MMs01586582 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 44 0 0 0 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 1.4643 0.3252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4781 -0.7804 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9424 -0.4552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3930 0.9755 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9562 -1.5608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6577 -3.0308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9634 -3.7690 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0997 -4.9612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0690 -2.7552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4465 -1.3905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1847 -0.0847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4229 1.2075 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6846 -0.0711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4228 1.2347 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9227 1.2483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6845 -0.0439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1844 -0.0302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9226 1.2755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1609 2.5677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6609 2.5541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4226 1.2892 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 16.1607 2.5949 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.1843 -0.0030 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 8.5390 -3.0537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2929 -3.6533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2601 1.1715 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1715 -0.2601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2601 -1.1715 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0047 1.4337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4762 0.9703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4870 -1.2547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8159 -0.4713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0940 -1.0885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7938 -1.0640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7514 3.6124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0515 3.5879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3002 -4.2297 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7150 -3.2926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7778 -1.8777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7949 -2.5615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2012 -4.1513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7909 -4.7451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 25 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 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END