PUBCHEM-ZINC04214171 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 0 0 0 0 0 0999 V2000 -0.1540 1.6190 -0.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2960 0.2050 -0.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -0.4670 0.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 -1.8120 0.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3470 -2.9650 1.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6390 -4.1550 0.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5540 -4.2200 -0.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 -3.1040 -1.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8710 -1.9100 -0.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4360 -0.6830 -1.2830 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1610 -0.3840 -2.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4120 0.1300 -3.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4830 0.5800 -5.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2030 0.8110 -7.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3520 1.9440 -7.2920 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 1.7540 -6.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 1.5700 -5.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 0.1330 2.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3230 0.9140 2.5890 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6180 -0.1860 3.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 -0.2670 4.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2370 -0.5600 5.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5690 -0.7630 5.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9230 -0.6580 3.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9520 -0.3630 2.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4170 -1.0480 6.2260 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7800 -1.2850 5.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 2.0580 -1.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2470 1.6640 -0.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 2.2540 0.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4080 -2.9470 2.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9290 -5.0360 1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7810 -5.1540 -1.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0870 -3.1810 -2.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2160 -1.2960 -3.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6570 0.3420 -2.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7820 1.0670 -2.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2110 -0.6170 -3.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0860 -0.3210 -5.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9720 1.4480 -5.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1420 1.0100 -7.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7440 -0.0710 -7.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 2.6430 -6.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4250 0.8960 -7.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 2.4440 -4.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7220 1.3640 -4.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2340 -0.1080 4.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9570 -0.6300 6.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9460 -0.7940 3.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2590 -0.2710 1.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3150 -1.5110 6.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8810 -2.1520 5.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2400 -0.3950 5.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 0.3800 -4.8760 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7210 -0.4620 -5.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 18 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 12 54 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 13 54 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 17 54 1 0 0 0 0 18 19 2 0 0 0 0 18 20 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 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END