MMs03310897 MOE2007 2D CORINA 3.40 0006 02.08.2006 45 46 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 -0.8952 -1.2036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3851 -1.0301 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1206 0.2772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4952 1.6406 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5912 -0.0182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7646 -1.5082 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.6132 -0.6596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4012 -2.1336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1058 -3.6042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0720 -2.2436 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.0887 -3.7435 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3625 -1.4791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6699 -2.2145 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.6699 -1.0145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6867 -3.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9605 -1.4501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9437 0.0498 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.2678 -2.1855 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.4413 -3.6754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9119 -3.9709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6473 -2.6635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6312 -1.5601 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -13.7903 -1.2495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9267 -0.0895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8008 0.9017 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9629 -0.7162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7162 0.9629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9629 0.7162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1774 -1.7417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2388 -2.3533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7033 1.1765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7911 -0.0048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5810 -0.5685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1236 -0.5513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2866 -3.7077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7001 -4.9144 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4867 -3.7279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8413 -3.6821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3292 -4.8702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5538 -5.1162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0135 -4.4467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.6260 -3.3580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.4402 -1.7628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3480 0.3900 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 9 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 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 11 1 0 0 0 0 9 10 2 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 M CHG 1 45 -1 M END