PUBCHEM-ZINC06350527 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 -0.6240 1.6360 -0.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4530 0.1420 -0.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4360 -0.3410 -1.3850 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7730 -1.6710 -1.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 -2.6140 -0.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6470 -3.9630 -0.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5770 -4.3500 -1.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1030 -3.4150 -2.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7100 -2.0760 -2.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1690 -1.0920 -3.1870 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2120 -1.4220 -4.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -4.9650 0.4550 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5540 -4.4350 1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1830 -5.7050 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9340 -5.0770 2.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9570 -5.7970 2.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2030 -7.1080 2.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4080 -7.6570 1.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3970 -6.9950 0.7940 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7810 -5.5030 -1.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3100 -6.6220 -2.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1590 -7.6790 -1.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9020 -8.2220 0.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7220 -6.7170 0.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3420 2.1480 -0.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0230 1.8460 -1.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3010 2.0580 0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 -0.0370 0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4300 -0.3450 -0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 -2.3100 0.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9170 -5.3820 -1.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8210 -3.7640 -3.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8690 -2.1520 -4.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4900 -0.5090 -4.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1000 -1.7820 -3.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7480 -4.0480 2.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5690 -5.3370 3.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0020 -7.6840 2.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5730 -8.6750 1.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1870 -4.8420 -1.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5870 -4.9130 -0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9260 -6.1530 -2.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4710 -7.0970 -2.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9240 -7.2670 -0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6520 -8.3000 -2.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9770 -8.7660 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6840 -8.6080 1.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6860 -6.2020 0.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2190 -6.5760 1.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9080 -6.0240 -0.1820 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.2050 -6.6940 -0.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2920 -8.6100 -0.7180 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.7970 -9.5090 -0.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4550 -8.8570 -1.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 7 8 2 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 50 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 20 50 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 22 52 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 23 52 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 50 51 1 0 0 0 0 52 53 1 0 0 0 0 52 54 1 0 0 0 0 M CHG 1 50 1 M CHG 1 52 1 M END