MMs01186853 MOE2007 2D CORINA 3.40 0006 02.08.2006 56 58 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 1.3043 -0.7409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3147 -2.2409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -2.9999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0315 -4.4999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3357 -5.2408 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6295 -4.4817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6190 -2.9818 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9337 -5.2226 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.2275 -4.4635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5317 -5.2044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6990 -6.6951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1683 -6.9967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9092 -5.6924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8978 -4.5848 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3999 -5.5252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0004 -4.1507 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2900 -6.7325 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7807 -6.5653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3812 -5.1908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6708 -7.7727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2623 -5.2590 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2518 -6.7589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5456 -7.5180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8498 -6.7771 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8603 -5.2771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5665 -4.5181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5927 1.0434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0434 0.5927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5927 -1.0434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3043 0.4591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2053 -1.0168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6330 0.6254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9908 1.0532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0224 -2.4072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4497 -3.5497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9924 -3.5389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8128 -7.5043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6641 -8.0895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8096 -7.8322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9807 -6.5653 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4808 -5.6712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8616 -4.0911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2815 -4.7104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7050 -8.4848 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3829 -8.7385 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6367 -7.0605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0715 -6.5423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8335 -7.8837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7678 -8.4318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3105 -8.4426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0406 -5.4938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2786 -4.1524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8016 -3.5934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3443 -3.6042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 23 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 M END