MMs01062936 MOE2007 2D CORINA 3.40 0006 02.08.2006 50 52 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 1.3045 -0.7405 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9025 -0.7216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 0.0378 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5005 -0.7027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5114 -2.2027 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 0.0567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0985 -0.6838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3920 0.0757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3811 1.5756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0766 2.3161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7831 1.5567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0657 3.8161 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3593 4.5755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3483 6.0755 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6637 3.8350 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.6637 5.0350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6747 2.3351 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9573 4.5945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2617 3.8539 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 15.5553 4.6134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8597 3.8729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8707 2.3729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1751 1.6324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4687 2.3918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4578 3.8918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1533 4.6323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7731 1.6513 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.5924 1.0436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0436 0.5924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5924 -1.0436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8200 0.9325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3626 0.9438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1378 -1.6465 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6805 -1.6352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1873 1.2378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1072 -1.8837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4356 -0.5168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7395 2.1491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0222 4.4085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7182 1.7426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1793 5.5081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7219 5.5193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7773 5.5270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3199 5.5382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8358 1.7653 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1839 0.4324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.4926 4.4993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1446 5.8323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 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 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 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 13 2 0 0 0 0 9 10 2 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 12 2 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 M END