MMs00177550 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 43 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 0.0054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2547 -1.2909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7547 -1.2855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7453 1.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2453 1.3071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4906 2.6035 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 0.0216 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7546 -1.2747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0093 -2.5765 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2546 -1.2693 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.6546 -2.3086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 0.0324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4999 0.0378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2453 1.3395 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2546 -1.2585 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7229 -1.5651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9333 -0.6791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3058 -1.2842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4679 -2.7755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2576 -3.6615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8851 -3.0563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5170 -3.6714 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5093 -2.5603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0093 -2.5657 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0043 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0043 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6584 -2.3323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3584 -2.3226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3416 2.3539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5962 1.0630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8708 0.4388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2041 1.2149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8036 0.5139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2741 -0.5754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5660 -3.2596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3873 -4.8545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4130 -3.6070 0.0000 H 0 0 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 26 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 25 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 26 40 1 0 0 0 0 M END