MMs03454312 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 42 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 1.5000 0.0081 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2570 -1.2869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5139 -2.5900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7430 -1.3031 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4419 -4.0271 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7764 -4.9022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9851 -4.0140 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8660 -4.4983 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8660 -3.2983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3218 -5.9273 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6324 -7.0864 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8218 -5.9354 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.0218 -5.9354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2930 -4.5113 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.6036 -3.3522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0842 -3.6231 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7220 -4.0555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8313 -5.0652 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.2604 -4.6093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3697 -5.6190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6969 -7.1536 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4336 -7.1361 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7569 -1.2789 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6056 1.0360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7828 -6.1022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1644 -2.9929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6716 -3.3218 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7027 -3.5468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2100 -3.8756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4201 -6.3527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9274 -6.6815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0546 -3.9907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2030 -8.2473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2409 -7.0043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3625 -2.3149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3513 -0.2364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7988 -5.1631 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.6862 -5.9709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 8 27 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 24 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 23 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 28 1 0 0 0 0 19 29 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 30 1 0 0 0 0 21 31 1 0 0 0 0 22 32 1 0 0 0 0 22 33 1 0 0 0 0 22 39 1 0 0 0 0 23 35 1 0 0 0 0 24 36 1 0 0 0 0 25 37 1 0 0 0 0 25 38 1 0 0 0 0 34 39 1 0 0 0 0 39 40 1 0 0 0 0 M END