IFLAB-ZINC04280272 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 45 0 0 1 0 0 0 0 0999 V2000 1.2550 1.8230 -1.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 0.9500 -1.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3900 -0.1010 0.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3640 -1.0740 1.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 -1.4930 -1.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 -2.1250 -2.7200 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0540 -1.5390 -3.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2800 -3.5760 -2.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3610 -4.0330 -4.1140 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0980 -5.3160 -4.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6850 -5.6930 -5.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5000 -6.9800 -6.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2770 -7.9100 -5.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8630 -7.5300 -4.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6790 -6.2420 -3.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5140 -9.2270 -5.9870 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0500 -9.8170 -7.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6470 -9.3030 -8.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5130 -11.2470 -7.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5720 -2.0500 -2.4940 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9840 -2.6010 -3.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6240 2.1630 -1.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0650 1.2850 -2.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0220 2.7110 -2.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7980 1.4600 -1.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3230 0.6570 -2.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6280 -0.2190 0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7210 0.9230 0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3730 -0.9460 0.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4140 -0.8970 2.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0660 -2.1150 0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5420 -1.1440 -1.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 -2.1990 -0.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -4.1810 -2.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3700 -3.6310 -3.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2940 -4.9810 -6.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9780 -7.2200 -7.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4740 -8.2310 -3.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1550 -6.0030 -2.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0890 -9.8030 -5.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6060 -11.2800 -7.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1060 -11.6910 -8.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 -11.8260 -6.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3470 -0.3090 -1.0790 N 0 3 0 0 0 0 0 0 0 0 0 0 1.2890 -0.6310 -1.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 25 1 0 0 0 0 2 26 1 0 0 0 0 2 44 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 3 44 1 0 0 0 0 4 29 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 5 44 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 20 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 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 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 44 1 M END