PUBCHEM-ZINC04258582 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 0 0 0 0 0999 V2000 -0.0460 1.4880 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0190 0.0620 -0.0830 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2160 -0.5770 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2610 -1.9640 -0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4730 -2.6170 -0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6600 -1.8840 -0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6100 -0.4900 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3940 0.1550 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9610 -2.5800 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0020 -3.7930 -0.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1040 -1.8700 0.0070 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3400 -2.5310 0.0080 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.4400 -1.8480 0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7410 -2.5430 0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9270 -1.8100 0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1400 -2.4640 0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1840 -3.8500 0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0080 -4.5820 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7900 -3.9370 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3820 -4.4900 0.0930 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.1800 -4.3000 -0.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.7760 -3.6620 -1.9300 O 0 0 0 0 0 0 0 0 0 0 0 0 -15.5400 -4.8640 -0.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.0630 -5.4850 0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.3450 -6.0160 0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.1340 -5.9530 -0.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.6710 -5.3400 -2.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.3710 -4.7780 -2.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.9070 -4.1620 -3.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.7150 -4.1030 -4.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.9960 -4.6490 -4.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.4730 -5.2670 -3.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 1.8720 -0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5970 1.8960 -0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5350 1.7840 0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3440 -2.5300 -0.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5070 -3.6940 -0.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5250 0.0810 0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3550 1.2320 0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0710 -0.9030 0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4040 -0.7710 0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8940 -0.7330 0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0580 -1.8980 0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0470 -5.6600 -0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8760 -4.5070 -0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.4660 -5.5540 1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.7270 -6.4940 1.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.1270 -6.3780 -0.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.9160 -3.7340 -3.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.3560 -3.6270 -5.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.6160 -4.5890 -5.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.4690 -5.6860 -3.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 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 7 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 30 31 2 0 0 0 0 30 50 1 0 0 0 0 31 32 1 0 0 0 0 31 51 1 0 0 0 0 32 52 1 0 0 0 0 M END