MMs01998098 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 42 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 0.7452 1.3018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0096 2.5981 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6096 1.5588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5096 2.5925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2644 3.8888 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4644 3.8843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2356 3.9054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9808 5.2072 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5808 4.1680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4808 5.2127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2260 6.5145 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7260 6.5201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4807 5.2238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9807 5.2294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7259 6.5312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9711 7.8274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4711 7.8219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7163 9.1182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2260 6.5035 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 6.4990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0414 0.5962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5962 -1.0414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0414 -0.5962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6673 0.5339 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6616 2.0765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2968 1.4115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6357 2.1779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3647 3.4991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0316 2.7229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2768 4.0302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6099 4.8065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8846 4.1824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5846 4.1924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9259 6.5356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5673 8.8689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7534 9.7220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1125 10.1552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6793 8.5143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7356 3.8999 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.3935 4.3061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9396 5.0824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 40 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 20 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 40 41 1 0 0 0 0 40 42 1 0 0 0 0 M CHG 1 40 1 M END