MMs00027984 MOE2007 2D CORINA 3.40 0006 02.08.2006 61 65 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 0.7530 1.2973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4940 2.6016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2470 1.3043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 0.0035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2409 3.9023 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.5417 3.1554 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9402 4.6493 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9879 5.2031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4879 5.2066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2409 3.9093 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2349 6.5074 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7349 6.5109 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.1349 7.5501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4819 7.8116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9819 7.8151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7349 6.5178 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.9879 5.2171 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.3879 4.1778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4879 5.2136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7409 3.9198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9939 2.6190 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.2409 3.9232 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.9879 5.2240 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -12.5879 6.2633 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2349 6.5213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9819 7.8221 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.4879 5.2275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2409 3.9302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6340 2.5585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.7510 1.5574 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -14.6284 0.3637 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.0483 2.3104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7330 3.7769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.8454 4.7832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.2731 4.3230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.5884 2.8565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.4760 1.8502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5976 -1.0406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9530 1.2945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6085 3.6359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4470 1.3071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1024 -1.0343 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8593 5.6109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1935 6.3854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6325 7.5452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3533 8.2194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6875 8.9939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7707 8.9964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1085 8.2282 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3612 4.8005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6990 4.0323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8433 2.8854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2768 6.4088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.6146 5.6406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4608 2.3063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.5932 5.9564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.1630 5.1280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.7305 2.4883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.7282 0.6770 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 40 1 0 0 0 0 2 3 2 0 0 0 0 2 41 1 0 0 0 0 3 4 1 0 0 0 0 3 42 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 43 1 0 0 0 0 6 44 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 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 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 47 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 21 1 0 0 0 0 16 17 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 17 18 1 0 0 0 0 17 50 1 0 0 0 0 17 51 1 0 0 0 0 18 19 1 0 0 0 0 18 27 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 21 52 1 0 0 0 0 21 53 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 29 1 0 0 0 0 27 28 2 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 30 31 2 0 0 0 0 30 35 1 0 0 0 0 31 32 1 0 0 0 0 31 57 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 34 35 1 0 0 0 0 34 39 2 0 0 0 0 35 36 2 0 0 0 0 36 37 1 0 0 0 0 36 58 1 0 0 0 0 37 38 2 0 0 0 0 37 59 1 0 0 0 0 38 39 1 0 0 0 0 38 60 1 0 0 0 0 39 61 1 0 0 0 0 M END