MMs01978662 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 41 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 0.0108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2593 -1.2827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7593 -1.2719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 0.0325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7405 1.3261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2405 1.3153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4812 2.6089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4811 2.6306 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8611 3.9964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9685 5.0082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2730 4.2676 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9717 2.7981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9834 1.6907 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.4484 2.0132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4601 0.9057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0069 -0.5242 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9250 1.2282 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.9368 0.1208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6355 -1.3487 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9399 -2.0892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0474 -1.0775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4274 0.2884 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0087 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0087 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6669 -2.3263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3668 -2.3067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6999 0.0412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5160 3.2164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8737 3.6437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4463 2.0014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6855 4.2374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8345 6.2006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9908 3.1225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4614 2.6564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2876 2.3721 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0740 -3.2817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2229 -1.3185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 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 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 M END