PUBCHEM-ZINC05643831 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 46 0 0 0 0 0 0 0 0999 V2000 -2.5310 -2.3550 -5.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6370 -2.3250 -3.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3960 -0.7240 -2.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8980 -0.7310 -2.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2740 -0.2510 -3.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3920 1.2240 -3.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4180 1.5990 -4.2630 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2940 1.9890 -3.3400 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 3.3460 -3.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9790 4.0990 -4.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7590 5.5250 -4.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5790 6.2080 -5.0180 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4070 6.0190 -3.9160 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5900 7.0030 -4.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3600 5.3050 -3.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3700 5.8790 -2.8380 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0940 3.9390 -3.0640 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1220 3.1720 -2.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0320 2.3370 -3.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9120 3.2190 -4.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9090 1.4070 -2.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3720 -1.8300 -5.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6050 -1.8970 -5.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5460 -3.3910 -5.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5660 -2.8130 -3.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7970 -2.8330 -3.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0990 0.2440 -1.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0710 -1.5220 -1.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1970 0.0550 -2.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2530 -1.6890 -2.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4160 -0.5490 -1.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 -0.7420 -4.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8600 -0.3950 -2.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4570 1.5050 -2.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9090 3.7350 -4.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7460 3.8520 -1.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6220 2.5380 -1.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4180 1.7120 -3.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5770 2.6050 -4.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 3.8250 -4.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5340 3.8930 -3.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2930 0.7350 -1.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5450 0.7860 -3.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5600 1.9740 -1.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6630 -0.8990 -3.3670 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.1780 -0.3180 -4.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 2 45 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 3 45 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 5 45 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 17 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 21 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 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 45 46 1 0 0 0 0 M CHG 1 45 1 M END