PUBCHEM-ZINC05758810 MOE2007 3D CORINA 3.40 0006 02.08.2006 76 79 0 0 1 0 0 0 0 0999 V2000 0.7560 0.9630 -1.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5420 -0.4870 -0.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0870 -0.6760 0.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 -0.8090 -0.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1590 -2.2920 -0.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6550 -2.6140 -0.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8600 -4.0970 -0.2370 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2770 -4.7020 -0.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4030 -4.3790 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3430 -4.4480 -0.3780 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.9260 -3.9330 0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8530 -4.0660 -1.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4150 -5.3700 -2.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7610 -6.2210 -1.1930 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.6770 -5.8580 -0.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5420 -5.9560 -0.2680 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.8970 -6.4920 1.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0510 -8.0150 0.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1060 -8.3870 -0.0680 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.0760 -8.0390 0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8500 -7.7180 -1.4320 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.9170 -8.0880 -1.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0330 -8.0200 -2.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2200 -9.5060 -2.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8530 -10.3280 -1.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1660 -9.8980 -0.2190 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.9150 -10.5140 0.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9810 -12.0330 0.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7780 -12.3720 -0.4700 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.7670 -11.9170 -0.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1050 -11.8120 -1.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9120 -13.7900 -0.5830 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.0400 -14.2040 -1.3330 N 0 3 0 0 0 0 0 0 0 0 0 0 -9.7900 -13.3740 -1.8130 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.2590 -15.3910 -1.4970 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.7350 -10.4380 -0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3100 -6.6830 -0.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8220 1.1930 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 1.0980 -2.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 1.6310 -0.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0660 -1.1550 -1.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5630 -0.0080 1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9340 -1.7090 0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1530 -0.4460 0.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4650 -0.2030 -0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3600 -0.5900 -1.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6470 -2.8980 -1.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7520 -2.5110 0.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1660 -2.0080 0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0620 -2.3950 -1.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0240 -3.8170 1.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4970 -5.4450 1.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3620 -4.0770 1.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6420 -3.3180 -1.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0310 -3.6830 -2.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3070 -5.1610 -3.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6560 -5.8620 -3.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1000 -6.2600 1.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8350 -6.0520 1.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0940 -8.4440 0.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3410 -8.4300 1.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9370 -7.5640 -1.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8320 -7.6140 -3.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6810 -9.9120 -3.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3890 -10.2780 1.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9260 -10.1090 1.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9710 -12.4320 0.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4690 -12.4770 1.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7210 -11.9610 -2.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1550 -12.3320 -1.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2650 -10.1750 0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7540 -11.5230 -0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1660 -10.0010 -1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4560 -6.4840 -0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5040 -7.7550 -0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0940 -6.3270 -1.8200 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 4 1 0 0 0 0 2 41 1 0 0 0 0 3 42 1 0 0 0 0 3 43 1 0 0 0 0 3 44 1 0 0 0 0 4 5 1 0 0 0 0 4 45 1 0 0 0 0 4 46 1 0 0 0 0 5 6 1 0 0 0 0 5 47 1 0 0 0 0 5 48 1 0 0 0 0 6 7 1 0 0 0 0 6 49 1 0 0 0 0 6 50 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 9 51 1 0 0 0 0 9 52 1 0 0 0 0 9 53 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 54 1 0 0 0 0 12 55 1 0 0 0 0 13 14 1 0 0 0 0 13 56 1 0 0 0 0 13 57 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 21 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 58 1 0 0 0 0 17 59 1 0 0 0 0 18 19 1 0 0 0 0 18 60 1 0 0 0 0 18 61 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 26 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 62 1 0 0 0 0 23 63 1 0 0 0 0 24 25 2 0 0 0 0 24 64 1 0 0 0 0 25 26 1 0 0 0 0 25 31 1 0 0 0 0 26 27 1 0 0 0 0 26 36 1 0 0 0 0 27 28 1 0 0 0 0 27 65 1 0 0 0 0 27 66 1 0 0 0 0 28 29 1 0 0 0 0 28 67 1 0 0 0 0 28 68 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 31 69 1 0 0 0 0 31 70 1 0 0 0 0 32 33 1 0 0 0 0 33 34 2 0 0 0 0 33 35 1 0 0 0 0 36 71 1 0 0 0 0 36 72 1 0 0 0 0 36 73 1 0 0 0 0 37 74 1 0 0 0 0 37 75 1 0 0 0 0 37 76 1 0 0 0 0 M CHG 1 33 1 M CHG 1 35 -1 M END