PUBCHEM-ZINC05838493 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -0.5110 0.0120 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.2890 -0.2660 0.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2600 0.4650 2.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3740 0.5270 2.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5400 -0.1300 2.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5910 -0.8580 1.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4690 -0.9320 0.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1910 -1.5540 -0.5910 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8030 -2.0970 -1.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9020 -1.2600 -0.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1900 -1.7360 -2.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2790 -0.7080 -3.1900 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7090 -0.9150 -4.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 -1.9560 -4.6170 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7990 0.1210 -5.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2090 -0.0930 -6.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2950 0.8790 -7.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9670 2.0710 -7.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5560 2.2860 -6.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4780 1.3150 -5.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2120 3.4520 -5.9200 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7920 3.6060 -4.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0490 3.0250 -8.3750 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1710 2.9600 -9.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2800 0.6720 -8.8830 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9540 -0.5730 -9.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3580 0.9800 2.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3480 1.0930 3.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4120 -0.0720 3.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5000 -1.3680 1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1420 -1.9270 -1.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6560 -2.6550 -2.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7470 0.1230 -3.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3130 -1.0170 -6.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9390 1.4810 -4.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5240 2.8160 -4.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0110 3.5430 -3.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2830 4.5770 -4.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1620 2.0080 -9.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0920 3.0460 -8.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1150 3.7780 -9.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3650 -0.6090 -10.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7620 -0.6660 -8.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2490 -1.3930 -8.9430 H 0 0 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 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 13 2 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 2 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 28 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 M CHG 1 4 1 M END