MMs02299763 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 54 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 0.0117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2601 -1.2814 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 -1.2696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 0.0352 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5202 -2.5628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0202 -2.5510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7803 -3.8442 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2803 -3.8324 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.2685 -2.3325 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2920 -5.3324 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7802 -3.8207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5200 -2.5158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0200 -2.5041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7801 -3.7972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0403 -5.1020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5404 -5.1138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8005 -6.4187 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.2801 -3.7854 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 12.7598 -1.1992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7600 -1.2462 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 8.2599 -1.2344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9997 0.0705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2396 1.3636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7396 1.3518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9998 0.0470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9794 2.6685 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4793 2.6802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2192 3.9616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7804 -3.8676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0406 -5.1725 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0094 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0094 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2823 1.1918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6243 0.4310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1885 -4.8880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9119 -1.4813 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6484 -6.1366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8037 -1.7910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3516 -0.1553 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7159 -0.6073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8680 -2.2689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1997 0.0799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1315 2.3863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3998 0.0423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4887 1.4802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6793 2.6896 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4699 3.8802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2537 4.5697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6111 4.9961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1847 3.3535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4087 -7.4532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 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 2 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 18 53 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 30 31 3 0 0 0 0 M CHG 1 21 1 M END