MMs01855643 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 0.0092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2420 1.3128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4841 2.6072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0159 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7579 1.2944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2579 1.2853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1321 0.0664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5615 0.5212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5707 2.0212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1470 2.4934 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7896 2.8954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1561 2.2770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3750 3.1512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5939 4.0255 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3038 0.7842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0849 -0.0900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2326 -1.5827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5992 -2.2012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8181 -1.3269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6704 0.1658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7469 -3.6939 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.7420 1.3219 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7512 -0.1781 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7328 2.8219 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2420 1.3311 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5936 -1.0429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1063 -1.0264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0777 3.6501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6222 3.6336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7544 -1.0726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5280 -0.1901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6714 4.0896 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5383 0.1574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2575 -2.2821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9113 -1.8217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6455 0.8652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8356 2.3739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8483 0.2955 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 2 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 3 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 26 38 1 0 0 0 0 26 39 1 0 0 0 0 M END