PUBCHEM-ZINC05844535 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 0.1990 2.4550 -0.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6850 1.4030 -1.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 1.1040 -2.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7230 1.8150 -3.9740 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7000 2.8860 -3.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1720 1.3940 -4.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9740 1.5700 -3.2340 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5360 0.8160 -5.2900 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6630 0.6150 -6.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0760 0.0890 -7.2980 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3690 0.9520 -6.2430 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 1.5410 -5.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3570 1.8410 -5.1380 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4390 0.6860 -7.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7240 -0.6260 -7.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5210 -0.8860 -8.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0340 0.1590 -9.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7510 1.4660 -9.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9510 1.7320 -8.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9030 -0.1280 -10.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3540 -0.4320 -1.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 -1.9230 -1.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6110 -2.6330 -0.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 -4.0620 -0.6690 N 0 3 0 0 0 0 0 0 0 0 0 0 2.0470 -5.0010 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4270 -6.1870 -1.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2730 -5.9470 -0.4140 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3890 -6.6060 -0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2290 -4.6220 -0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 2.0440 -0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2660 3.3350 -1.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2350 2.7350 0.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6810 0.4900 -0.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4570 0.5380 -5.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3240 -1.4420 -7.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7430 -1.9060 -9.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1540 2.2810 -9.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 2.7540 -7.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2780 -0.2170 -11.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6150 0.6860 -10.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4440 -1.0610 -10.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9300 -0.0050 -0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4360 -0.3010 -1.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 -2.0540 -1.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4430 -2.3500 -2.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6930 -2.5030 -0.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 -2.2070 0.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9880 -4.8350 -1.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7740 -7.1440 -1.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 -4.1100 0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7880 0.2480 -2.9250 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7040 1.7810 -1.4760 H 0 0 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 52 1 0 0 0 0 3 4 1 0 0 0 0 3 51 2 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 12 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 2 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 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 38 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 20 41 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 21 51 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 22 45 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 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 29 50 1 0 0 0 0 M CHG 1 24 1 M END