IFLAB-ZINC04304068 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7000 1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0810 1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7710 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0680 -1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6880 -1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.1670 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -4.8930 -1.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -6.3760 -1.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0060 -7.1710 -0.9730 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9280 -6.8980 -1.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5570 -8.4500 -0.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 -8.3640 -0.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1590 -7.0870 -0.8170 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5510 -9.5150 -0.3470 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9160 -10.6910 -0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5690 -11.6910 0.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4220 -10.7890 -0.2800 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1820 -9.7040 -0.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3930 -9.8050 -0.6150 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0640 -12.0930 -0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0110 -9.4510 -0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1640 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6240 2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.6010 -2.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.1410 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -4.6570 0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8420 -4.6390 -1.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9380 -4.6140 -1.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3030 -12.8490 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7540 -12.0460 0.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6120 -12.3560 -1.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2910 -9.2560 0.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4400 -10.4010 -0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3870 -8.6500 -0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 20 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 23 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 22 1 0 0 0 0 20 21 2 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 M END