MMs00877213 MOE2007 2D CORINA 3.40 0006 02.08.2006 56 59 0 0 0 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 -0.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2572 1.2865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5144 2.5897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0144 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7428 1.3032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7283 3.9012 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.7572 1.2782 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4999 -0.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9999 -0.0334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7571 1.2615 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0143 2.5647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5144 2.5730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2571 1.2532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0143 2.5480 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9999 -0.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4998 -0.0584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2426 -1.3616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7426 -1.3699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4853 -2.6731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.9853 -2.6814 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -15.7281 -3.9846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.9709 -5.2795 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -17.2281 -3.9929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.9853 -2.6981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.4507 -3.0181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.5992 -4.5107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.2256 -5.1132 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -17.2425 -1.3949 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -17.8483 -0.3590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.7425 -1.3866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.9998 -0.0834 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6058 -1.0359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0942 -1.0509 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1202 3.6256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9427 1.3099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3700 -0.4292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7017 -1.2079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7850 -1.2139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1252 -0.4500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1442 2.9688 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8125 3.7476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3890 2.9897 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7293 3.7536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8700 -0.4542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2017 -1.2329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2980 1.1245 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6297 0.3458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1127 -1.7657 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4444 -2.5445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5408 -0.1870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8725 -0.9657 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3555 -3.0772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6872 -3.8560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -20.3470 -2.2201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -20.6351 -5.1165 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 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 36 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 14 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 43 1 0 0 0 0 13 44 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 45 1 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 19 20 1 0 0 0 0 19 51 1 0 0 0 0 19 52 1 0 0 0 0 20 21 1 0 0 0 0 20 53 1 0 0 0 0 20 54 1 0 0 0 0 21 22 1 0 0 0 0 21 31 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 29 1 0 0 0 0 26 27 2 0 0 0 0 26 55 1 0 0 0 0 27 28 1 0 0 0 0 27 56 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 31 32 2 0 0 0 0 M END