MMs00025076 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 1.5000 0.0087 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2575 -1.2859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5151 -2.5893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0151 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7424 -1.3034 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4401 -4.0273 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7785 -4.9019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9869 -4.0132 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8640 -4.4991 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0155 -5.3476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3192 -5.9284 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6298 -7.0875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8192 -5.9371 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.0192 -5.9371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2910 -4.5132 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.6016 -3.3541 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0826 -3.6245 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7203 -4.0580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8291 -5.0681 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2584 -4.6129 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 -7.8031 -3.1837 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.6876 -4.1577 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.7965 -5.1678 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 -9.7863 -6.2767 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.8067 -4.0590 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.2720 -4.3794 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 -12.9516 -5.8448 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6938 -7.1557 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1994 -8.2491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4305 -7.1367 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 3.7575 -1.2772 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6060 1.0357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7855 -6.1019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1631 -2.9952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6701 -3.3247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3635 -2.3129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3514 -0.2345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7136 -6.0422 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -11.9054 -6.1780 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -13.5924 -2.9140 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -14.7374 -4.6998 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 33 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 3 32 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 34 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 31 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 29 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 35 1 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 21 39 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 24 40 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 27 41 1 0 0 0 0 27 42 1 0 0 0 0 29 30 1 0 0 0 0 32 37 1 0 0 0 0 32 38 1 0 0 0 0 M CHG 1 31 -1 M CHG 1 39 -1 M CHG 1 40 -1 M CHG 1 41 -1 M CHG 1 42 -1 M END