PUBCHEM-ZINC03201321 MOE2007 3D CORINA 3.40 0006 02.08.2006 72 75 0 0 1 0 0 0 0 0999 V2000 0.3720 1.7290 1.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2940 0.2400 0.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 -0.5880 2.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 -1.9810 1.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2290 -2.5370 0.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3930 -1.7370 -0.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 -0.3340 -0.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5030 -2.6110 -1.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4210 -3.9230 -1.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2050 -3.8530 0.2130 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 -4.9870 1.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5150 -5.1150 1.4830 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9140 -4.1520 1.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6920 -6.1780 2.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4570 -7.7950 3.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7650 -8.3500 2.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7520 -8.1120 1.4560 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9150 -8.6380 0.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9950 -5.2950 3.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4880 -4.7740 4.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3070 -3.9910 4.5000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8360 -3.4370 5.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3070 -5.5430 0.3640 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1910 -4.8880 -0.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5030 -5.1740 -1.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 -5.5490 -2.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4360 -6.7260 -3.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6990 -7.5290 -3.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7390 -7.1570 -2.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6440 -5.9830 -1.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6800 -2.2670 -3.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8480 -2.6320 -3.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0050 -2.3040 -5.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0010 -1.6040 -5.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1600 -1.2290 -5.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3210 -1.5580 -3.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4120 2.0350 1.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 2.2430 0.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2220 2.0590 1.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -0.1510 3.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 -2.5990 2.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5750 0.2990 -1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3160 -5.8980 0.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 -4.8320 1.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2630 -7.1220 2.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2270 -5.9270 3.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4690 -7.6850 4.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6390 -8.4650 3.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8370 -9.4230 3.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6290 -7.8460 3.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8150 -8.1620 1.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8510 -8.4250 -0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9670 -9.7220 0.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0230 -5.6560 3.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9850 -4.5060 2.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2610 -4.1310 5.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2810 -5.5920 5.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5830 -4.2330 6.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9340 -2.8560 5.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5890 -2.7710 6.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4140 -4.9230 -2.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2420 -7.0080 -4.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7800 -8.4370 -4.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6310 -7.7750 -2.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4730 -5.6930 -1.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6370 -3.1750 -3.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9090 -2.5940 -5.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 -1.3500 -6.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9400 -0.6830 -5.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2330 -1.2650 -3.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1730 -6.4480 2.7900 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.5170 -6.5840 1.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 41 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 42 1 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 23 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 14 71 1 0 0 0 0 15 16 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 15 71 1 0 0 0 0 16 17 1 0 0 0 0 16 49 1 0 0 0 0 16 50 1 0 0 0 0 17 18 1 0 0 0 0 18 51 1 0 0 0 0 18 52 1 0 0 0 0 18 53 1 0 0 0 0 19 20 1 0 0 0 0 19 54 1 0 0 0 0 19 55 1 0 0 0 0 19 71 1 0 0 0 0 20 21 1 0 0 0 0 20 56 1 0 0 0 0 20 57 1 0 0 0 0 21 22 1 0 0 0 0 22 58 1 0 0 0 0 22 59 1 0 0 0 0 22 60 1 0 0 0 0 23 24 1 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 61 1 0 0 0 0 27 28 1 0 0 0 0 27 62 1 0 0 0 0 28 29 2 0 0 0 0 28 63 1 0 0 0 0 29 30 1 0 0 0 0 29 64 1 0 0 0 0 30 65 1 0 0 0 0 31 32 1 0 0 0 0 31 36 2 0 0 0 0 32 33 2 0 0 0 0 32 66 1 0 0 0 0 33 34 1 0 0 0 0 33 67 1 0 0 0 0 34 35 2 0 0 0 0 34 68 1 0 0 0 0 35 36 1 0 0 0 0 35 69 1 0 0 0 0 36 70 1 0 0 0 0 71 72 1 0 0 0 0 M CHG 1 71 1 M END