MMs01318595 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 43 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 0.0039 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2534 -1.2932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5067 -2.5942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2601 -3.8913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 -3.8874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5067 -2.5864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7533 -1.2893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5134 -5.1845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0134 -5.1806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7668 -6.4777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5201 -7.7748 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7601 -3.8796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0067 -2.5826 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2601 -3.8758 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0067 -2.5748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5067 -2.5709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2600 -3.8680 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2533 -1.2699 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7533 -1.2661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5067 -2.5632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0067 -2.5593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7533 -1.2583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9999 0.0388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5000 0.0349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7466 1.3320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9932 2.6291 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.7600 -3.8564 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0031 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0031 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3067 -2.5973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6628 -4.9321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1067 -2.5849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3507 -0.2486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9161 -6.2253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8780 -2.1673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2120 -1.3925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6506 -0.2323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9094 -3.6039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9533 -1.2552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5973 1.0796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 3 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 28 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 26 27 3 0 0 0 0 M END