IFLAB-ZINC02712783 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 32 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.7420 -0.5110 1.2420 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2850 -0.0870 2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6550 -2.0370 1.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 -2.5880 0.0760 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1480 -0.1040 1.1720 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5180 1.1160 1.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6880 1.8770 2.0590 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9640 1.5350 1.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1100 2.9320 2.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4550 3.1220 3.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5860 4.4440 3.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8970 4.6410 5.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3650 5.4830 3.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4530 6.3910 3.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0220 5.2640 1.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8260 6.2110 1.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9000 4.0130 1.2710 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6570 3.8760 0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2560 -2.4040 2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3830 -2.3370 1.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1230 -3.5550 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8120 -0.7120 0.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5710 0.8480 2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2970 1.5140 0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6280 2.2780 4.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 7 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 5 27 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 2 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 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 M END