PUBCHEM-ZINC06266596 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 61 0 0 1 0 0 0 0 0999 V2000 0.0280 1.7360 0.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2910 0.2220 -0.0050 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3230 -0.1880 1.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4900 -1.6940 1.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1500 -2.3470 1.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8420 -2.0650 0.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4610 -3.1010 -0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0700 -0.5750 0.1450 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5840 -0.1870 1.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0210 -0.2960 -1.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3080 -0.5600 -2.3830 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9650 -1.6050 -2.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 0.3310 -2.5150 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3500 1.3960 -2.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9140 0.0120 -1.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3510 0.0770 -3.8410 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7630 -0.1610 -4.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7710 -0.1920 -5.8280 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9860 -0.3490 -3.7300 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4850 -1.2750 -4.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8910 0.8680 -3.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1520 -0.1540 -4.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9560 1.8750 -2.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1400 1.6230 -1.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9510 1.1830 -0.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0480 0.9270 0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3420 1.1100 -0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5430 1.5520 -1.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4480 1.8070 -2.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9530 2.3140 0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7040 2.1530 -0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3550 1.9240 1.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3000 0.2600 0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0120 0.2200 2.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9370 -2.1320 0.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1840 -1.8930 2.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3050 -3.4240 1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2520 -1.9640 2.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 -4.1260 0.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2060 -2.9910 -0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9310 -0.9010 -0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3580 0.7460 -1.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8040 0.6410 -1.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2690 -1.0190 -1.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4800 1.7320 -3.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0190 1.1600 -4.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6210 -1.0530 -4.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3590 0.4960 -5.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0750 -0.4440 -3.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2220 2.4650 -3.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2090 2.4430 -2.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9520 1.0430 -0.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8940 0.5880 1.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1950 0.9110 0.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5540 1.6990 -1.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6290 2.1510 -3.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2820 0.6000 -3.3390 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.1980 0.0000 -2.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 15 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 7 39 1 0 0 0 0 7 40 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 41 1 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 19 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 21 57 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 22 57 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 23 57 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 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 27 28 2 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 29 56 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 57 1 M END