MMs02779278 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 56 0 0 0 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 0.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2428 1.3114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7428 1.3197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 0.0248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7571 -1.2784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2571 -1.2866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5143 -2.5898 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 0.0331 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7427 1.3362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9856 2.6311 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2427 1.3445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9855 2.6476 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4855 2.6559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2427 1.3610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7426 1.3693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4855 2.6724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7283 3.9673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2284 3.9590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9855 2.6807 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.9772 4.1807 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9937 1.1807 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.4854 2.6890 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.2283 3.9921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7282 4.0004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4711 5.3035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7139 6.5984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2139 6.5901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4711 5.2870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0066 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0066 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6371 2.3473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3370 2.3622 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3628 -2.3143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6056 -1.0028 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0409 0.1616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3726 0.9403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6484 0.3185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3484 0.3334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3226 5.0098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6226 4.9950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0912 1.6530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8283 2.9529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.5264 2.8175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.8581 3.5962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.3946 4.5373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.3861 6.0799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.8393 7.0150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4990 7.7790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4158 7.7730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0841 6.9943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5561 4.5106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5476 6.0533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 29 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 M END