PUBCHEM-ZINC06077806 MOE2007 3D CORINA 3.40 0006 02.08.2006 71 75 0 0 1 0 0 0 0 0999 V2000 0.4280 0.6980 1.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 -0.6850 1.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2860 -0.8630 0.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3990 -0.4980 1.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3490 0.0790 -0.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4350 -2.2580 0.1440 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5090 -2.9820 -0.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0610 -4.1690 -0.7190 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7340 -4.2000 -0.4270 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3450 -3.0550 0.0990 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9490 -2.5480 -0.4990 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9000 -1.4910 -0.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8100 -2.7190 0.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6410 -3.6620 1.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4980 -3.7210 2.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3340 -4.7020 3.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1710 -4.7240 4.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1780 -3.7660 5.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3420 -2.7840 4.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5040 -2.7650 3.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6590 -1.7740 2.0490 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3810 -1.0720 2.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8710 -1.6860 0.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0180 -0.7890 0.1050 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0580 -3.6770 6.1650 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.9240 -4.6310 7.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6000 -2.3760 -2.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9740 -3.0120 -3.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3710 -4.4110 -3.6350 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4240 -5.2700 -2.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0770 -4.6470 -1.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5720 -4.8960 -4.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3230 -5.8470 -3.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5420 -6.3330 -3.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0310 -5.8730 -5.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3200 -4.9350 -5.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1020 -4.4550 -5.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2230 -6.3690 -5.5430 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4450 0.6980 2.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3900 1.4700 1.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2430 0.9810 2.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9100 -0.9390 0.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 -1.4040 2.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2420 0.4850 2.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3730 -0.4270 1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4680 -1.2340 2.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5090 -0.1010 -1.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2660 -0.0610 -1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3230 1.1320 -0.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8650 -4.4190 1.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5570 -5.4570 3.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0120 -5.5020 5.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1240 -2.0400 4.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6900 -4.4130 7.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1000 -5.6470 6.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9470 -4.5500 7.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1760 -1.3780 -2.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4780 -2.3260 -1.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7740 -2.4050 -4.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1180 -2.9730 -4.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7930 -6.2900 -2.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5120 -5.3630 -3.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9660 -4.5800 -0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3030 -5.2320 -1.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9870 -6.2080 -2.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1060 -7.0620 -3.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6860 -4.5720 -6.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5520 -3.7430 -5.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4440 -5.9450 -6.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5520 -3.2250 -1.7650 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.7560 -3.3160 -2.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 2 42 1 0 0 0 0 2 43 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 4 44 1 0 0 0 0 4 45 1 0 0 0 0 4 46 1 0 0 0 0 5 47 1 0 0 0 0 5 48 1 0 0 0 0 5 49 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 70 1 0 0 0 0 13 14 2 0 0 0 0 13 23 1 0 0 0 0 14 15 1 0 0 0 0 14 50 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 51 1 0 0 0 0 17 18 1 0 0 0 0 17 52 1 0 0 0 0 18 19 2 0 0 0 0 18 25 1 0 0 0 0 19 20 1 0 0 0 0 19 53 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 25 26 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 26 56 1 0 0 0 0 27 28 1 0 0 0 0 27 57 1 0 0 0 0 27 58 1 0 0 0 0 27 70 1 0 0 0 0 28 29 1 0 0 0 0 28 59 1 0 0 0 0 28 60 1 0 0 0 0 29 30 1 0 0 0 0 29 32 1 0 0 0 0 30 31 1 0 0 0 0 30 61 1 0 0 0 0 30 62 1 0 0 0 0 31 63 1 0 0 0 0 31 64 1 0 0 0 0 31 70 1 0 0 0 0 32 33 1 0 0 0 0 32 37 2 0 0 0 0 33 34 2 0 0 0 0 33 65 1 0 0 0 0 34 35 1 0 0 0 0 34 66 1 0 0 0 0 35 36 2 0 0 0 0 35 38 1 0 0 0 0 36 37 1 0 0 0 0 36 67 1 0 0 0 0 37 68 1 0 0 0 0 38 69 1 0 0 0 0 70 71 1 0 0 0 0 M CHG 1 70 1 M END