MMs02742145 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 43 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 1.5000 0.0034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2471 1.3041 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7471 1.3075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0102 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4941 2.6082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7412 3.9056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4883 5.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9882 5.2097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7412 3.9123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9941 2.6116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7470 1.3143 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.0444 2.0672 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4497 0.5613 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 0.0169 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 0.0203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7470 1.3211 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7529 -1.2770 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2529 -1.2736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0058 -2.5710 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.5058 -2.5676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2529 -1.2669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5000 0.0305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0000 0.0271 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2470 1.3312 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 14.2588 -3.8649 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7588 -3.8615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0027 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0027 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2943 -1.1788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6286 -0.4045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5412 3.9029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8859 6.2442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5859 6.2503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9412 3.9151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9023 -1.0236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1553 -2.3176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4529 -1.2641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7615 -5.0615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9588 -3.8588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7561 -2.6615 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 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 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 11 2 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 2 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 26 27 1 0 0 0 0 27 40 1 0 0 0 0 27 41 1 0 0 0 0 27 42 1 0 0 0 0 M END