MMs02551889 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 41 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 0.9556 -1.1562 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2662 0.0029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4347 -0.9068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3903 -2.0630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8667 -3.4687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3876 -3.7181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1678 -5.2019 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5110 -5.8695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5610 -4.7983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0137 -5.1721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4164 -6.6170 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3664 -7.6882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9137 -7.3145 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0637 -4.1009 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5164 -4.4746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5665 -3.4034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0191 -3.7771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0692 -2.7059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5219 -3.0797 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 -2.5619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9250 0.7645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7645 0.9250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -0.7645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0327 0.2239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4784 -0.3146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1685 -1.1495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4250 -2.6708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6886 -8.8442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7416 -2.9449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0202 -5.5672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5063 -5.1530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5766 -2.7250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0627 -2.3108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5229 -4.8697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0090 -4.4556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6027 -1.9542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3461 -3.4754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6665 -1.2610 0.0000 O 0 5 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 4 1 0 0 0 0 2 21 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 4 26 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 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 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 18 36 1 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 M CHG 1 39 -1 M END