IFLAB-ZINC04188645 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 34 0 0 0 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 0 0 0 0 0 0 0 0 0 0 0.7630 -2.0410 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4920 -2.5400 2.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9500 -1.7500 3.2520 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6350 -3.8640 2.6590 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3070 -4.3250 3.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5030 -5.5710 4.0820 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1680 -5.8250 5.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5600 -4.7420 5.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0310 -3.3060 5.0250 S 0 0 0 0 0 0 0 0 0 0 0 0 3.4580 -7.2060 5.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0250 -8.2900 4.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3040 -9.5720 5.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0060 -9.7320 6.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4050 -8.6140 7.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1320 -7.4020 6.7800 N 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 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 -2.4180 1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -2.3920 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2690 -4.4960 2.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1100 -4.7520 6.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4810 -8.1290 3.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9810 -10.4310 4.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2390 -10.7210 6.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9510 -8.7350 8.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 16 17 2 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 M END