CHEMDIV-ZINC04315770 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 -0.6580 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2220 -0.0300 -0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 -2.0780 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -2.7870 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2330 -4.1620 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5060 -4.5470 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5570 -3.2060 -0.0380 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.1830 -2.0700 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 -0.7080 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4440 -0.3290 0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2090 -1.3630 0.0410 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4910 -2.4530 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0100 -3.8680 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1710 -4.3540 1.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6970 -5.7910 1.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8560 -6.2700 2.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5760 -5.5340 3.7940 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3100 -7.5150 3.1150 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4640 -7.9810 4.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9830 -9.3960 4.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0960 -10.4560 4.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5680 -11.7560 4.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9290 -11.9970 4.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8200 -10.9350 4.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3440 -9.6320 4.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1590 -11.1700 4.5160 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.5780 -12.5360 4.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5830 -4.8700 -0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8310 -5.5770 -0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9750 -3.9000 -0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3040 -4.5130 -0.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2050 -4.3220 1.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8760 -3.7100 1.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6630 -5.8230 0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9920 -6.4360 0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5340 -8.1030 2.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4980 -7.9480 5.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1700 -7.3360 5.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0320 -10.2700 4.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8740 -12.5820 4.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2970 -13.0120 4.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0360 -8.8030 4.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6670 -12.5820 4.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2020 -13.0290 3.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1840 -13.0390 5.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 11 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 M END