CHEMBRIDGE-ZINC01182227 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 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 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6010 -1.8390 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6650 -2.6180 -0.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9760 -2.3470 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7120 -2.6290 1.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9480 -3.0820 0.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2470 -3.1760 -0.7360 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.6940 -2.5950 -1.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2200 -2.4030 -2.4070 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0100 -2.6790 -3.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1380 -3.0970 -3.2860 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5050 -2.4740 -4.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3210 -2.7590 -5.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8430 -2.5650 -7.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5590 -2.0890 -7.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7460 -1.8040 -6.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2120 -1.9890 -5.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0540 -1.8830 -8.7870 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.7670 -2.1330 -9.7420 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9240 -1.4640 -8.9640 O 0 5 0 0 0 0 0 0 0 0 0 0 -5.9480 -3.4600 2.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2010 -3.6410 3.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3100 -2.4190 3.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1510 -2.4360 2.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1180 0.1090 0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3200 -2.0700 -2.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3230 -3.1310 -5.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4730 -2.7850 -8.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 -1.4330 -6.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5780 -1.7620 -4.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6900 -2.6680 2.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4420 -4.3930 1.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9200 -3.7350 4.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5840 -4.5380 3.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8950 -1.5090 3.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9170 -2.4510 4.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4750 -3.2570 2.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6110 -1.4900 2.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 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 10 2 0 0 0 0 7 8 2 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END