PUBCHEM-ZINC06200608 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 45 0 0 1 0 0 0 0 0999 V2000 0.0330 1.5870 -0.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 0.0740 -0.0350 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5830 -0.4120 -0.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5810 -0.3150 1.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 -0.6590 2.2780 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9430 -0.2300 1.4410 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3720 -0.4660 2.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5510 0.0550 0.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3680 -0.4400 -0.0860 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0460 -0.6230 -1.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5660 -0.3370 -2.3630 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4280 -1.1940 -1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1020 -1.3930 -2.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4980 -1.9560 -2.3770 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.4180 -2.9900 -2.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2260 -1.9350 -1.0210 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.1100 -2.5820 -1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2970 -2.3840 0.1120 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.0320 -3.4380 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0120 -1.5450 0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9880 -2.2770 1.3570 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5800 -1.5030 1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7390 -0.6180 -0.7230 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0070 0.0210 -0.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2400 -1.1780 -3.3600 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1220 -1.3890 -4.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4320 -2.2690 -5.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9210 -0.4160 -5.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5360 -0.5720 -7.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0590 1.9670 -0.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3980 1.8860 -1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5390 2.0880 0.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7770 -0.6630 0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6240 -1.1700 -3.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2920 -2.1200 0.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2030 -0.6210 0.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8590 -0.4580 -2.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9870 -0.6210 -5.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7150 0.6030 -5.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4670 -0.3990 -7.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8050 -1.5570 -7.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2580 0.4290 -7.8310 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.9990 0.3310 -8.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0320 1.3960 -7.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2800 0.3160 -7.7810 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 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 34 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 18 1 0 0 0 0 16 23 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 25 37 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 38 1 0 0 0 0 28 39 1 0 0 0 0 29 40 1 0 0 0 0 29 41 1 0 0 0 0 29 42 1 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 42 45 1 0 0 0 0 M CHG 1 42 1 M END