CHEMBRIDGE-ZINC04867594 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 50 0 0 1 0 0 0 0 0999 V2000 0.6390 1.3800 5.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 -0.0650 5.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8740 -0.5100 4.3910 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6160 -1.7980 4.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 -2.5790 4.6730 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2970 -2.1670 2.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4670 -3.6920 2.6700 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9140 -3.9530 1.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4800 -4.1520 3.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5720 -3.6010 3.8640 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1580 -5.2160 4.5310 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8850 -5.8990 4.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 -5.8550 3.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6600 -4.2860 1.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0980 -4.7400 1.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5370 -5.7750 0.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8690 -6.1980 0.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7780 -5.5910 1.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3460 -4.5560 2.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0170 -4.1230 2.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5040 -3.1190 3.0750 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4100 -2.4310 3.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1040 -5.9070 1.6040 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6070 -6.9410 0.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3290 2.0070 4.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1800 1.7650 6.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7270 1.4730 5.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5780 -0.6840 6.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8440 -0.1400 5.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7050 -1.7690 1.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2800 -1.6820 2.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8710 -5.5010 5.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0580 -6.9350 4.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 -5.4240 5.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8240 -6.3740 2.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7750 -6.2940 3.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0870 -4.8540 0.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6400 -3.2340 1.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8510 -6.2640 -0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1640 -7.0010 -0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0810 -4.1060 2.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8500 -1.6460 4.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2070 -1.9460 3.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8190 -3.1050 4.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6720 -7.0610 0.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5130 -6.6720 -0.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1130 -7.8950 0.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 -4.4110 2.6930 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.4800 -3.9230 3.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 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 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 48 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 13 48 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 14 48 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 48 1 M END