PUBCHEM-ZINC04530879 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 1 0 0 0 0 0999 V2000 0.0380 1.7860 -0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 0.3630 -0.0820 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2860 -0.1730 -0.0340 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8970 0.3150 -0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2230 -1.6980 -0.3330 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6680 -1.8750 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4470 -2.3430 0.8440 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5670 -1.9300 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1960 -2.0760 2.1480 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2070 -2.5000 2.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 -0.5590 2.3300 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2370 -0.1560 2.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9310 0.0560 1.2340 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9530 -0.2800 3.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2670 -0.9620 4.7060 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2040 -2.3730 4.4750 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2270 -2.7720 4.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 -2.6910 3.2470 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4400 -3.0310 5.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9210 -4.2110 6.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2140 -4.8280 7.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9840 -4.2790 7.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4800 -3.1150 7.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7750 -2.4970 6.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6020 -2.2080 -0.5580 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9560 -3.5310 -0.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1340 -4.4400 -0.5900 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3770 -3.8370 -0.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6700 -5.0000 -1.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9950 -5.3380 -1.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0320 -4.5230 -1.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7450 -3.3730 -0.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4200 -3.0290 -0.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0770 2.1260 -0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4890 2.1740 -0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4170 2.1730 0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9420 0.7930 3.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0060 -0.5860 3.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8540 -4.6590 5.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 -5.7380 7.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5300 -4.7580 8.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4150 -2.6870 7.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 -1.5880 5.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3310 -1.5070 -0.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8710 -5.6480 -2.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2190 -6.2380 -2.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0650 -4.7870 -1.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5580 -2.7480 -0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2360 -2.1470 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2120 -3.8030 0.6820 N 0 3 0 0 0 0 0 0 0 0 0 0 0.6010 -4.0110 0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0290 -4.2740 0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 -4.2490 1.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 13 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 25 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 50 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 18 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 45 1 0 0 0 0 30 31 1 0 0 0 0 30 46 1 0 0 0 0 31 32 2 0 0 0 0 31 47 1 0 0 0 0 32 33 1 0 0 0 0 32 48 1 0 0 0 0 33 49 1 0 0 0 0 50 51 1 0 0 0 0 50 52 1 0 0 0 0 50 53 1 0 0 0 0 M CHG 1 50 1 M END