IBS-ZINC02253163 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 44 0 0 0 0 0 0 0 0999 V2000 -1.1280 2.8030 -1.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0920 1.5560 0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2270 4.0840 0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0910 4.2990 1.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7970 5.6670 1.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6200 5.9360 3.1310 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6960 7.2130 3.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1050 8.1910 3.2120 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5580 7.3670 4.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8960 6.9670 4.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7570 7.1680 5.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2760 7.7880 7.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9380 8.1890 7.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0930 7.9720 5.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6930 8.3280 6.1330 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.4380 9.4810 6.5040 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8620 7.4330 5.9240 O 0 5 0 0 0 0 0 0 0 0 0 0 -6.1920 7.9450 8.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7740 8.6240 9.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0820 6.8060 5.8440 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6140 6.1870 4.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4550 1.8730 -2.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 2.8900 -2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5970 3.6540 -2.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 1.6050 0.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 0.6830 -0.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5390 1.5210 1.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4000 4.8940 -0.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 4.0450 0.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1540 4.2350 1.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9030 3.5230 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7510 5.7320 2.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9680 6.4600 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1200 5.1770 3.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2550 6.5270 3.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5380 8.6550 7.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6350 8.6880 9.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9880 8.0650 9.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4510 9.6460 8.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5670 6.8610 3.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1080 5.2390 4.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6680 5.9660 4.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5920 2.7910 -0.5630 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.6190 2.7240 -0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 43 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 2 43 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 43 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 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 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 20 1 0 0 0 0 12 13 2 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 18 19 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 43 44 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M CHG 1 43 1 M END