CHEMBRIDGE-ZINC04980270 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.6080 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 0.1590 -2.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7820 -0.4560 -3.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 -1.8360 -3.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2780 -2.6060 -2.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 -1.9960 -1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3400 -4.1100 -2.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -6.0890 -2.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3900 -6.5790 -3.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6300 -6.1650 -4.4840 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5670 -4.7030 -4.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1860 -4.2130 -4.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8540 -6.6570 -4.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0340 -6.3020 -4.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2420 -6.7900 -4.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2770 -7.6310 -5.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1040 -7.9880 -6.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8920 -7.4980 -6.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7460 -7.8420 -6.6840 F 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 0.3640 -4.2170 N 0 3 0 0 0 0 0 0 0 0 0 0 2.3330 1.5800 -4.1540 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9220 -0.1760 -5.1650 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 1.2370 -2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3160 -2.3120 -4.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 -4.4040 -2.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5440 -4.5200 -1.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1590 -6.3690 -1.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -6.5440 -3.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4290 -7.6660 -3.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1540 -6.1460 -2.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7350 -4.4220 -5.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3330 -4.2480 -3.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5780 -4.6460 -4.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1470 -3.1260 -4.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0080 -5.6460 -3.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1600 -6.5140 -4.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2220 -8.0100 -6.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1340 -8.6450 -7.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 -2.7520 -0.1360 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -4.6260 -2.7800 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8060 -2.9830 -0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 22 1 0 0 0 0 6 7 2 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 44 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 9 45 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 10 45 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 44 46 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END