MMs03080431 MOE2007 2D CORINA 3.40 0006 02.08.2006 62 62 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 0.0025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2521 -1.2953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7521 -1.2929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5043 -2.5907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0043 -2.5882 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.2043 -2.5882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7564 -3.8860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0085 -5.1863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5085 -5.1887 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7607 -6.4841 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0128 -7.7843 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7521 -1.2879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 0.0099 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2521 -1.2855 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 0.0148 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.6000 -1.0244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2479 1.3126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7479 1.3101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9957 2.6129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5000 0.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2521 -1.2805 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2478 1.3175 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.6355 2.6869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7486 3.6924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0488 2.9445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7394 1.4768 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.8985 1.7874 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7449 0.3637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2116 0.6780 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2897 1.1839 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6270 0.4147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1252 -1.7076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4625 -2.4768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5418 -0.1114 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8791 -0.8806 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3773 -3.0029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7146 -3.7721 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6744 -3.1131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6769 -4.6558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9607 -6.4821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6145 -8.8226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8538 -2.3237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6479 2.3518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7459 2.5101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5479 1.3082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7498 0.1101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5158 2.3137 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2949 3.1330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9555 3.2112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1164 2.3860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2820 3.1717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8555 4.4939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4523 4.6644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5351 4.0416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1907 2.5756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7283 -0.2739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1963 -0.7482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0160 -0.2124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 13 1 0 0 0 0 8 9 1 0 0 0 0 8 42 1 0 0 0 0 8 43 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 44 1 0 0 0 0 12 45 1 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 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 21 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 47 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 20 51 1 0 0 0 0 20 52 1 0 0 0 0 20 53 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 54 1 0 0 0 0 24 55 1 0 0 0 0 25 26 1 0 0 0 0 25 56 1 0 0 0 0 25 57 1 0 0 0 0 26 27 1 0 0 0 0 26 58 1 0 0 0 0 26 59 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 60 1 0 0 0 0 29 61 1 0 0 0 0 30 62 1 0 0 0 0 M END