CHEMDIV-ZINC00217945 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3790 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 1.2430 -0.6520 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4140 0.1270 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3370 1.4500 -0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 2.0780 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9910 -0.6590 -0.0390 S 0 0 0 0 0 0 0 0 0 0 0 0 5.0680 0.7950 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5080 0.3540 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7800 -0.8280 -0.0660 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4950 1.2720 -0.0620 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8950 0.8430 -0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8060 2.0730 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2460 1.6310 -0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8450 1.5540 -1.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2710 1.1220 -1.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0150 1.2030 -0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1720 0.4940 0.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8990 1.3140 1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3210 -2.1230 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4040 -2.6740 -0.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9570 1.9100 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9180 -0.5700 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 3.1580 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8620 1.3980 -0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8790 1.3890 0.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2770 2.2180 -0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1000 0.2410 0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0840 0.2500 -0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6000 2.6750 -0.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6170 2.6660 0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2830 1.8180 -2.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2950 0.0950 -1.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7600 1.7730 -2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9830 0.7100 -0.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1560 2.2470 0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9110 -0.5070 0.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7380 0.4290 1.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1510 2.2420 1.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2090 0.7390 1.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -2.8580 -0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2920 -3.8190 -0.0200 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 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 41 42 1 0 0 0 0 M END