MMs00580506 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 47 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 0.7595 -1.2935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2595 -1.2824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 0.0221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2404 1.3156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7404 1.3045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2358 2.4376 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6106 1.8376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4648 0.3447 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.9041 2.5972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2086 1.8567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5021 2.6163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4911 4.1162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1866 4.8567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8931 4.0971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7846 4.8758 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.0891 4.1353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1001 2.6354 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3826 4.8949 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.3433 5.4949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3715 6.3948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6650 7.1544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9695 6.4140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9806 4.9140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6871 4.1545 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.7263 3.5545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6981 2.6545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4046 1.8950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1672 -2.3371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8671 -2.3172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1328 2.3393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2175 0.6568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5457 2.0239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1777 6.0566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8495 4.6895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7757 6.0757 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1913 6.1778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9528 7.5194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6562 8.3543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0043 7.0216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1608 5.1311 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3993 3.7894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0026 1.9141 0.0000 O 0 5 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 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 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 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 21 1 0 0 0 0 19 25 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 2 0 0 0 0 27 44 1 0 0 0 0 M CHG 1 44 -1 M END