MMs02556941 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 45 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 0.7609 1.2927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0218 2.5980 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4781 2.6106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2390 1.3179 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4999 0.0126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2172 3.9159 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7171 3.9285 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7297 2.4285 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7045 5.4284 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2171 3.9411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9780 2.6484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4779 2.6610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2170 3.9663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4561 5.2590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9561 5.2464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7169 3.9789 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.4560 5.2842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6951 6.5768 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.9559 5.2968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6950 6.6020 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.1949 6.6146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.9558 5.3220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.4558 5.3345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.1948 6.6398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.4340 7.9325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.9340 7.9199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.1731 9.2126 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -17.2167 4.0419 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.5913 -1.0442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9608 1.2826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1087 -1.0216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6085 4.9500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3867 1.6041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0866 1.6268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0473 6.3032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3474 6.2805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3256 2.9447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7575 4.1133 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0870 4.8958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3646 4.2777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.3948 6.6499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.0252 8.9768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 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 39 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 29 1 0 0 0 0 25 26 2 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 M END