MMs01774213 MOE2007 2D CORINA 3.40 0006 02.08.2006 48 50 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 1.4136 -0.5018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6858 -1.9769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0994 -2.4787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2407 -1.5054 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9685 -0.0303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5549 0.4715 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1099 0.9430 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5234 0.4412 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.0217 -0.9723 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0252 1.8548 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9370 -0.0606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0784 0.9128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4920 0.4110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7642 -1.0641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6228 -2.0374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2093 -1.5356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1778 -1.5659 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.3191 -0.5926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7327 -1.0944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0049 -2.5695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8636 -3.5428 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.4185 -3.0713 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.5599 -2.0980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9734 -2.5998 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.2876 -0.6229 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.8740 -0.1211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6018 1.3540 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.4290 0.3504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6907 -4.5464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4014 1.1309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1309 0.4014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4014 -1.1309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7727 -2.7555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3172 -3.6587 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8921 2.1231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8606 2.0928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4050 1.1896 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8406 -3.2175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2962 -2.3143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3955 -2.7460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1013 0.5875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2076 -0.5627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.3421 1.1291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6503 1.2635 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5107 -4.7642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9085 -5.7264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8708 -4.3286 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 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 27 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 30 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 29 1 0 0 0 0 27 28 2 0 0 0 0 29 43 1 0 0 0 0 29 44 1 0 0 0 0 29 45 1 0 0 0 0 30 46 1 0 0 0 0 30 47 1 0 0 0 0 30 48 1 0 0 0 0 M END