MMs00452165 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 41 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 0.7401 1.3047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2401 1.3160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 0.0227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2598 -1.2820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7598 -1.2933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 0.0341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2400 1.3387 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8400 2.3780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4802 2.6321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9802 2.6207 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7400 1.3501 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4998 0.0568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7596 -1.2479 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9997 0.0681 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7596 -1.2252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2595 -1.2138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0193 -2.5072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2792 -3.8118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7792 -3.8232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0194 -2.5299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0390 -5.1052 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.3323 -4.3453 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7457 -5.8650 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7988 -6.3985 0.0000 N 0 5 0 0 0 0 0 0 0 0 0 0 13.9988 -6.3894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1323 2.3393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5362 1.8379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8676 -2.3166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1677 -2.3371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3004 -1.1492 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6306 -0.3678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3321 2.3938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5919 1.1119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8516 -0.1701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2193 -2.4981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1871 -4.8669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8194 -2.5390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2203 3.9367 0.0000 O 0 5 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 31 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 10 1 0 0 0 0 8 12 1 0 0 0 0 10 11 2 0 0 0 0 10 40 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 M CHG 1 25 -1 M CHG 1 40 -1 M END