CHEMDIV-ZINC04668425 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 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 3 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -2.0410 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6730 -2.5700 1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0640 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1190 -0.0610 1.2180 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4620 0.0490 1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1050 -0.2430 0.2400 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1540 0.5260 2.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5450 0.6420 2.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1850 1.0870 3.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4500 1.4190 4.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0710 1.3060 4.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4200 0.8570 3.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1560 1.9050 5.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4880 0.7620 6.8180 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.9250 1.0060 8.3960 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.2140 -0.2770 8.9360 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9540 1.8820 8.9510 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4470 1.8940 8.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6470 1.2080 8.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8420 1.9030 8.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8360 3.2880 8.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6330 3.9740 8.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4400 3.2760 8.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0020 3.9680 8.3570 F 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 1.7650 -0.1340 1.2340 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 1.2730 -2.3920 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2900 -2.4020 2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 -3.6600 1.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1830 -2.2190 2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -2.4150 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4350 -2.4410 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6060 0.1720 2.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1190 0.3830 1.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2610 1.1760 3.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5040 1.5670 5.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3440 0.7660 3.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5040 2.5880 6.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0710 2.4250 5.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4520 -0.1390 6.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6520 0.1280 8.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7790 1.3670 8.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6280 5.0540 8.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5020 3.8110 8.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 11 12 2 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 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 29 53 1 0 0 0 0 M END