NIH-ZINC00614138 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 35 0 0 0 0 0 0 0 0999 V2000 -0.0220 1.8100 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.7090 -0.4240 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0990 -1.7580 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4410 -2.0830 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3970 -1.0830 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0120 0.2460 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6720 0.5780 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1080 -1.5030 0.0510 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.8000 -0.3820 -0.4810 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2050 -2.8090 -0.4990 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5700 -1.6280 1.6370 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5490 -0.4450 2.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3420 -0.7230 3.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7160 -1.2600 4.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4420 -1.5150 6.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7960 -1.2340 6.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4220 -0.6960 4.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6930 -0.4360 3.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7100 -1.5550 7.4880 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 2.1870 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 2.1710 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 2.1610 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3540 -2.5390 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7450 -3.1190 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7610 1.0240 0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3720 1.6160 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8540 -2.4840 1.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5190 -0.2090 2.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9890 0.4000 1.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6590 -1.4800 4.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9540 -1.9350 6.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4790 -0.4760 4.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1810 -0.0130 2.9260 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 8 27 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 19 34 1 0 0 0 0 M END