MMs00453569 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 40 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 1.2962 0.7549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0099 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8942 0.7648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8885 2.2648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1847 3.0197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4866 2.2747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4923 0.7747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7828 3.0296 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0847 2.2845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0904 0.7845 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3808 3.0395 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6827 2.2944 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.6827 3.4944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6884 0.7944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 0.0493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9960 -1.4506 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.2979 -2.1957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9789 3.0493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9732 4.5493 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6039 1.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0369 -0.6039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6039 -1.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5213 1.6712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0640 1.6771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8470 2.8608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1802 4.2197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5338 0.1786 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2007 -1.1803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7782 4.2296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3763 4.2394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5059 0.9983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2823 -0.3348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3964 1.1785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1728 -0.1545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7018 -3.2372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3394 -2.7918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8939 -1.1542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2808 2.3043 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 20 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 M CHG 1 40 -1 M END