MMs00648820 MOE2007 2D CORINA 3.40 0006 02.08.2006 52 55 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 1.2959 -0.7555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2895 -2.2555 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5854 -3.0109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8876 -2.2664 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5791 -4.5109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7889 -5.3977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3193 -6.8223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8194 -6.8160 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.3619 -5.3875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0628 -4.9179 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1817 -5.9169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8760 -7.3854 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6063 -5.4474 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7578 -4.5989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9120 -3.9789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7253 -6.4464 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1912 -6.1283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7955 -4.7554 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9466 -7.4242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4151 -7.7299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8847 -9.1545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8857 -10.2734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4172 -9.9677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9476 -8.5431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5748 -7.9388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2789 -8.6943 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2174 -4.9402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5355 -3.4743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9640 -3.0168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0745 -4.0252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7564 -5.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3279 -5.9486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5030 -3.5677 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.6044 1.0367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0367 0.6044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6044 -1.0367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7110 0.3704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4767 -0.9688 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0206 -7.7961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3073 -3.7431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7372 -3.7343 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1565 -2.8040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0868 -4.2234 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2143 -6.8347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0595 -9.3990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2613 -11.4131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6180 -10.8629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6471 -2.6676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2184 -1.8441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6448 -6.2978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0734 -7.1213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 38 1 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 10 2 0 0 0 0 7 8 2 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 26 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 49 1 0 0 0 0 30 31 1 0 0 0 0 30 50 1 0 0 0 0 31 32 2 0 0 0 0 31 34 1 0 0 0 0 32 33 1 0 0 0 0 32 51 1 0 0 0 0 33 52 1 0 0 0 0 M END