PUBCHEM-ZINC04774281 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 0 0 0 0 0999 V2000 0.1550 1.4810 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2230 0.0740 0.0680 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3720 -0.5700 1.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2100 0.0190 2.3790 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7050 -1.9120 1.2610 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8610 -2.7560 2.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 -4.0460 2.2750 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9750 -3.8080 1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0750 -4.9620 3.5030 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6710 -4.6530 4.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1370 -6.3640 2.9110 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4150 -7.1070 3.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6570 -6.1970 1.5820 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7210 -6.3830 1.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6050 -4.8070 1.1700 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3010 -7.0450 0.4630 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 -6.8030 -0.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 -7.7450 -1.3890 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2350 -8.6520 -1.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8910 -8.2360 0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8920 -8.8730 0.7650 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2010 -10.0240 0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6520 -10.5530 -0.9780 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6500 -9.8680 -1.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 -10.3890 -2.7260 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4380 -6.5390 2.7250 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.3480 -4.9190 4.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3300 -5.6380 4.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4060 -0.5310 -0.9720 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2930 -0.0100 -2.0870 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 1.5910 -0.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6310 2.0580 -0.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2930 1.8940 1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8610 -2.3750 0.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 -2.2130 3.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9340 -2.9660 2.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3100 -5.9280 -0.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9990 -10.6050 0.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -9.8770 -3.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4240 -11.2690 -3.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 15 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 27 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 26 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 18 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 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 27 28 1 0 0 0 0 29 30 2 0 0 0 0 M CHG 1 26 -1 M END