CHEMBRIDGE-ZINC04956318 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 44 0 0 1 0 0 0 0 0999 V2000 -0.0350 1.5790 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 0.0510 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5010 -0.4710 0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5420 -2.0020 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9660 -2.5770 0.0150 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5330 -2.1400 -0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9400 -4.1070 -0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3330 -4.7260 -0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2500 -6.2400 -0.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6410 -6.8530 -0.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6660 -8.3780 -0.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5490 -8.9530 -0.7580 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3930 2.1170 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4080 3.6430 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8250 4.1980 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9230 5.7250 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8410 6.3500 0.2000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6350 1.9890 -0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4960 1.9180 0.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3890 -0.2930 -0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5320 -0.3600 0.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9520 -0.0940 0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0920 -0.0760 -0.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0000 -2.3550 -0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0010 -2.3920 0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3410 -4.3850 -0.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4360 -4.5400 0.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9350 -4.5180 0.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8500 -4.2760 -1.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6750 -6.4690 -1.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7090 -6.6860 0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2270 -6.5810 0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1620 -6.4420 -1.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9980 1.6970 0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8490 1.7940 -1.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 4.0620 -0.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9470 3.9600 0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4360 3.7790 0.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2810 3.8880 -1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8280 -8.8740 -0.6220 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.6870 -2.1900 1.2620 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.6530 -2.5420 1.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7550 -1.1710 1.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2200 -2.5600 2.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1000 6.1740 -0.0930 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 13 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 24 1 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 41 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 9 31 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 11 12 2 0 0 0 0 11 40 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 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 15 39 1 0 0 0 0 16 17 2 0 0 0 0 16 45 1 0 0 0 0 41 42 1 0 0 0 0 41 43 1 0 0 0 0 41 44 1 0 0 0 0 M CHG 1 40 -1 M CHG 1 41 1 M CHG 1 45 -1 M END