MMs02381611 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 61 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 -0.0027 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2949 2.2524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5953 1.5047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3004 -0.7476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8930 2.2571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1934 1.5095 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1934 2.7095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4911 2.2618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7915 1.5142 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0892 2.2666 0.0000 P 0 0 3 0 0 0 0 0 0 0 0 0 9.8415 0.9689 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3868 3.0189 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6872 2.2713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9849 3.0237 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.9849 1.8237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1390 4.5157 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.4496 5.6748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6056 4.8303 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 15.7647 5.1409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3580 3.5326 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 15.6686 2.3735 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3563 2.4161 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.8501 3.3785 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.8517 4.4951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2231 3.8875 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 19.0691 2.3954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6024 2.0809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1415 0.6534 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.1472 -0.4595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6139 -0.1449 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 20.0748 1.2825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.5414 1.5971 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.2132 6.2017 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0224 5.5174 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1580 -0.5924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0381 -0.6019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0431 2.0981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2927 3.4524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6384 -0.5934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3026 -1.9476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1200 3.1749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6627 3.1778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7181 3.1797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2607 3.1825 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9176 1.3506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4602 1.3535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6001 5.6684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7785 -1.6014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.3460 0.7067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.9102 2.7390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5061 7.1712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2698 6.6916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3368 3.5642 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0095 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2365 -0.5886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9349 4.6046 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 38 1 0 0 0 0 2 3 2 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 3 40 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 43 1 0 0 0 0 7 44 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 56 1 0 0 0 0 10 11 1 0 0 0 0 10 45 1 0 0 0 0 10 46 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 12 55 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 24 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 36 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 35 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 25 29 1 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 30 31 1 0 0 0 0 31 32 2 0 0 0 0 31 50 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 51 1 0 0 0 0 34 52 1 0 0 0 0 35 53 1 0 0 0 0 36 54 1 0 0 0 0 37 56 1 0 0 0 0 55 58 1 0 0 0 0 56 57 1 0 0 0 0 M END