MMs03586817 MOE2007 2D CORINA 3.40 0006 02.08.2006 50 51 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 -0.0866 1.4975 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0725 1.1869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5376 1.8779 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6967 2.1885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3477 0.6155 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6583 -0.5436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3974 -0.5451 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.8452 0.5289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5190 -0.8113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0165 -0.8979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6902 -2.2381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1877 -2.3247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8615 -3.6648 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.0115 -1.0711 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.5090 -1.1577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3327 0.0959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8302 0.0093 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -13.6539 1.2628 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -15.1514 1.1762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.9752 2.4298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.4727 2.3432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.1464 1.0030 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6242 3.3754 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2267 3.9205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1537 5.3715 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7235 2.7599 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1842 0.1941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3168 -1.1574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7054 1.7207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9947 0.8735 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3695 -1.1559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6588 -2.0031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8767 0.2939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1659 -0.5533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5408 -2.5827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8300 -3.4299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4725 0.0010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2327 -2.3255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6110 -1.6325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2306 0.5707 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6090 1.2636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.8752 0.0085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.2535 0.7014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.8731 2.9046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.2515 3.5976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6341 4.0235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9215 2.8292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.2964 3.5968 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -19.4944 3.5275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 8 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 27 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 24 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 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 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 49 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 48 1 0 0 0 0 49 50 1 0 0 0 0 M END