CHEMBRIDGE-ZINC01140363 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 0.4390 1.7250 0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1640 0.2340 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 -0.5560 1.2000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7560 -0.5070 1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2490 -1.9440 1.0780 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0780 -2.1580 0.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6600 -2.9040 1.7080 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8130 -1.4330 -0.1530 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3270 0.0040 -0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0980 0.9280 -0.2490 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3200 -1.4740 0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 -2.0860 -1.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0380 -3.4930 -1.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3240 -3.7350 -1.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8200 -5.0260 -1.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0280 -6.0740 -1.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7420 -5.8320 -1.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2450 -4.5420 -1.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5590 -7.4560 -1.5580 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.6930 -7.6690 -1.9480 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8620 -8.3800 -1.1780 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0910 0.0350 2.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9090 0.7180 3.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3800 1.2600 4.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9670 1.1200 4.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7850 0.4370 3.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2570 -0.1020 2.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8780 -0.2510 -1.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5110 1.8850 0.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 2.2840 -0.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0790 2.0690 1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5380 -0.9890 1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8420 -0.9510 -0.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6550 -2.5110 0.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9630 -1.5100 -2.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4190 -2.1100 -1.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9420 -2.9160 -2.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8250 -5.2150 -2.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1240 -6.6510 -0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2390 -4.3540 -0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9620 0.8280 3.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0190 1.7940 5.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3800 1.5430 5.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8380 0.3270 4.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8970 -0.6320 2.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9020 0.1240 -1.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8900 -1.3400 -1.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3520 0.1200 -2.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 9 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 22 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 8 12 1 0 0 0 0 9 10 2 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 2 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 27 45 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END