MMs02993456 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 44 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 1.3022 -0.7445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0109 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5588 0.6109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5918 1.5109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9002 -0.7336 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8610 -1.3336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1898 1.5218 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4983 -0.7227 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0327 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.7942 -1.1673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7879 1.5327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0837 2.2882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0774 3.7882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3733 4.5436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6755 3.7991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6818 2.2991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3859 1.5436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0963 -0.7118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 0.0436 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.4340 -0.5520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3897 0.6436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1026 -2.2118 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5956 1.0417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0417 0.5956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5956 -1.0417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5347 -1.6670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0774 -1.6605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7917 1.5159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5867 2.7109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3918 1.5059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5033 -1.9227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6070 1.3194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3727 2.6586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0357 4.3838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3683 5.7436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7122 4.4034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7235 1.7034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3884 0.9436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9065 -2.2336 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.7065 -2.2387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9116 -3.4336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1065 -2.2286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 41 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 20 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 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 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 24 2 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 41 42 1 0 0 0 0 41 43 1 0 0 0 0 41 44 1 0 0 0 0 M CHG 1 41 1 M END