CHEMBRIDGE-ZINC01144550 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7250 -0.4880 1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1990 -0.6690 1.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9130 0.0700 0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2190 -0.1420 -0.0300 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8320 -1.0640 0.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1690 -1.8090 1.5670 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8720 -1.6380 1.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1250 -2.4850 2.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6460 -3.6380 2.1130 F 0 0 0 0 0 0 0 0 0 0 0 0 2.9870 -2.8480 3.7850 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0490 -1.7560 3.2620 F 0 0 0 0 0 0 0 0 0 0 0 0 6.5660 -1.3080 0.4930 S 0 0 0 0 0 0 0 0 0 0 0 0 6.8370 -2.6380 1.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2940 -3.0230 1.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0720 -2.4530 0.9570 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7320 -3.9990 2.5120 N 0 0 0 0 0 0 0 0 0 0 0 0 10.1480 -4.3730 2.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3770 -5.4980 3.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8350 -5.8820 3.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6060 -5.3330 4.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0760 -5.6080 4.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4340 -6.8950 3.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8250 -6.8250 2.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3000 -6.8820 2.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2740 1.0900 -0.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4090 2.0630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5480 1.8860 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5310 1.8760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3840 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5300 -0.3580 -0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5860 0.2440 2.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2970 -1.4400 1.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5500 -2.2960 2.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2330 -3.5030 1.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1090 -4.4550 3.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4360 -4.7150 1.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7520 -3.5080 2.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0900 -5.1560 4.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7740 -6.3620 3.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1630 -4.6340 5.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6350 -4.7760 4.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3390 -5.7160 5.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5180 -6.9860 3.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0260 -7.7540 4.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1200 -5.8920 1.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1720 -7.6720 1.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9980 -7.8820 2.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8470 -6.6530 1.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0520 1.6490 -1.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6490 0.5800 -1.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 3.0480 -0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7860 2.1290 1.0200 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 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 14 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 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 53 1 0 0 0 0 28 54 1 0 0 0 0 M END