PUBCHEM-ZINC04574498 MOE2007 3D CORINA 3.40 0006 02.08.2006 71 71 0 0 1 0 0 0 0 0999 V2000 0.6980 1.4040 3.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7740 0.0440 3.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5880 -0.2950 2.4380 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9180 0.5270 1.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6060 -0.5140 3.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4700 -1.5700 1.6010 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4400 -1.8080 1.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5380 -1.3580 0.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6610 -1.8010 0.6150 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1920 -0.6740 -0.6080 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 -2.6770 2.4560 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3300 -3.9480 2.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9560 -4.1740 1.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -5.0860 2.9950 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0930 -4.7880 4.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5440 -5.5450 2.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5540 -7.0090 3.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 -7.4750 2.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7350 -6.2690 2.7780 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0630 -6.2470 2.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6380 -5.1880 2.4140 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8320 -7.5400 2.4520 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2370 -8.2780 1.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1350 -8.0570 3.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7540 -9.4530 3.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7270 -10.4290 3.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1720 -9.9190 5.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0890 -7.3090 1.7350 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6940 -8.3260 1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1980 -9.4350 1.1050 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8490 -8.1140 0.4330 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4450 -9.2560 -0.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7520 -10.3480 0.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7410 -8.8240 -0.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4690 -9.7990 -1.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0520 1.3640 4.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6680 1.6450 4.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4220 2.1700 3.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5240 0.0840 2.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 -0.7210 3.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2760 -1.3360 4.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6900 0.3950 4.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5770 -0.7550 3.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7250 -0.3830 -0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8600 -0.4740 -1.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 -2.4960 3.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6800 -5.5080 1.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3010 -4.9480 3.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2590 -7.6130 2.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7870 -7.0440 4.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -8.0250 1.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2320 -8.1070 3.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2110 -8.1060 4.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8340 -7.3810 4.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6290 -9.4210 3.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1680 -11.4240 3.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4300 -10.0980 2.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8520 -10.4620 3.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9030 -9.2230 5.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6130 -10.9130 5.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2960 -9.9510 5.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4850 -6.4240 1.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4470 -9.9610 1.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1990 -11.2050 0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8280 -10.6560 1.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5230 -8.0460 -1.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1880 -9.6810 -1.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4360 -8.4370 -0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5450 -10.1070 -0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9160 -10.6560 -1.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2500 -9.0210 -2.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 39 1 0 0 0 0 2 40 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 5 41 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 11 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 44 1 0 0 0 0 10 45 1 0 0 0 0 11 12 1 0 0 0 0 11 46 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 19 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 17 18 1 0 0 0 0 17 49 1 0 0 0 0 17 50 1 0 0 0 0 18 19 1 0 0 0 0 18 51 1 0 0 0 0 18 52 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 28 1 0 0 0 0 24 25 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 55 1 0 0 0 0 26 56 1 0 0 0 0 26 57 1 0 0 0 0 26 58 1 0 0 0 0 27 59 1 0 0 0 0 27 60 1 0 0 0 0 27 61 1 0 0 0 0 28 29 1 0 0 0 0 28 62 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32 35 1 0 0 0 0 33 63 1 0 0 0 0 33 64 1 0 0 0 0 33 65 1 0 0 0 0 34 66 1 0 0 0 0 34 67 1 0 0 0 0 34 68 1 0 0 0 0 35 69 1 0 0 0 0 35 70 1 0 0 0 0 35 71 1 0 0 0 0 M END