MMs03688187 MOE2007 2D CORINA 3.40 0006 02.08.2006 56 57 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 -0.2183 -1.4840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4366 -2.9681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2657 -1.7023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7023 -1.2657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2553 0.1286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7393 0.3469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6704 -0.8291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1174 -2.2235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6334 -2.4418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1544 -0.6108 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.9361 0.8732 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3727 -2.0949 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6385 -0.3925 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.1914 1.0018 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.5020 2.1609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2603 2.1779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8133 3.5722 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.6754 1.2201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2284 2.6145 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.6065 0.0441 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.0535 -1.3503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0905 0.2624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.0216 -0.9137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.5056 -0.6954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.4367 -1.8714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.8837 -3.2658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3997 -3.4841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4686 -2.3080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5936 -0.0873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1746 1.1872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1872 0.1746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6238 -2.7934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6112 -4.1553 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1570 -3.0554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1784 -2.2959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4530 -1.8770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3531 -1.1087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5104 1.0695 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1817 1.4624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8623 -3.1643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1910 -3.5573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3833 -1.3334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4631 1.2810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2386 2.8072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0685 4.5131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1690 -1.7927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6112 -2.4658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9381 -0.9079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7124 1.4012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1464 0.8325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.9480 0.4201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.6239 -1.6968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.6286 -4.2067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9573 -4.5996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2814 -2.4827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 10 42 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 19 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 46 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 27 28 2 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 29 56 1 0 0 0 0 M END