MMs00311680 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 0.1418 -1.4933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5060 -2.1171 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6478 -3.6104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9393 -4.3733 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6127 -5.8374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6052 -6.9621 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1195 -5.9792 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7195 -7.0184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5231 -4.6028 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3565 -7.2707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1434 -7.2556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8804 -5.9491 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9064 -8.5471 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4063 -8.5321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1693 -9.8235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6693 -9.8085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4062 -8.5020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6432 -7.2106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1433 -7.2256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9061 -8.4870 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -8.6431 -7.1805 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6691 -9.7784 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 4.3156 -3.7770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5203 -4.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1946 0.1135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1135 1.1946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1946 -0.1135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0543 -1.3976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1601 -2.6547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4799 -7.6924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1363 -8.4503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3169 -9.5923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5798 -10.8687 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2796 -10.8417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2328 -6.1654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5329 -6.1924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6546 -2.7755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1872 -2.9521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8052 -5.6345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4840 -5.3858 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2353 -3.7071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 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 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 24 25 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END