PUBCHEM-ZINC06267170 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 1 0 0 0 0 0999 V2000 3.0310 1.7930 -0.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8240 0.2960 -0.2120 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9420 0.1150 0.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0880 -0.2640 0.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7640 -1.0730 -0.2080 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6060 -0.3800 -1.4970 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4690 -0.2920 -2.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4760 0.3570 -1.9400 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5680 -1.0220 -3.4110 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 -1.0720 -4.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8620 -1.7800 -5.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2980 -3.2420 -5.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9630 -4.0600 -4.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3930 -5.3890 -4.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1560 -5.9240 -5.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4910 -5.1310 -6.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0620 -3.8030 -6.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 -1.5930 -6.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 -0.7330 -7.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1020 -0.5350 -8.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3200 -1.1940 -8.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5160 -2.0500 -7.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4940 -2.2490 -6.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9100 1.9940 -1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1670 2.2530 -0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1760 2.3040 0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3980 -0.9580 -1.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4200 -1.5420 -3.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3770 -1.5460 -3.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1850 -0.0350 -4.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7500 -1.2460 -6.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 -3.6830 -3.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1330 -6.0040 -3.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4880 -6.9580 -5.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0840 -5.5450 -7.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3280 -3.2050 -7.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8630 -0.2050 -7.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9490 0.1360 -9.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1170 -1.0390 -9.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4650 -2.5640 -7.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6700 -2.9230 -5.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2810 0.1360 1.6850 O 0 5 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 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 42 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 18 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 16 2 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 M CHG 1 42 -1 M END