CHEMDIV-ZINC04955374 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7020 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.8180 -2.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6920 -3.1410 -3.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.4040 -3.9970 -4.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3790 -4.4860 -5.3580 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3360 -4.4250 -5.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7400 -5.0850 -6.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1840 -5.7390 -7.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 -6.2400 -8.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -6.0800 -8.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5590 -5.4360 -7.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3600 -4.9270 -6.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2220 -4.2560 -5.0430 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7200 -6.9400 -9.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9100 -7.0800 -9.8940 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8240 -7.4240 -10.5750 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3530 -8.1010 -11.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -3.8480 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5130 -2.2170 -3.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 -3.7630 -2.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2420 -5.8620 -7.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 -6.4700 -8.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6190 -5.3170 -6.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 -8.4410 -12.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9480 -8.9590 -11.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9800 -7.4120 -12.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 19 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 17 2 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 18 19 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 M END