PUBCHEM-ZINC04566338 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 -0.0570 1.5800 -0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1450 0.0520 -0.0960 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1880 -0.2660 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4790 -0.5440 -1.3880 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4850 -0.1110 -1.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3390 -0.1250 -2.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6660 -1.3450 -3.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5080 -2.3300 -2.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7310 -2.7770 -1.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6450 -2.0920 -1.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4130 -2.4850 -2.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6450 -2.0300 -3.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -0.1290 2.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5610 -1.2010 3.4400 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6270 -1.0200 3.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1890 -1.2820 4.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4110 -0.8240 5.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 -0.9130 7.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5460 -1.4610 7.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1650 -1.9120 6.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4860 -1.8200 4.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2470 -1.5710 8.4890 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.6340 -1.2340 9.5110 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4110 -1.9940 8.4720 O 0 5 0 0 0 0 0 0 0 0 0 0 0.5000 -2.4500 2.7220 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9840 1.9190 -0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 2.0240 -0.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.9950 0.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2800 0.3640 -2.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2340 0.6100 -3.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2220 -1.0300 -4.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4520 -1.8600 -2.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7730 -3.2050 -3.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3070 -2.5520 -0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6060 -3.8670 -1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -2.4460 -0.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4130 -2.0360 -2.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5600 -3.5710 -2.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4380 -2.8920 -4.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2640 -1.3410 -4.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0600 -0.1710 2.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3530 0.8810 2.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4150 -0.4020 5.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2380 -0.5560 8.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1650 -2.3410 6.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9780 -2.1850 3.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5500 -3.1650 3.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 -0.4760 1.1060 N 0 3 0 0 0 0 0 0 0 0 0 0 0.5420 -1.5170 1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5860 -0.2510 1.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 48 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 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 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 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 13 41 1 0 0 0 0 13 42 1 0 0 0 0 13 48 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 25 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 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 25 47 1 0 0 0 0 48 49 1 0 0 0 0 48 50 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M CHG 1 48 1 M END