NIH-ZINC02882202 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 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 0.6930 -0.4770 1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -1.8240 1.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2550 -2.6730 0.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3670 -4.0410 0.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 -4.5660 1.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5700 -3.7220 2.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4650 -2.3530 2.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1680 -1.2780 3.6100 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 -0.3320 3.9400 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7960 -2.1120 4.5730 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3790 -0.4290 2.8650 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0600 0.5080 1.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2620 1.4180 1.5280 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1290 0.8180 1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9340 2.4130 0.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1210 3.8040 1.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0340 3.4750 2.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5540 2.1870 2.7070 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 -6.2870 1.7880 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 -4.9630 -0.5290 C 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 -0.2590 -2.2630 -0.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0830 -4.1340 3.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3000 -0.5530 3.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8260 -0.0500 0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2000 1.1130 2.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6250 2.2870 -0.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9040 2.2840 0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6160 4.4920 0.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1650 4.2100 1.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0760 3.4070 1.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9160 4.2230 3.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5130 -5.1700 -1.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 -5.8970 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1000 -4.4890 -0.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 22 1 0 0 0 0 7 8 2 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 20 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 M END