MMs02658798 MOE2007 2D CORINA 3.40 0006 02.08.2006 28 30 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 1.2009 -0.8987 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5797 -0.3081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7576 1.1814 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7807 -1.2068 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7415 -1.8068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7595 -2.7067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1794 -3.1903 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.0781 -1.9893 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.6781 -3.0286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2137 -0.7635 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1124 0.4375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6691 1.8705 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5323 -0.0462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5111 -1.5460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7994 -2.3143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1089 -1.5827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1301 -0.0829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8418 0.6854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7190 0.9608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9608 0.7190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7190 -0.9608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5680 -2.5644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4934 -3.8768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7825 -3.5142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1396 -2.1974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1777 0.5024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8588 1.8853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 11 1 0 0 0 0 7 8 1 0 0 0 0 7 23 1 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 25 1 0 0 0 0 17 18 2 0 0 0 0 17 26 1 0 0 0 0 18 19 1 0 0 0 0 18 27 1 0 0 0 0 19 28 1 0 0 0 0 M END