MMs01688236 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 0.0058 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2550 -1.2904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5100 -2.5923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2649 -3.8884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7649 -3.8827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5099 -2.5808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7550 -1.2846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7450 1.3134 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 0.0230 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7450 1.3249 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.3450 0.2857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9900 2.6211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7350 3.9230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9800 5.2192 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.7250 6.5211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2450 1.3307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9900 2.6326 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 0.0346 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4999 0.0403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1452 1.3944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6067 1.7324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7825 0.8010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7883 -0.6989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6190 -1.6381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1556 -1.3088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0046 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0046 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3100 -2.5969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6689 -4.9300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3689 -4.9196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7099 -2.5762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6039 -1.0139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0737 1.8462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0678 3.3889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6572 3.1552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6513 4.6979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7665 5.9251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3210 7.5626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6835 7.1171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4039 -1.0070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8999 -0.9989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9743 1.6571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1413 2.5944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0827 2.8119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5425 2.4835 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2994 1.8840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9534 0.5383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9572 -0.4276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3128 -1.7782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5597 -2.3831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1018 -2.7209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9866 -1.5798 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1595 -2.5088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 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 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 18 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 27 1 0 0 0 0 21 44 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 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 M END