MMs01846866 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 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 -0.0356 -1.4996 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1566 -2.4098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6594 -3.8250 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8402 -3.7894 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2697 -2.3522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6849 -1.8549 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.8231 -2.8319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2383 -2.3346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5153 -0.8604 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3766 -3.3116 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7917 -2.8143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9300 -3.7912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3451 -3.2940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6221 -1.8198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4839 -0.8428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0687 -1.3401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0373 -1.3225 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -11.5400 0.0927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.5345 -2.7377 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.4524 -0.8252 0.0000 N 0 5 0 0 0 0 0 0 0 0 0 0 -14.3630 -1.6068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5938 -1.9803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9404 -0.5209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3776 -0.0914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4682 -1.1212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1216 -2.5807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6844 -3.0102 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1997 -0.0285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0285 1.1997 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1997 0.0285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8953 -3.5929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4115 -3.8777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1550 -4.4909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7084 -4.9706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2557 -4.0755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7054 0.3366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1581 -0.5585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 0.3030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6549 1.0762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6180 -0.7776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9940 -3.4046 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 6 1 0 0 0 0 3 4 2 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 39 1 0 0 0 0 25 26 1 0 0 0 0 25 40 1 0 0 0 0 26 27 2 0 0 0 0 26 41 1 0 0 0 0 27 28 1 0 0 0 0 27 42 1 0 0 0 0 M CHG 1 21 -1 M END