PUBCHEM-ZINC03872445 MOE2007 3D CORINA 3.40 0006 02.08.2006 72 72 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 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 -0.1240 2.4970 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2110 0.9530 2.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 -0.5140 3.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2790 -1.2940 4.5170 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3300 -0.8210 2.5030 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3730 -0.3030 3.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2450 0.7430 3.7880 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5590 -0.9440 3.1860 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6930 -0.3810 3.9240 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.6590 0.7070 3.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6160 -0.8170 5.3880 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.4580 -0.4020 5.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2950 -0.3380 6.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2400 -0.8150 7.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2030 -2.8850 6.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6370 -2.2860 5.4740 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4640 -4.2210 6.8270 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9810 -0.8760 3.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9540 -1.6260 2.3650 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1630 -0.4870 3.8360 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.4150 -0.9680 3.2480 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.2960 -1.0660 2.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7690 -2.3310 3.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7090 -3.3570 3.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0580 -4.7000 4.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0550 -4.8230 4.7090 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2610 -5.7630 3.8030 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.5200 0.0130 3.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2840 1.0160 4.1850 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.7690 -0.2240 3.1000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.8430 0.7300 3.3880 C 0 0 3 0 0 0 0 0 0 0 0 0 -11.6870 1.1640 4.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8360 1.8400 2.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1700 0.0170 3.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.9090 0.0740 4.3100 O 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 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -1.5870 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 -1.5960 1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7350 -0.0630 1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4320 -1.6550 2.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6610 -1.7780 2.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4560 -0.7580 5.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2500 0.7510 5.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2390 -0.6450 7.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9620 -0.2510 8.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9510 -2.8200 4.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9480 -4.7240 6.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1660 -4.6610 7.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1840 0.1130 4.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8010 -2.2530 4.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7430 -2.6490 3.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6770 -3.4350 2.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7350 -3.0400 3.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4630 -5.6640 3.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4850 -6.6270 4.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9580 -1.0260 2.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9910 1.4050 1.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6340 2.5500 2.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8760 2.3560 2.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4610 -0.5460 2.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9670 0.0060 3.9280 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5560 -2.2360 7.5460 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4340 -0.2750 4.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 43 1 0 0 0 0 3 44 1 0 0 0 0 3 45 1 0 0 0 0 3 46 1 0 0 0 0 4 5 1 0 0 0 0 4 47 1 0 0 0 0 4 48 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 70 1 0 0 0 0 9 10 1 0 0 0 0 9 49 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 50 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 22 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 20 1 0 0 0 0 17 18 1 0 0 0 0 17 51 1 0 0 0 0 17 52 1 0 0 0 0 18 53 1 0 0 0 0 18 54 1 0 0 0 0 18 71 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 71 2 0 0 0 0 20 55 1 0 0 0 0 21 56 1 0 0 0 0 21 57 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 58 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 32 1 0 0 0 0 27 28 1 0 0 0 0 27 59 1 0 0 0 0 27 60 1 0 0 0 0 28 29 1 0 0 0 0 28 61 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 63 1 0 0 0 0 31 64 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 65 1 0 0 0 0 35 36 1 0 0 0 0 35 37 1 0 0 0 0 35 38 1 0 0 0 0 37 66 1 0 0 0 0 37 67 1 0 0 0 0 37 68 1 0 0 0 0 38 39 2 0 0 0 0 38 69 1 0 0 0 0 70 72 1 0 0 0 0 M END