CHEMBRIDGE-ZINC02999134 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 0 0 0 0 0 0999 V2000 0.1000 1.2440 0.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 -0.2490 0.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9910 -0.6590 -0.5280 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3480 -1.9730 -0.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 -2.9690 0.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4560 -4.3010 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0980 -4.6570 -1.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 -3.6760 -2.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0180 -2.3520 -1.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3340 -1.3530 -2.8220 N 0 3 0 0 0 0 0 0 0 0 0 0 3.1430 -0.4680 -2.5110 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7970 -1.4870 -3.9300 O 0 5 0 0 0 0 0 0 0 0 0 0 2.5170 -6.0580 -1.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5850 -6.2280 -1.9730 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6090 -7.0400 -0.9910 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6950 -8.4520 -1.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9560 -9.3300 -1.6900 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 -8.9900 -0.3320 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0650 -10.2330 -0.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 -10.9460 -1.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7370 -12.1450 -1.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5070 -12.6250 -0.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5760 -11.9200 0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8670 -10.7200 0.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9870 -10.0080 1.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6990 -12.8870 -3.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -12.3540 -4.1520 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0400 1.7890 0.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5350 1.4750 -0.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3880 1.6120 1.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0070 -0.4500 1.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6010 -0.7700 0.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5760 -2.7460 1.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2610 -5.0350 0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9110 -3.9430 -3.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7290 -6.6980 -0.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2430 -8.4220 0.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5310 -10.5640 -2.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0690 -13.5510 -0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1930 -12.3180 1.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5130 -9.0570 1.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5480 -10.6000 2.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -9.8240 2.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3350 -13.9860 -3.2680 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 26 44 2 0 0 0 0 M CHG 1 10 1 M CHG 1 12 -1 M CHG 1 27 -1 M END