MMs01641264 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 55 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 0.0063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2555 -1.2895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7555 -1.2832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7445 1.3149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2445 1.3086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 0.0254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7444 1.3276 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7554 -1.2705 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2554 -1.2641 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.6554 -2.3033 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 0.0381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2444 1.3339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4999 0.0444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0109 -2.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2664 -3.8622 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5109 -2.5536 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2664 -3.8495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7664 -3.8431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5109 -2.5409 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5219 -5.1390 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.0219 -5.1326 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.4219 -6.1718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8984 -3.9154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3269 -4.3729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3333 -5.8728 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 17.8768 -7.2709 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.8229 -6.0493 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.9087 -6.3424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0051 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0051 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6599 -2.3313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3599 -2.3198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3401 2.3567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6401 2.3452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1598 -2.3122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5999 1.0773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2811 1.9383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6400 2.3706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2077 0.7296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5050 -1.1555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6999 0.0495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4948 1.2444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1405 -4.2647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4798 -5.0303 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9263 -6.1807 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8566 -3.3198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3818 -2.8171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.5715 -3.1980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.5209 -4.4932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8720 -6.9468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4014 -7.4366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 39 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 30 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 27 28 2 0 0 0 0 27 29 2 0 0 0 0 27 30 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 M END