MMs01808174 MOE2007 2D CORINA 3.40 0006 02.08.2006 46 47 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 1.4133 0.5027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5552 -0.4699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9685 0.0327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1104 -0.9399 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5237 -0.4372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7950 1.0380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2083 1.5407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3503 0.5681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0789 -0.9072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6657 -1.4098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7635 1.0707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0348 2.5460 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9055 0.0981 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.3187 0.6008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5901 2.0761 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.4607 -0.3718 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.8740 0.1309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1453 1.6061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5586 2.1088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7005 1.1362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4292 -0.3391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0159 -0.8417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5711 -1.3117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2998 -2.7869 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.1138 1.6388 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.4021 1.1306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1306 -0.4021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4021 -1.1306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8209 1.5463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3382 1.2672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6303 -1.2345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1476 -1.5136 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3761 1.0763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8934 0.7973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8815 1.8161 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4254 2.7209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9925 -1.6852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4486 -2.5900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6884 -1.0821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2436 -1.5520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2317 2.3842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7756 3.2890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7989 -2.0219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.9844 -0.8090 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.8980 -1.5871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 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 4 35 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 39 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 40 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 45 46 1 0 0 0 0 M END