MMs00028588 MOE2007 2D CORINA 3.40 0006 02.08.2006 77 80 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 1.4998 -0.0214 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7768 -1.3357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5534 -2.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0531 -2.5880 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4531 -3.6272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7762 -1.2738 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9995 0.0095 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5791 0.1648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7226 1.3237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9459 2.6070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4463 2.5761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9534 3.9928 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1485 4.8993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3800 4.0429 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.1176 6.3990 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4009 7.1757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7151 6.4526 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3699 8.6753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6532 9.4520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6223 10.9516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9365 10.2286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 8.7289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7232 1.2619 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1232 2.3011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7765 1.2309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5531 2.5142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 3.8285 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0528 2.4833 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8294 3.7666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3291 3.7357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0521 2.4214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5518 2.3905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3285 3.6738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6054 4.9880 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1057 5.0189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0710 -2.0310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0921 -0.5539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3735 -1.3336 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8297 -3.8713 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0171 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