CHEMBRIDGE-ZINC04688065 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 0.6740 1.8740 0.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 1.3150 2.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 1.3300 3.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8240 2.6790 3.6140 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1570 3.3620 2.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9640 3.3530 1.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0980 3.2390 4.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5580 2.4570 5.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8410 3.0140 7.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6580 4.3890 7.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1860 5.2290 6.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9250 4.6160 5.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9880 6.5850 6.5330 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5420 7.5430 5.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2880 8.9130 6.1890 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5730 8.7990 7.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 9.9600 5.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0830 10.6370 4.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8850 10.6190 6.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5260 9.4120 6.7380 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9910 4.9200 8.7080 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.6530 4.1950 9.4660 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5960 6.0580 9.0090 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9560 0.8260 0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5120 2.4600 0.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3120 2.2850 -0.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7760 1.8980 2.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2590 0.2880 2.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0340 0.6420 3.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8890 0.9540 4.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0010 2.8340 1.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4910 4.3940 2.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2590 3.7340 0.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1290 3.9450 1.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7390 1.3930 5.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2080 2.3610 7.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5380 5.2340 4.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1890 6.9660 7.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6110 7.1980 5.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3140 7.6310 4.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 10.6870 5.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2290 9.5490 4.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9350 11.6450 4.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5860 10.0360 4.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6210 11.4630 6.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9640 10.6370 5.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4520 1.9310 1.1890 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.2210 1.3700 0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 47 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 2 47 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 6 47 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 21 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 20 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 47 48 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M CHG 1 47 1 M END