MMs00678432 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 1.3055 -0.7388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9034 -0.7163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9164 -2.2163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6239 -2.9774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3184 -2.2387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0259 -2.9999 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0389 -4.4998 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2796 -2.2611 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 5.1960 0.0449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1830 1.5448 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5014 -0.6939 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7939 0.0673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7810 1.5673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0735 2.3285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3790 1.5897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3919 0.0898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0994 -0.6714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6974 -0.6490 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9899 0.1122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9769 1.6121 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2954 -0.6266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4650 -2.1169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9349 -2.4161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6736 -1.1107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6604 -0.0046 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 1.0444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0444 0.5910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5910 -1.0444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5876 1.2224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9608 -2.8073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6343 -4.1774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5118 -1.8938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7366 2.1583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0631 3.5284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4130 2.1987 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1098 -1.8714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7077 -1.8490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5802 -2.9276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4324 -3.5081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8659 -0.9749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 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 34 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 26 2 0 0 0 0 25 41 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 M CHG 1 8 1 M CHG 1 10 -1 M END