CHEMDIV-ZINC01739142 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3950 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 1.2320 -0.6630 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3590 0.0180 -0.0200 N 0 3 0 0 0 0 0 0 0 0 0 0 2.3770 1.3370 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 2.0690 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 3.4280 0.0080 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.2610 -0.7720 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3270 -0.1890 0.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2300 -2.1200 0.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4820 -2.8810 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1680 -4.3790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4750 -5.1740 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1610 -6.6710 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4130 -7.4320 0.0060 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3820 -8.7800 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3160 -9.3630 -0.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6450 -9.5480 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8790 -8.8880 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0360 -9.6570 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9290 -11.0410 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7490 -11.6310 0.0130 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.6260 -10.9440 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2570 -9.0610 0.0350 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9510 1.9360 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2610 -1.7420 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3240 1.8560 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2010 -0.4640 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3790 -2.5860 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0500 -2.6360 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0680 -2.6260 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6000 -4.6240 -0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5820 -4.6340 0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0440 -4.9280 0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0610 -4.9190 -0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5930 -6.9170 -0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5750 -6.9260 0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2640 -6.9670 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9300 -7.8090 0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8250 -11.6430 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6810 -11.4650 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7080 -12.6000 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 41 1 0 0 0 0 M CHG 1 4 1 M CHG 1 7 -1 M CHG 1 22 1 M CHG 1 24 -1 M END