PUBCHEM-ZINC06481287 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -0.5760 0.7750 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 1.0450 2.4850 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1530 -0.0390 2.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2890 1.8400 2.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 3.0930 1.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6510 2.9770 1.3050 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9990 3.3650 0.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4900 3.5390 2.4720 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5300 3.2180 2.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0720 2.9520 3.8460 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8990 3.1090 4.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7530 1.4440 3.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 3.6590 4.3340 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2840 3.6470 5.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4290 3.0890 6.5010 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5250 4.3530 6.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0710 4.1380 7.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2550 4.7750 7.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8940 5.6360 6.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3480 5.8640 5.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1650 5.2240 5.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4930 5.0740 2.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4380 5.5310 3.4370 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5060 6.8810 3.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8240 7.6920 2.9600 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5500 7.2570 4.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8930 8.6100 4.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8870 9.0120 5.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5400 8.0650 6.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1980 6.7170 6.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2040 6.3110 5.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 -0.2930 0.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4600 0.9530 -0.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2650 1.1710 -0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8110 2.0790 3.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9900 1.2580 1.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 4.0150 1.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3570 3.0950 0.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6990 0.8870 3.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1670 1.1240 4.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5830 3.4710 8.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6790 4.6020 8.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8150 6.1330 7.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8430 6.5450 4.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7560 5.4250 4.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5010 5.4830 2.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8100 5.4340 1.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3930 9.3600 4.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1520 10.0630 5.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3150 8.3780 7.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7050 5.9800 6.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9560 5.2540 5.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8690 1.4710 1.3220 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.8550 1.2580 1.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 53 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 12 1 0 0 0 0 2 53 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 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 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 53 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 22 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 29 30 2 0 0 0 0 29 50 1 0 0 0 0 30 31 1 0 0 0 0 30 51 1 0 0 0 0 31 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END