PUBCHEM-ZINC06076989 MOE2007 3D CORINA 3.40 0006 02.08.2006 82 84 0 0 1 0 0 0 0 0999 V2000 0.1370 -1.3290 0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4640 0.0770 0.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 0.9280 -0.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9170 -0.0060 0.0720 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8080 0.6000 1.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5320 -0.0120 2.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5590 2.1090 1.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5510 -0.7870 -1.2430 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.8150 -0.1870 -1.4940 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5140 -0.8490 -2.2120 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8780 -2.4490 -0.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0770 -2.7660 -0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3360 -4.0680 0.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3890 -5.0580 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1850 -4.7360 -0.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9350 -3.4330 -0.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 -6.3760 0.3940 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6480 -7.4190 0.1530 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6490 -6.9990 0.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8050 -7.9520 -1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6860 -8.2410 -2.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8260 -8.7310 -3.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0950 -8.9310 -3.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2180 -8.6380 -3.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0690 -8.1540 -1.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4620 -8.8320 -3.5760 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5700 -8.5100 -2.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2370 -9.4110 -5.0910 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3060 -10.8300 -5.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7240 -9.0150 -4.0390 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5480 -8.7850 -3.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8430 -8.5400 1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7300 -8.4740 1.9660 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0320 -9.6160 1.1090 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2220 -10.7050 2.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9010 -11.4530 2.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0990 -12.5910 3.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1610 -13.5580 2.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4820 -12.8100 2.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2830 -11.6720 1.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 -1.2820 0.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3880 -1.9740 0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 -1.7320 -0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2380 0.5350 1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 0.4100 -1.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3800 1.8880 -0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1940 1.0910 -0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8440 0.4120 0.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5280 0.2630 2.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2610 0.3630 3.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6090 -1.0970 2.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7830 2.5490 0.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2020 2.5560 1.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5150 2.2960 1.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8130 -1.9960 0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2740 -4.3150 0.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4470 -5.5040 -0.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0010 -3.1830 -1.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4890 -6.6000 0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 -8.0860 -1.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9410 -7.9310 -1.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5000 -8.7100 -3.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5290 -9.1190 -1.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5260 -7.4550 -2.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3920 -11.2820 -4.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1620 -11.2130 -4.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4190 -11.0780 -6.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 -7.7320 -3.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6360 -9.3960 -2.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3400 -9.0520 -4.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3230 -9.6690 0.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5490 -10.2940 3.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 -11.8640 1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1450 -10.7640 2.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 -13.1230 3.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4260 -12.1800 4.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8340 -13.9680 1.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3020 -14.3680 3.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2380 -13.4990 2.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8080 -12.3990 3.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2250 -11.1400 1.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9570 -12.0830 0.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 44 1 0 0 0 0 3 45 1 0 0 0 0 3 46 1 0 0 0 0 3 47 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 48 1 0 0 0 0 6 49 1 0 0 0 0 6 50 1 0 0 0 0 6 51 1 0 0 0 0 7 52 1 0 0 0 0 7 53 1 0 0 0 0 7 54 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 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 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 57 1 0 0 0 0 16 58 1 0 0 0 0 17 18 1 0 0 0 0 17 59 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 32 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 60 1 0 0 0 0 22 23 1 0 0 0 0 22 30 1 0 0 0 0 23 24 2 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 61 1 0 0 0 0 26 27 1 0 0 0 0 27 62 1 0 0 0 0 27 63 1 0 0 0 0 27 64 1 0 0 0 0 28 29 1 0 0 0 0 29 65 1 0 0 0 0 29 66 1 0 0 0 0 29 67 1 0 0 0 0 30 31 1 0 0 0 0 31 68 1 0 0 0 0 31 69 1 0 0 0 0 31 70 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 34 35 1 0 0 0 0 34 71 1 0 0 0 0 35 36 1 0 0 0 0 35 40 1 0 0 0 0 35 72 1 0 0 0 0 36 37 1 0 0 0 0 36 73 1 0 0 0 0 36 74 1 0 0 0 0 37 38 1 0 0 0 0 37 75 1 0 0 0 0 37 76 1 0 0 0 0 38 39 1 0 0 0 0 38 77 1 0 0 0 0 38 78 1 0 0 0 0 39 40 1 0 0 0 0 39 79 1 0 0 0 0 39 80 1 0 0 0 0 40 81 1 0 0 0 0 40 82 1 0 0 0 0 M END