CHEMBRIDGE-ZINC00942088 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 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 0.7040 -0.4850 1.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 -1.8220 1.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3320 -2.5650 0.4880 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 -2.3790 2.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0830 -1.5870 3.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6710 -2.2930 4.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5140 -4.0130 4.1450 S 0 0 0 0 0 0 0 0 0 0 0 0 1.6510 -3.7290 2.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 -4.7180 1.8640 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 -6.0160 2.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9660 -6.3180 3.1800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8440 -7.0720 1.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0450 -8.4170 1.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5590 -9.3980 0.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1270 -9.0500 -0.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3300 -7.7190 -0.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 -6.7280 0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6460 -10.1080 -1.2980 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.4680 -11.2810 -1.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2500 -9.8060 -2.3120 O 0 5 0 0 0 0 0 0 0 0 0 0 3.3540 -1.7070 5.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9340 -2.5380 6.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5700 -1.9850 7.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6330 -0.6100 7.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0600 0.2190 6.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4260 -0.3210 5.7830 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 -1.0200 -0.3810 0.0100 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 2.0560 -0.5080 3.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6840 -4.4770 1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5810 -8.6900 2.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 -10.4390 0.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 -7.4550 -1.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -5.6890 -0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8860 -3.6110 6.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0200 -2.6260 8.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1310 -0.1820 8.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1120 1.2910 7.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9830 0.3270 5.0420 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 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 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 34 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 35 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 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 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 38 1 0 0 0 0 19 39 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 28 2 0 0 0 0 24 25 2 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 26 27 2 0 0 0 0 26 42 1 0 0 0 0 27 28 1 0 0 0 0 27 43 1 0 0 0 0 28 44 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END