MMs00596935 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 44 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 1.3011 -0.7465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0071 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8991 -0.7394 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1921 1.5141 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4972 -0.7323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8659 -0.1185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8726 -1.2305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1261 -2.5316 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6581 -2.2237 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7685 -3.0291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3639 -1.0696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8553 -0.9088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5248 -2.5610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2031 0.4217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3052 -2.2465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6062 -2.9929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6103 -4.4929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3133 -5.2464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0122 -4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0082 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2848 -5.2535 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.5858 -4.5071 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2807 -6.7535 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.5972 1.0409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0409 0.5972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5972 -1.0409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9024 -1.9394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1122 1.0560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9196 -1.5053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0484 -0.7801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7909 -0.3122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3317 -2.6897 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6535 -3.7541 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1213 -2.4966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7996 0.4861 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0744 1.6148 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0100 0.2930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6438 -2.3901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6512 -5.0901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3166 -6.4464 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0327 -2.4028 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 17 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M END