MMs03539775 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 43 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 -1.4286 -0.4572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4352 -1.9572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0107 -2.4270 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8763 -1.2174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3763 -1.2240 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7763 -2.2632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1320 0.0717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1435 2.6697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3992 3.9721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8992 3.9787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1435 2.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8878 1.3806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1206 -2.5264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6206 -2.5330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3763 -1.2373 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8763 -1.2439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6205 -2.5462 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6320 0.0518 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6526 -2.8335 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.5024 -4.3260 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0202 -2.2174 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.3759 1.1396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3963 0.2524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0479 -0.7037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0547 0.8390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0661 3.4370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0593 1.8944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5287 4.3775 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1961 5.1548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1128 5.1595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2266 4.3941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7723 3.4584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7791 1.9157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2417 0.9752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0909 0.1980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5160 -3.5629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7809 -0.1954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8320 0.0466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0366 1.0937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3878 1.3740 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 3.5878 1.3740 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 14 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 13 41 1 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 41 42 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M CHG 1 41 1 M END