PUBCHEM-ZINC05972868 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 54 0 0 1 0 0 0 0 0999 V2000 -1.9660 1.1650 -1.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1630 -0.3190 -1.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5030 -0.7360 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5290 -2.2550 0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9610 -2.8090 0.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0310 -4.3320 0.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4680 -4.8300 0.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7240 -2.3670 1.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3310 -3.0190 2.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8810 -4.3860 2.7180 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4190 -5.1190 3.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2040 -4.6670 4.5690 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9180 -6.5580 3.6700 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1150 -6.5000 3.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7580 -7.3260 2.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1800 -8.6950 2.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8740 -7.2300 5.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3640 -7.5770 5.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4270 -8.2060 6.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7440 -8.4950 7.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9790 -8.1530 6.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0440 -7.5250 5.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4520 1.4430 -2.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4010 1.7720 -0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9030 1.4120 -1.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2380 -0.5240 -1.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7380 -0.8970 -2.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4650 -0.3850 -0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9940 -0.2130 0.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0050 -2.7850 -0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4670 -2.3230 1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5330 -2.5540 -0.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4510 -4.8240 -0.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6010 -4.6340 1.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4980 -5.9160 0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0710 -4.3730 1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9300 -4.5940 -0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9430 -1.2970 1.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0710 -2.8680 0.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4240 -2.9860 2.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 -2.4980 3.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8130 -6.7420 1.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7930 -7.4450 2.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7740 -9.1680 1.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 -9.3610 3.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1500 -8.6070 1.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2930 -7.3680 5.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3900 -8.4740 7.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 -8.9850 8.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8930 -8.3740 7.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0210 -7.2590 5.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7710 -2.5470 1.4800 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.1690 -2.0010 2.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9080 -3.5340 1.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 52 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 8 52 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 10 11 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 15 1 0 0 0 0 13 17 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 19 48 1 0 0 0 0 20 21 2 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 22 51 1 0 0 0 0 52 53 1 0 0 0 0 52 54 1 0 0 0 0 M CHG 1 52 1 M END