1 0 0 0 0 56 59 1 0 0 0 0 57 58 1 0 0 0 0 M END