MMs00032886 MOE2007 2D CORINA 3.40 0006 02.08.2006 81 84 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 1.2980 -0.7518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8961 -0.7553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4942 -0.7589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4921 -2.2589 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0107 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0922 -0.7625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4634 -0.1542 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.4655 -1.2703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7138 -2.5683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2470 -2.2545 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.4620 -3.8684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9620 -3.8705 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.5377 -4.2947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7138 -2.5725 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.9655 -1.2724 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.3655 -0.2332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7173 0.0256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9691 1.3257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4691 1.3277 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7209 2.6237 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9727 3.9238 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.3727 4.9630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4727 3.9258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7245 5.2218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9762 6.5218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7280 7.8198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2280 7.8178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9762 6.5177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2245 5.2197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2138 -2.5745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9620 -3.8746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2102 -5.1726 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 16.4102 -5.1726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7102 -5.1705 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.4101 -5.9188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7081 -6.6705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4081 -7.4187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.9584 -6.4727 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4655 -1.2745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6014 1.0384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0384 0.6014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6014 -1.0384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5254 -1.6700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0681 -1.6721 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8280 0.9167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3707 0.9146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1235 -1.6735 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6662 -1.6757 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4261 0.9132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9688 0.9111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7959 1.1893 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3338 -4.2773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5654 -4.4594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6355 -0.7470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6376 0.7957 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9209 2.6220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4743 5.1258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2727 3.9275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4710 2.7258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7762 6.5235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1294 8.8599 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8294 8.8562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1762 6.5161 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8230 4.1797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0070 -1.3925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3420 -2.1656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8823 -3.1045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8802 -4.6472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1109 -5.3987 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3701 -6.5173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0087 -6.9588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8902 -6.4638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1170 -7.7987 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4064 -8.6187 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1584 -6.4743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5040 -1.8759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0670 -0.2360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4271 -0.6730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 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