PUBCHEM-ZINC05581787 MOE2007 3D CORINA 3.40 0006 02.08.2006 74 77 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6880 -0.4760 -1.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9850 -0.1920 -1.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3010 -0.7780 -2.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1090 -1.4970 -3.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 -1.2780 -2.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1330 -1.8510 -2.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4000 -2.6260 -3.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4240 -2.8410 -4.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8160 -2.2810 -4.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6300 -0.7090 -3.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5980 0.4140 -4.4440 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3140 1.3480 -3.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9630 0.5640 -5.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1060 0.4130 -6.2540 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0210 0.8650 -4.2940 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3050 0.9940 -4.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6210 0.0870 -5.4860 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0460 1.0730 -6.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3360 2.2300 -5.9840 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0410 0.7370 -7.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7110 -0.4890 1.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0140 -0.2070 1.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3520 -0.8060 2.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 -1.5310 3.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1630 -1.2930 2.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0960 -1.8560 2.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3440 -2.6360 3.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3490 -2.8650 4.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8970 -2.3280 4.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6940 -0.7440 3.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5290 -1.9600 2.9250 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9730 -2.8720 3.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8220 -1.9630 3.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8780 -1.9160 3.1150 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8000 -2.0180 5.0410 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0830 -2.0180 5.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8200 -1.8950 1.4910 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0790 -3.0250 0.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0720 -4.0960 1.3730 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3790 -2.9580 -0.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6550 0.4160 -0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8980 -1.6890 -1.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3770 -3.0700 -3.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6500 -3.4510 -5.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5700 -2.4550 -5.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4180 -0.5090 -2.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8270 -1.6590 -3.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5570 0.0520 -5.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2500 1.7870 -5.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0720 1.2380 -4.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3890 -0.8380 -5.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9100 -0.3440 -7.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 1.2080 -7.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3990 1.1040 -8.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6730 0.4070 0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8760 -1.6830 1.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3220 -3.0720 3.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5600 -3.4780 5.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6660 -2.5100 4.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2110 0.1680 3.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5530 -0.7450 4.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9220 -2.0650 6.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6640 -2.8830 5.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6250 -1.1050 5.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8270 -1.0380 1.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3410 -1.9210 -1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3730 -3.3640 -0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6390 -3.5420 -1.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 1 45 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 46 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 47 1 0 0 0 0 5 6 1 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 48 1 0 0 0 0 9 10 2 0 0 0 0 9 49 1 0 0 0 0 10 11 1 0 0 0 0 10 50 1 0 0 0 0 11 51 1 0 0 0 0 12 13 1 0 0 0 0 12 52 1 0 0 0 0 12 53 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 54 1 0 0 0 0 18 55 1 0 0 0 0 18 56 1 0 0 0 0 19 20 1 0 0 0 0 19 57 1 0 0 0 0 20 21 2 0 0 0 0 20 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 23 27 1 0 0 0 0 24 25 2 0 0 0 0 24 61 1 0 0 0 0 25 26 1 0 0 0 0 25 32 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 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 63 1 0 0 0 0 30 31 1 0 0 0 0 30 64 1 0 0 0 0 31 65 1 0 0 0 0 32 33 1 0 0 0 0 32 66 1 0 0 0 0 32 67 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 33 39 1 0 0 0 0 35 36 2 0 0 0 0 35 37 1 0 0 0 0 37 38 1 0 0 0 0 38 68 1 0 0 0 0 38 69 1 0 0 0 0 38 70 1 0 0 0 0 39 40 1 0 0 0 0 39 71 1 0 0 0 0 40 41 2 0 0 0 0 40 42 1 0 0 0 0 42 72 1 0 0 0 0 42 73 1 0 0 0 0 42 74 1 0 0 0 0 M END