MMs00789678 MOE2007 2D CORINA 3.40 0006 02.08.2006 41 43 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 1.4671 -0.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0766 -1.6831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5684 -1.5270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8809 -0.0599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5823 0.6906 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2515 0.5495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4647 -0.3327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8353 0.2768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9927 1.7685 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0484 -0.6054 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4190 0.0040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7315 1.4711 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.2234 1.6272 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.8329 0.2566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7177 -0.7466 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.2999 -0.0559 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 15.3041 1.0583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7712 0.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2341 -0.6810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7012 -0.9935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7054 0.1207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2425 1.5475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7754 1.8601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 1.1737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1737 0.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2500 -1.1737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4761 -2.7221 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3710 -2.4192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5810 1.5447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1151 1.3827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6011 -1.1659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1352 -1.3278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9224 -1.7988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2868 1.6947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7542 2.1708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4307 -1.5724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.0715 -2.1350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.8790 -0.1293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.0459 2.4389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4051 3.0015 0.0000 H 0 0 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 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 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 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 M END