MMs00327135 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 54 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 0.7436 -1.3027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0129 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2435 -1.3102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0149 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6000 1.0244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2564 1.2879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7564 1.2953 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0128 2.5832 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0223 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2435 -1.3250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4871 -2.6203 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7435 -1.3325 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1435 -0.2932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4870 -2.6352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7306 -3.9305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4742 -5.2332 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.7177 -6.5285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4999 -0.0372 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 -0.0446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7434 -1.3473 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7563 1.2507 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2563 1.2433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2637 2.7433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7563 1.2359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2489 -0.2567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0422 0.5948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5948 1.0422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0422 -0.5948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4564 -1.3027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0491 -1.9929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6180 -3.6343 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0234 -3.2032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0293 -2.4909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3691 -1.7262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2128 2.5772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4180 3.6254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1051 1.0140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4101 -1.8684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4025 -3.4111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8152 -3.1546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8075 -4.6973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6815 -5.9234 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1126 -7.5648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7540 -7.1337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9051 1.0050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8637 2.7403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2697 3.9433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0637 2.7492 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7533 0.6359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9563 1.2299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7593 1.8359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0489 -0.2507 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2429 -1.4567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8489 -0.2597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 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 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 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 5 10 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 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 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 M END