MMs00468427 MOE2007 2D CORINA 3.40 0006 02.08.2006 57 57 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 1.3019 0.7450 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.3078 2.2449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6097 2.9899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6155 4.4899 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5763 3.8899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9174 5.2349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9233 6.7348 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2136 4.4798 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5155 5.2248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8116 4.4697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8116 5.6697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8058 2.9698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1019 2.2147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4039 2.9597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4431 3.5597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4097 4.4597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1136 5.2147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7000 2.2047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0019 2.9496 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6942 0.7047 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 -0.0504 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.9511 -0.6504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2922 0.6946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5883 -0.0604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8903 0.6845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8961 2.1845 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9845 -1.5503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2806 -2.3054 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5960 1.0415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0415 -0.5960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 -1.0415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1252 2.0412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9017 3.3742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0157 1.8607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7923 3.1937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2089 3.2798 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7477 6.1470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2904 6.1410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6248 3.1827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3910 1.8437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3270 1.2985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8697 1.2925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5906 4.2467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8245 5.5857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3458 6.1369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8885 6.1310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6526 0.1087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5244 1.6168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0671 1.6109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8134 -0.9767 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3561 -0.9827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1864 -0.0705 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 11.6825 -2.2953 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.3194 5.2449 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3240 6.4449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2778 4.6490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 55 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 18 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 19 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 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 2 0 0 0 0 26 53 1 0 0 0 0 28 29 2 0 0 0 0 28 54 1 0 0 0 0 55 56 1 0 0 0 0 55 57 1 0 0 0 0 M CHG 1 53 -1 M CHG 1 54 -1 M END