MMs00485458 MOE2007 2D CORINA 3.40 0006 02.08.2006 59 60 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 -0.7507 1.2986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0014 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4986 2.5989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2493 1.3003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 0.0008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2507 -1.2978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5014 -2.5973 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9014 -3.6365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0014 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7479 -3.8975 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2521 -3.8959 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7521 -3.8951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5014 -2.5956 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5028 -5.1937 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3437 -5.5043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8934 -6.5644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0087 -7.5675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3073 -6.8168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9947 -5.3497 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9978 -4.2344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5335 -2.8081 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4652 -4.5455 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.6243 -4.8561 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4683 -3.4303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9356 -3.7413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9387 -2.6261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4061 -2.9371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7521 3.8967 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2997 -0.5198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9507 1.2980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0980 3.6384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4493 1.3009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1695 -0.5260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1704 -2.0687 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6527 -4.9355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8539 -5.9649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1886 -7.5356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1174 -8.3709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7146 -8.5379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7960 -7.9127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4484 -6.4453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4503 -2.7949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9172 -2.3174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4867 -4.8542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9536 -4.3767 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9207 -1.9907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3877 -1.5132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9572 -4.0500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4241 -3.5725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5831 -2.0707 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1270 -6.8641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1527 4.9363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7493 -1.2994 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4092 -1.8219 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.0378 -0.6808 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9295 -5.9719 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.1034 -6.2207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9493 -1.3001 0.0000 H 0 0 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 10 11 2 0 0 0 0 10 54 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 20 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 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 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 57 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 28 55 1 0 0 0 0 29 53 1 0 0 0 0 51 55 1 0 0 0 0 52 57 1 0 0 0 0 54 59 1 0 0 0 0 55 56 1 0 0 0 0 57 58 1 0 0 0 0 M END