MMs02552731 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 40 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 1.5000 0.0076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4924 1.5076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5076 -1.4924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0152 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7434 1.3180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9868 2.6132 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2434 1.3256 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9868 2.6284 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5868 3.6676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4868 2.6360 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.6868 2.6360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2433 1.3407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4999 0.0379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2565 -1.2573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7564 -1.2497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4999 0.0531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7433 1.3483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9998 0.0607 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 12.7433 1.3635 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7564 -1.2346 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 8.2302 3.9388 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2302 3.9236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7303 3.9160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 0.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -0.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6924 1.5136 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4863 2.7075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8924 1.5045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9076 -1.4954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5136 -2.6924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7075 -1.4863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8486 0.2894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2999 0.0318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6617 -2.2996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3617 -2.2859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3380 2.3906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4302 3.9448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9737 5.2264 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 23 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 22 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M CHG 1 40 -1 M END