PUBCHEM-ZINC03752769 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 0 0 0 0 0 0999 V2000 0.0240 1.6000 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 0.0830 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6550 -0.5600 -1.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6110 -2.0850 -1.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 -2.5960 -2.3410 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3580 -3.9580 -2.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8330 -4.8930 -1.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9870 -6.2690 -1.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6810 -6.6730 -2.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2180 -5.7720 -3.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0510 -4.3920 -3.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8520 -6.5330 -4.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6730 -7.8800 -4.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9800 -7.9310 -3.3930 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7280 -8.7850 -2.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1030 -9.1030 -5.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4440 -9.2900 -5.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8650 -10.4660 -6.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9460 -11.4780 -6.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5890 -11.3020 -6.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1800 -10.1170 -5.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7480 -12.3410 -6.5120 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 -12.1440 -6.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2710 -12.6680 -7.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6150 -12.8300 -7.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7160 -14.1760 -8.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5270 -5.9540 -6.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8640 -5.3070 -5.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8440 -6.1000 -5.6260 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0580 1.9600 -0.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4890 1.9640 -1.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4660 2.0390 0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 -0.2460 0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0680 -0.2420 0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1730 -0.2270 -2.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7000 -0.2300 -1.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1320 -2.4220 -0.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4340 -2.4180 -1.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2920 -4.5880 -0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 -6.9920 -1.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4730 -3.6650 -4.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1810 -8.5200 -5.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9200 -10.5550 -6.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1390 -9.9560 -5.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1650 -13.0360 -6.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1270 -12.0370 -5.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 -11.2880 -6.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8790 -12.0410 -8.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3040 -12.8160 -6.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7330 -14.3530 -8.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4410 -14.9850 -7.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0240 -14.2270 -9.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6970 -6.7190 -6.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8690 -5.2060 -6.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8430 -4.0450 -5.6270 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 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 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 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 41 1 0 0 0 0 12 13 2 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 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 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 28 29 2 0 0 0 0 28 55 1 0 0 0 0 M CHG 1 55 -1 M END