MMs02248226 MOE2007 2D CORINA 3.40 0006 02.08.2006 45 45 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 1.5000 -0.0047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2459 -1.3061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7459 -1.3109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4918 -2.6123 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0142 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -0.0189 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4000 1.0203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7459 -1.3203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2459 -1.3250 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.9918 -2.6264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4918 -2.6312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2458 -1.3345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7458 -1.3392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4917 -2.6406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7376 -3.9373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2377 -3.9326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7541 1.2777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0082 2.5791 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4918 -2.6028 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0082 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7623 -3.8947 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7541 -1.2967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2541 1.2919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0038 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 0.0019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0038 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9033 1.0269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6170 -1.7272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9505 -2.5027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8628 -3.0333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1964 -3.8089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6491 -0.2934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3491 -0.3019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6917 -2.6444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3344 -4.9784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6344 -4.9699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0885 -3.6439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 -0.6999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0525 -0.7761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7952 -1.8934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2914 0.6887 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8574 2.3293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2168 1.8952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2541 1.2730 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 18 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 45 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 M CHG 1 45 -1 M END