NIH-ZINC03019960 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 42 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 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 -2.0580 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7900 -2.5650 -0.1110 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0210 -3.8880 -0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0910 -4.6600 -0.3220 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4350 -4.4100 -0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4170 -5.9340 -0.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7910 -6.4410 -0.3300 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1060 -7.9890 -0.8260 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.5050 -8.1850 -0.6670 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4340 -8.1580 -2.0670 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3190 -9.0740 0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0020 -9.5120 1.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3850 -10.3620 2.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0840 -10.7760 2.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4000 -10.3370 0.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0200 -9.4910 0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3080 -11.8440 3.2400 Cl 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 0.5120 -0.3560 -0.8950 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 0.7570 -1.6010 1.2360 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 -1.9160 -0.2570 0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9860 -0.1020 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9330 -2.3340 -1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8630 -2.4890 0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5340 -1.9480 -0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9170 -4.1330 0.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9880 -3.9780 -1.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9350 -6.2110 -1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8640 -6.3660 0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5170 -5.8700 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0180 -9.1890 1.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9190 -10.7040 3.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3840 -10.6590 0.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4890 -9.1520 -0.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 25 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 13 2 0 0 0 0 12 14 2 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 42 1 0 0 0 0 M END