CHEMBRIDGE-ZINC02903220 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 0.3240 1.1980 -0.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1690 -0.2120 -0.1510 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1010 -0.7220 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2650 0.0610 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5400 -0.5270 0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6040 -1.9360 0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4510 -2.7340 0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1970 -2.1290 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -2.8140 -0.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0590 -4.2330 -0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8820 -2.6290 0.3190 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.0630 -3.6590 -0.3400 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6950 -2.1240 1.1130 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.7500 0.3770 0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6400 1.2660 1.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2720 1.1390 2.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5540 1.8970 3.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7100 3.1920 3.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0380 3.5160 3.4300 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.4370 4.4040 3.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7600 2.4580 2.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8560 1.4230 2.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3510 0.2070 2.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7210 0.0730 1.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5970 1.1250 2.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1330 2.3390 2.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3930 1.4130 -0.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 1.6020 -1.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 1.6840 0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1910 1.1450 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5480 -3.8150 0.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6230 -4.5610 -1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9670 -4.5970 -0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 -4.6630 0.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4750 1.4160 -0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4840 0.0630 -0.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3270 0.9410 0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3140 2.2920 1.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4560 0.0830 3.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5700 1.5040 3.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9920 3.9100 3.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6840 -0.6260 1.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1060 -0.8640 1.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6600 1.0010 1.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8200 3.1550 2.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4310 0.3870 1.4910 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.7270 -0.5980 1.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7540 0.6290 2.2270 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 14 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 45 1 0 0 0 0 46 47 1 0 0 0 0 46 48 1 0 0 0 0 M CHG 1 11 1 M CHG 1 13 -1 M CHG 1 46 1 M END