PUBCHEM-ZINC04782564 MOE2007 3D CORINA 3.40 0006 02.08.2006 69 73 0 0 0 0 0 0 0 0999 V2000 0.9800 -1.1750 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.0000 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3730 -0.5090 0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0870 -0.6520 -1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6610 -0.3600 -2.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4960 -0.5590 -3.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7780 -1.0530 -3.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2180 -1.3470 -2.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3810 -1.1480 -1.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6040 -1.4100 0.7330 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.9800 -0.8600 1.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4390 -0.7980 2.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0160 -1.2420 3.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1230 -1.7580 3.6630 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3130 -1.0800 4.7520 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 -0.4930 4.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7680 -0.2460 5.6270 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9710 0.3520 5.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4320 1.3950 6.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6430 1.9940 5.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4040 1.5610 4.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9500 0.5230 4.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7420 -0.0850 4.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6330 2.1720 4.5310 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4380 1.7170 3.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0520 2.5110 2.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1140 3.2670 5.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9480 2.6950 6.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1410 -0.1440 2.9260 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.8370 -1.5140 6.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 -2.9630 6.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9580 -3.4100 7.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2060 -4.0000 7.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7000 -4.4100 8.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9470 -4.2300 10.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6990 -3.6410 10.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2030 -3.2350 8.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0020 -0.7950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8220 -1.7760 0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8140 -1.7900 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1660 0.6160 0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 0.6020 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6660 0.0260 -2.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1490 -0.3280 -4.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4270 -1.2060 -4.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2160 -1.7320 -1.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8400 1.7330 7.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9990 2.8010 6.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5440 0.1890 3.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3920 -0.8950 3.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4950 1.8720 3.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2550 0.6560 3.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6500 2.1720 1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9950 2.3550 1.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2350 3.5720 2.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7300 3.9420 4.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2630 3.8130 5.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3060 3.5090 7.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3330 2.0190 7.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8000 2.1480 6.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4380 -0.8740 6.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9250 -1.4460 6.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8180 -3.6030 5.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3310 -3.0310 6.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7940 -4.1400 6.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6760 -4.8700 9.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3340 -4.5500 11.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1110 -3.5010 10.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2260 -2.7780 8.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 2 41 1 0 0 0 0 2 42 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 43 1 0 0 0 0 6 7 1 0 0 0 0 6 44 1 0 0 0 0 7 8 2 0 0 0 0 7 45 1 0 0 0 0 8 9 1 0 0 0 0 8 46 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 16 17 2 0 0 0 0 16 29 1 0 0 0 0 17 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 47 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 27 28 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 28 60 1 0 0 0 0 30 31 1 0 0 0 0 30 61 1 0 0 0 0 30 62 1 0 0 0 0 31 32 1 0 0 0 0 31 63 1 0 0 0 0 31 64 1 0 0 0 0 32 33 1 0 0 0 0 32 37 2 0 0 0 0 33 34 2 0 0 0 0 33 65 1 0 0 0 0 34 35 1 0 0 0 0 34 66 1 0 0 0 0 35 36 2 0 0 0 0 35 67 1 0 0 0 0 36 37 1 0 0 0 0 36 68 1 0 0 0 0 37 69 1 0 0 0 0 M END