PUBCHEM-ZINC06470885 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 0.5470 -2.3960 5.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 -1.6310 4.5580 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2530 -2.2770 4.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9120 -0.2980 5.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7050 0.3600 4.4410 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3720 -1.3310 3.3340 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1720 -1.3580 2.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7120 -0.9770 0.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0370 -1.7050 1.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0980 -2.9190 0.7980 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2930 -0.8950 1.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0170 0.2660 2.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9780 1.2200 1.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8450 0.5230 0.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 1.1810 0.2380 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6030 -1.7470 1.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6770 -3.2440 1.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0230 -3.6580 1.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5640 -3.5340 -0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8220 -4.0570 -0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0440 -4.4840 1.1520 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9030 -4.2350 1.9100 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8660 -4.1780 -1.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5540 -3.1760 -2.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0350 -3.1780 -2.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0890 -3.0060 -1.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9730 -2.5120 -1.6030 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9880 -1.7490 -1.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3650 -3.5890 -3.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4380 -1.8060 5.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -2.6600 6.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8880 -3.3230 5.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 -1.3020 0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0550 -1.5490 1.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6540 -0.5390 0.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6760 -0.1150 3.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9450 0.8160 2.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5570 1.8360 2.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4620 1.8830 0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2830 -1.4760 2.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9310 -1.1640 0.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -3.5200 0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4110 -3.8130 2.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8570 -5.2070 -1.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8610 -3.9910 -0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7670 -4.1310 -3.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8210 -2.3790 -3.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4480 -1.3830 -1.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8050 -1.0400 -2.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0580 -1.7140 -1.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4400 -3.5910 -3.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1890 -2.9000 -4.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0890 -4.5940 -3.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 -0.0290 6.3520 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 54 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 16 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 8 33 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 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 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 1 0 0 0 0 18 22 2 0 0 0 0 19 20 2 0 0 0 0 19 26 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 28 1 0 0 0 0 24 29 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 M CHG 1 54 -1 M END