MMs00037958 MOE2007 2D CORINA 3.40 0006 02.08.2006 57 61 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 1.2930 0.7603 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6099 -1.4793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9149 -2.2190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2079 -1.4587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 0.0413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8910 0.7809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4890 0.8016 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 0.0619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8059 -1.4380 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0870 0.8222 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3920 0.0826 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.3920 1.2826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5606 -1.4079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0303 -1.7081 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7699 -0.4032 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.3699 -1.4424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7574 0.7035 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.4468 1.8626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4971 2.0085 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9667 1.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1354 0.2178 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.9839 1.0663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4403 -0.5219 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.7333 0.2384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7214 1.7384 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.0145 2.4987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3194 1.7590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3313 0.2591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0383 -0.5012 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 20.6363 -0.4806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6482 -1.9805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9532 -2.7202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2462 -1.9599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2343 -0.4599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9293 0.2797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.5273 0.3004 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.6082 1.0344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0344 -0.6082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6082 -1.0344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5755 -2.0875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9244 -3.4189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2519 -2.0504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8815 1.9809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4795 2.0015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3607 -1.4175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4447 -2.6023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0827 2.9027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1667 1.7178 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4498 -1.7218 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0049 3.6987 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.3539 2.3673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.6138 -2.5888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.9627 -3.9201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.2902 -2.5516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.9198 1.4797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 43 1 0 0 0 0 6 7 2 0 0 0 0 6 44 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 45 1 0 0 0 0 9 10 1 0 0 0 0 9 46 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 23 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 29 30 2 0 0 0 0 29 53 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 32 33 1 0 0 0 0 32 37 2 0 0 0 0 33 34 2 0 0 0 0 33 54 1 0 0 0 0 34 35 1 0 0 0 0 34 55 1 0 0 0 0 35 36 2 0 0 0 0 35 56 1 0 0 0 0 36 37 1 0 0 0 0 36 38 1 0 0 0 0 37 57 1 0 0 0 0 M END