CHEMDIV-ZINC04955617 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 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 -1.0150 -0.3960 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8010 -0.5330 1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9430 -1.3100 0.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9830 -2.0080 1.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9200 -2.6490 0.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8150 -2.5900 -0.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7800 -1.8950 -1.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8290 -1.2460 -0.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 -0.4960 -1.1810 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3460 -0.2620 -2.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 0.4020 -2.6910 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 -0.8250 -3.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5600 -0.4320 -4.8680 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8860 0.8670 -5.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4900 -1.4550 -5.6380 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.4630 -1.0970 -7.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1920 -2.7630 -5.1700 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1100 -1.0760 -5.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9550 -0.1790 -5.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0950 -0.2010 -4.8410 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8900 0.3370 -4.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9060 -1.1110 -3.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7180 -1.6340 -3.9990 N 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 1.1830 0.2950 1.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1800 -1.1890 1.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0640 -2.0530 2.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -3.1930 0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5470 -3.0900 -1.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7040 -1.8530 -2.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1790 -0.4370 -3.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1830 -1.9120 -3.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7540 0.7600 -6.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 1.2230 -6.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1100 1.5830 -4.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7700 0.4390 -6.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6210 -1.3670 -3.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 11 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 20 21 2 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 2 0 0 0 0 24 41 1 0 0 0 0 M END