MMs02481788 MOE2007 2D CORINA 3.40 0006 02.08.2006 56 57 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 0.0025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2521 -1.2953 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5043 -2.5956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2564 -3.8934 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0043 -2.5981 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 -3.6383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7479 -1.3003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2479 -1.3028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7521 -1.2928 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1521 -0.2536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6318 -0.0779 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.4803 0.7707 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0592 -0.5390 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.2183 -0.8496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0616 -2.0390 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.7511 -3.1981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6358 -2.5049 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2766 -2.9187 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.3159 -3.5187 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1223 -4.4107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7530 -5.0231 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6459 -2.3063 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.8609 -3.1860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7066 -4.6780 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.2302 -2.5736 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -12.2694 -1.9736 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4452 -3.4533 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -13.2937 -4.3018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8145 -2.8409 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -14.8537 -2.2409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.0295 -3.7206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.3988 -3.1082 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -17.6138 -3.9879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.9831 -3.3755 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -17.4595 -5.4799 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.9688 -1.3489 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.2909 -4.9453 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2712 0.3447 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1659 1.3480 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6017 1.0382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0983 1.0427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7694 -1.1127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1677 -4.5556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.7022 -4.7143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.4314 -6.1837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.3640 -5.9698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.0643 -0.8590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2629 -5.6491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4126 -0.3779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1438 1.5379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9674 2.2411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3373 -5.2904 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.3845 -1.0816 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.4800 -0.5917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2138 -6.4840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 8 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 2 42 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 40 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 39 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 23 1 0 0 0 0 21 22 2 0 0 0 0 21 53 1 0 0 0 0 23 24 1 0 0 0 0 23 43 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 28 1 0 0 0 0 26 54 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 38 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 37 1 0 0 0 0 32 33 1 0 0 0 0 32 44 1 0 0 0 0 32 45 1 0 0 0 0 33 34 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 36 46 1 0 0 0 0 36 47 1 0 0 0 0 37 48 1 0 0 0 0 38 49 1 0 0 0 0 39 51 1 0 0 0 0 40 52 1 0 0 0 0 50 54 1 0 0 0 0 53 56 1 0 0 0 0 54 55 1 0 0 0 0 M END