PUBCHEM-ZINC05847213 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 44 0 0 0 0 0 0 0 0999 V2000 -2.3890 1.6930 0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0540 0.3390 0.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2010 -0.0620 -0.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1570 -0.7630 -1.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3860 -1.9290 0.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7730 -2.5730 0.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6540 -3.9610 0.8710 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7180 -4.3420 2.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8790 -3.6290 3.1290 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5490 -5.8480 2.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3940 -6.1710 0.7240 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4740 -5.0060 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3900 -4.9140 -1.1520 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2190 -7.3420 0.2130 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2710 -8.4280 0.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9840 -9.6720 0.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9960 -10.9580 1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6510 -11.9060 0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4360 -11.2600 -0.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6420 -9.9470 -0.8110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0400 -11.9370 -2.2080 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.8680 -13.2420 -2.2290 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8630 -11.2310 -3.3050 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.8000 2.3560 1.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4830 2.1350 -0.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1210 1.5520 -0.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3210 0.4800 1.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9600 -0.1020 1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5660 -0.2720 0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 1.0140 -0.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0710 -0.3310 -2.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3090 -1.8260 -1.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6550 -0.6320 -2.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9630 -1.9140 1.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7360 -2.5060 -0.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4120 -2.0190 1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2110 -2.5550 -0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6570 -6.1370 2.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4330 -6.3360 2.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5380 -8.3310 2.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2300 -11.1160 2.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5600 -12.9660 0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4990 -0.5540 -0.1290 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 2 43 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 43 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 5 43 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 10 39 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 2 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END