IFLAB-ZINC04176294 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 -0.1220 1.4240 0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 -0.0040 0.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5640 -0.6140 1.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 0.0500 1.9520 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6430 -2.0250 1.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2710 -2.7560 2.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 -4.1180 1.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 -4.5170 0.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 -3.1150 -0.0790 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3450 -5.9220 0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3600 -6.2170 -0.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 -7.5310 -1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 -8.5560 -0.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6710 -8.2700 0.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8650 -6.9610 1.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9140 -2.1640 3.1800 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 -2.9320 4.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3610 -4.1440 4.0830 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9700 -2.3020 5.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4710 -3.0960 6.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0050 -2.5030 7.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0450 -1.1210 7.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5480 -0.3280 6.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0180 -0.9110 5.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5680 -0.5440 8.7510 F 0 0 0 0 0 0 0 0 0 0 0 0 0.8940 1.8170 0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6690 1.7860 -0.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6230 1.7600 0.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6620 -4.8160 2.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7620 -5.4180 -1.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0860 -7.7600 -2.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 -9.5820 -0.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0690 -9.0750 1.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4150 -6.7390 2.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0140 -1.2000 3.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4410 -4.1720 6.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3920 -3.1150 8.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5820 0.7480 6.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6360 -0.2920 4.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 16 1 0 0 0 0 7 8 2 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 13 14 2 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 18 2 0 0 0 0 17 19 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 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 24 39 1 0 0 0 0 M END