MMs01746485 MOE2007 2D CORINA 3.40 0006 02.08.2006 30 32 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 1.2948 0.7574 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6066 -1.4852 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8928 0.7722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0296 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2046 -1.4704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5079 -2.2130 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8026 -1.4557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2318 -1.9111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8497 -3.2779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3424 -3.4262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2171 -2.2077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5992 -0.8408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1066 -0.6925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2180 0.5160 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.5824 1.6593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 0.0443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4908 0.7869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4823 2.2869 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6059 1.0358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0358 -0.6059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6059 -1.0358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1162 1.6870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6589 1.6958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1688 -2.0763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1499 -4.2527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8367 -4.5196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4113 -2.3263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2991 0.1340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 19 1 0 0 0 0 7 8 2 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 18 2 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 27 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 M END