CHEMBRIDGE-ZINC04865749 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 -0.4330 1.2450 -0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -0.1960 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2540 -0.8150 1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6490 -2.1510 1.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7900 -2.8780 0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5340 -2.2760 -1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 -0.9360 -1.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1380 -0.2550 -2.3950 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0750 -0.9870 -3.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4610 -0.0110 -4.7310 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4330 0.4460 -4.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4660 -0.6750 -6.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4220 0.0330 -8.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6440 1.2480 -9.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6260 1.9290 -9.5560 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4360 2.3040 -8.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6770 1.0850 -7.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0250 2.2370 -10.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 2.8390 -11.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 3.1910 -13.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7350 2.9430 -13.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6710 2.3370 -12.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3300 1.9770 -11.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1920 1.3240 -10.4890 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5040 1.0440 -10.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4940 1.0720 -4.7970 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6320 1.3620 -3.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2830 1.8400 -0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4270 1.3360 -0.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 1.6730 0.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1490 -0.2580 2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8480 -2.6210 2.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0990 -3.9200 0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6600 -2.8820 -2.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9510 -1.3390 -3.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7790 -1.8260 -3.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4200 -1.3080 -6.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3670 -1.2620 -6.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1670 -0.7440 -8.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3830 -0.3800 -8.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3390 1.9520 -8.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1160 0.8930 -10.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8890 3.0680 -7.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3930 2.7630 -8.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1640 1.3850 -6.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2790 0.3200 -7.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9020 3.0710 -11.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2810 3.6650 -13.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0110 3.2160 -14.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6590 2.1510 -13.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0450 1.9660 -11.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4790 0.3630 -11.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0470 0.5400 -10.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3450 0.4370 -7.1360 N 0 3 0 0 0 0 0 0 0 0 0 0 0.2220 1.1440 -6.6190 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 26 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 12 54 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 13 54 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 17 54 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 21 22 2 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 26 27 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END