CHEMBRIDGE-ZINC04894590 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 1 0 0 0 0 0999 V2000 0.1230 1.5080 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 0.0010 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4540 -0.6930 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4580 -2.0740 1.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 -2.7660 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6970 -2.0660 -1.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6920 -0.6850 -1.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3240 -2.8130 -2.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -4.1640 -0.0240 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2400 -4.8430 1.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 -4.2420 2.1900 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3410 -6.3180 1.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3080 -7.0100 -0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4020 -8.3860 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5270 -9.0850 1.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5600 -8.4050 2.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4730 -7.0220 2.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6860 -9.1180 3.4950 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5990 -8.5380 4.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2620 -7.3940 4.9250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 -9.5750 5.7510 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3340 -9.5260 6.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4280 -9.2890 6.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1450 -10.5290 6.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1510 -11.5840 5.5750 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5700 -11.1570 4.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7120 -12.0190 5.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 -10.8740 4.9870 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2460 -11.1900 5.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 -10.4470 3.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 -11.1680 2.5960 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9860 -12.7890 6.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 1.8690 0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 1.8760 -1.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7550 1.8700 0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -0.1540 1.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9070 -2.6150 1.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 -0.1400 -1.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5730 -2.9900 -2.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1390 -2.2210 -2.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7120 -3.7670 -1.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -4.6460 -0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2100 -6.4680 -1.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3770 -8.9200 -1.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6000 -10.1620 1.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5040 -6.4920 3.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9750 -8.8970 5.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4210 -8.5330 6.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1700 -10.2740 6.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6210 -10.9180 7.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6990 -12.7350 4.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3320 -12.5090 6.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5570 -13.2200 6.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9880 -13.5370 5.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0090 -12.4690 6.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 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 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 38 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 10 11 2 0 0 0 0 10 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 43 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 15 16 2 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 30 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 28 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 32 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 30 31 2 0 0 0 0 32 53 1 0 0 0 0 32 54 1 0 0 0 0 32 55 1 0 0 0 0 M END