PUBCHEM-ZINC06308594 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 1 0 0 0 0 0999 V2000 1.6000 0.8050 -0.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4780 -0.7130 -0.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4590 -1.3920 0.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2180 -2.8760 0.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0230 -3.4390 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2350 -4.8650 0.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4470 -4.9700 0.6760 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9840 -3.8930 0.8330 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2730 -5.9800 -0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4740 -6.4250 -1.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4880 -7.5400 -1.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 -7.9360 -1.0530 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4930 -8.1590 -3.2700 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8850 -8.6530 -3.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0430 -9.5870 -4.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1160 -10.7910 -4.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3320 -10.3090 -4.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4330 -9.3580 -3.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 -9.5480 -2.4100 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8980 -8.2910 -2.9150 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2460 -8.6900 -3.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3810 -10.2100 -3.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2760 -8.0240 -2.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4900 -8.2510 -4.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 -2.6280 -0.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0570 -3.1080 -1.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -1.1340 -0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8250 -1.1100 -1.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6180 1.1120 -0.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9040 1.2920 -1.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3650 1.0920 0.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4810 -1.1860 0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3050 -1.0070 1.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4560 -6.8220 0.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7490 -5.6260 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2910 -5.5830 -2.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4970 -6.7780 -1.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0760 -9.9280 -4.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7780 -9.0630 -5.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4000 -11.3300 -3.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2020 -11.4540 -5.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9880 -11.1640 -4.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 -9.7940 -5.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1710 -7.4240 -4.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5600 -10.4910 -2.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2180 -10.5420 -3.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4630 -10.6810 -3.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1790 -6.9410 -2.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2790 -8.3210 -2.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1020 -8.3370 -1.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6750 -8.6070 -5.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4320 -8.6700 -5.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5370 -7.1630 -4.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1960 -0.9260 0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6500 -0.5830 -0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8460 -0.8020 -2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7400 -2.1920 -2.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1380 -0.6200 -2.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 20 2 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 M END