OTAVA-ZINC05374835 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 0 0 1 0 0 0 0 0999 V2000 1.4270 0.4760 -0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -0.8170 -0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -1.5020 1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8580 -0.5000 -0.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7750 -1.7200 -0.7450 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7440 -2.4070 0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2090 -1.1190 -0.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6150 -0.9920 -2.0640 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4300 -2.4610 -1.9670 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 -3.5150 -2.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -3.9720 -1.0800 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3890 -4.0510 -3.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4390 -5.2580 -3.4570 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1820 -6.4820 -3.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3850 -6.6720 -3.1410 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8190 -7.5680 -3.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4680 -8.8440 -3.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 -9.9740 -3.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7770 -10.5470 -1.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6720 -11.6180 -1.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1850 -12.1230 -3.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8030 -11.5600 -4.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9100 -10.4870 -4.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 -6.9300 -3.5080 S 0 0 0 0 0 0 0 0 0 0 0 0 1.8130 -5.2710 -3.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8480 -3.9840 -3.8440 S 0 0 0 0 0 0 0 0 0 0 0 0 2.4760 0.2680 0.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 0.9630 -1.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0470 1.1840 0.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0420 -1.4730 -0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2730 -0.8880 1.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2200 -2.4750 1.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7680 -1.6730 1.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2780 0.1490 0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8600 0.1000 -1.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9540 -2.1300 -2.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3820 -4.2860 -3.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -3.2730 -4.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5750 -9.1070 -2.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3890 -10.1610 -0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9720 -12.0580 -0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8830 -12.9550 -3.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2030 -11.9540 -5.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6220 -10.0540 -5.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7870 -0.8460 0.2220 O 0 5 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 2 4 1 0 0 0 0 2 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 45 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 12 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 25 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 M CHG 1 45 -1 M END