PUBCHEM-ZINC00685376 MOE2007 3D CORINA 3.40 0006 02.08.2006 69 74 0 0 1 0 0 0 0 0999 V2000 -0.9560 0.8030 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7940 -0.6900 0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5780 -1.3060 1.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3530 -2.7900 1.4060 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5930 -2.9850 1.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2030 -3.3630 0.0790 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2430 -4.6480 -0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6480 -5.4210 0.7340 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1690 -4.9870 -1.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4770 -6.2230 -1.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4260 -6.6770 -3.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4060 -7.9870 -3.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3490 -7.9500 -5.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3580 -6.6210 -5.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4100 -5.8620 -4.4240 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3280 -5.9750 -6.7420 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4090 -4.5140 -6.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5560 -4.1050 -7.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3330 -6.2990 -8.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1960 -6.6890 -8.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4740 -4.3640 -10.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3870 -3.6250 -2.4630 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5100 -2.6390 -1.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8350 -1.3920 -1.0720 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4940 -3.4570 2.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2710 -3.9230 3.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3060 -4.5040 4.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5670 -4.6210 3.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8160 -4.1660 2.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7830 -3.5810 1.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5620 -5.1770 4.3500 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.5120 -0.5730 2.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5360 -0.5660 3.2030 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7290 -0.0270 2.9310 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0200 0.7270 4.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3420 1.1600 4.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7100 1.9110 5.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7580 2.2360 6.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4410 1.8100 6.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0720 1.0590 5.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3730 1.1590 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0080 1.0490 -0.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6080 1.3680 0.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 -6.9620 -1.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4170 -8.8720 -3.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3120 -8.8000 -5.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 -4.1300 -7.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 -4.0320 -5.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5470 -3.0240 -7.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5290 -4.4080 -7.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3060 -6.6280 -8.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 -6.7190 -9.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2060 -7.7780 -7.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7700 -6.4330 -8.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4430 -4.6790 -9.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4280 -3.2770 -10.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2700 -4.8410 -11.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2870 -3.8330 3.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1360 -4.8630 5.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8090 -4.2680 1.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9950 -3.2250 0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5090 -0.1840 2.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1050 0.9190 3.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7380 2.2400 5.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0420 2.8200 7.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6950 2.0620 6.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 0.7500 4.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4010 -4.7840 -9.1240 N 0 3 0 0 0 0 0 0 0 0 0 0 0.5040 -4.4730 -9.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 25 1 0 0 0 0 6 7 1 0 0 0 0 6 23 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 22 1 0 0 0 0 10 11 1 0 0 0 0 10 44 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 45 1 0 0 0 0 13 14 2 0 0 0 0 13 46 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 18 68 1 0 0 0 0 19 20 1 0 0 0 0 19 51 1 0 0 0 0 19 52 1 0 0 0 0 19 68 1 0 0 0 0 20 53 1 0 0 0 0 20 54 1 0 0 0 0 21 55 1 0 0 0 0 21 56 1 0 0 0 0 21 57 1 0 0 0 0 21 68 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 58 1 0 0 0 0 27 28 1 0 0 0 0 27 59 1 0 0 0 0 28 29 2 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 29 60 1 0 0 0 0 30 61 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 34 35 1 0 0 0 0 34 62 1 0 0 0 0 35 36 1 0 0 0 0 35 40 2 0 0 0 0 36 37 2 0 0 0 0 36 63 1 0 0 0 0 37 38 1 0 0 0 0 37 64 1 0 0 0 0 38 39 2 0 0 0 0 38 65 1 0 0 0 0 39 40 1 0 0 0 0 39 66 1 0 0 0 0 40 67 1 0 0 0 0 68 69 1 0 0 0 0 M CHG 1 68 1 M END