PUBCHEM-ZINC06320712 MOE2007 3D CORINA 3.40 0006 02.08.2006 67 70 0 0 1 0 0 0 0 0999 V2000 0.2120 1.1610 -0.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3210 -0.3080 -0.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -0.7570 0.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1640 -2.1130 1.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 -2.5980 2.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 -3.9050 2.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3510 -4.8850 1.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4010 -6.0910 1.8440 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -4.3870 0.3550 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8620 -5.0560 -0.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5140 -3.0270 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7690 -2.6020 -1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -1.2410 -1.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9560 -0.8060 -3.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 -4.4440 4.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6000 -4.7520 4.3980 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2200 -5.8540 3.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7540 -7.2400 4.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3230 -9.6870 4.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0110 -10.7650 3.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4240 -10.8560 1.8850 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5500 -9.6270 1.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8390 -8.4860 1.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3100 -4.0370 5.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8840 -2.5090 5.9560 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.4030 -4.7210 5.8930 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4470 -4.2330 6.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7320 -5.0470 6.5850 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.1120 -4.8730 5.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7970 -4.7560 7.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5300 -5.8070 8.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0990 -6.9880 7.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4060 -6.4530 6.7010 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1790 1.5520 -1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 1.3340 -1.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0880 1.7360 -0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1990 -0.0370 1.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3080 -1.8610 3.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0390 -3.3270 -2.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7940 -0.1020 -3.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.6550 -3.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 -0.3340 -3.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3980 -5.3610 4.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 -3.7410 4.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3110 -5.7890 3.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0090 -5.6940 2.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6720 -7.3790 4.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0370 -7.3870 5.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8100 -9.5730 4.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2570 -9.9000 4.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8960 -11.7390 3.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0850 -10.5680 3.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0980 -9.7720 0.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6130 -9.4020 1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7710 -8.6950 2.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9930 -7.5410 1.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5230 -5.6990 5.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0560 -4.3680 7.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6380 -3.1700 6.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7710 -3.7340 8.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7910 -4.9250 7.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7060 -5.4860 9.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3950 -6.0260 9.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4420 -7.6740 8.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9650 -7.5490 7.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4200 -8.3470 3.3010 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.4210 -8.1240 3.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 13 2 0 0 0 0 3 4 2 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 15 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 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 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 18 66 1 0 0 0 0 19 20 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 19 66 1 0 0 0 0 20 21 1 0 0 0 0 20 51 1 0 0 0 0 20 52 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 53 1 0 0 0 0 22 54 1 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 23 66 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 57 1 0 0 0 0 27 28 1 0 0 0 0 27 58 1 0 0 0 0 27 59 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 33 1 0 0 0 0 30 31 1 0 0 0 0 30 60 1 0 0 0 0 30 61 1 0 0 0 0 31 32 1 0 0 0 0 31 62 1 0 0 0 0 31 63 1 0 0 0 0 32 33 1 0 0 0 0 32 64 1 0 0 0 0 32 65 1 0 0 0 0 66 67 1 0 0 0 0 M CHG 1 66 1 M END