MMs01771894 MOE2007 2D CORINA 3.40 0006 02.08.2006 33 33 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 1.3039 -0.7416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3136 -2.2415 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0168 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5883 1.5168 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5883 2.7168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8824 2.2752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1863 1.5337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4805 2.2921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7843 1.5505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 0.0505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4999 -0.7079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 0.0337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5096 -2.2078 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 7.8135 -2.9494 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2155 -2.9662 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 9.0785 2.3089 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 9.0688 3.8089 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3824 1.5673 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2844 2.2584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0097 1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5932 1.0431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0431 0.5932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5932 -1.0431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6411 -0.5764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1052 3.1895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6478 3.1995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4727 3.4920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1607 -0.5730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0979 -0.6910 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2747 3.7583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2316 4.3516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1333 -0.0843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 25 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 26 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 17 1 0 0 0 0 11 12 2 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 29 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 20 21 2 0 0 0 0 20 31 1 0 0 0 0 30 33 1 0 0 0 0 31 32 1 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M CHG 1 17 1 M CHG 1 19 -1 M END