MMs03609100 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 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 1.4993 -0.0452 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6425 1.4480 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4425 1.4480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1068 1.7732 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2659 2.0838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8686 0.4811 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1792 -0.6780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3618 0.3379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9844 -1.0268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4775 -1.1699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3481 0.0516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7255 1.4163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2323 1.5595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5960 2.6378 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0892 2.4947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8412 -0.0915 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1001 -2.5346 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2296 -3.7561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2499 3.2664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5421 4.0282 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8741 3.8639 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8806 2.7401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6125 2.8832 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7669 -1.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5344 -2.6430 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0362 1.1995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1995 0.0362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0362 -1.1995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2879 -2.0040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7343 2.6512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9747 1.3002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2837 2.3801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2037 3.6892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3393 -1.1833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2523 -3.0597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5331 -4.7334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2068 -4.4526 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6139 5.0354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8752 -0.6428 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1354 -1.8142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7329 -1.3745 0.0000 O 0 5 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 2 25 1 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 23 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 20 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 40 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 18 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 25 26 2 0 0 0 0 25 42 1 0 0 0 0 40 41 1 0 0 0 0 M CHG 1 42 -1 M END