MMs03075655 MOE2007 2D CORINA 3.40 0006 02.08.2006 46 49 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 0.6503 -1.3517 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1460 -1.4644 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5460 -2.5036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1164 -0.3206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5041 -0.8900 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3914 -2.3857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9341 -2.7407 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7826 -3.5893 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7805 -0.1019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1011 -0.8133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3774 -0.0253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3331 1.4741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0125 2.1854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7362 1.3974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4156 2.1087 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 9.6095 2.2621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5652 3.7614 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9301 1.5508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9744 0.0514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6980 -0.7366 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7423 -2.2359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5303 -3.5123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0310 -3.5566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2064 2.3388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5270 1.6274 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0814 0.5202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5202 1.0814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0814 -0.5202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1252 0.3558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6855 0.7359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5909 -2.3503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5520 -3.5749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1755 -4.2891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1365 -2.0128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9771 3.3849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0308 -0.5177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9423 -2.2359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6453 -3.0688 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7735 -4.6874 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8917 -3.1796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8575 -4.7440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3647 -4.1285 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0983 -5.0781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1622 3.8381 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1832 4.4685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 8 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 43 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 21 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 25 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 34 43 1 0 0 0 0 43 44 1 0 0 0 0 45 46 1 0 0 0 0 M END