PUBCHEM-ZINC04097657 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 0.0720 1.2660 0.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -0.0980 0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 -0.7470 -0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3260 -0.0210 -0.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3130 1.3540 -0.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 1.9820 0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2430 3.3310 0.4250 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3690 2.1660 -0.6910 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9260 -2.0990 -0.3840 N 0 3 0 0 0 0 0 0 0 0 0 0 1.8310 -2.9810 -0.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5930 -4.4290 -0.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5640 -5.3160 -0.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9550 -5.0360 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9410 -5.4480 -1.0610 C 0 0 3 0 0 0 0 0 0 0 0 0 4.8600 -4.7620 -1.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7220 -6.8220 -1.5760 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5590 -7.3760 -1.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3690 -6.7920 -0.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3640 -8.7720 -1.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6450 -9.5440 -1.2900 O 0 5 0 0 0 0 0 0 0 0 0 0 6.3600 -5.3110 -0.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6040 -5.9890 0.5920 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5320 -2.3570 -0.0780 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6180 -3.2350 0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0060 -1.0810 0.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2810 -2.5360 -1.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2930 -1.5340 -2.1750 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7830 1.7610 1.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1880 -0.4920 -1.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1190 3.5980 0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0770 1.6230 -1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8680 -2.6450 -0.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6140 -4.7690 -1.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1110 -3.9900 0.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1040 -5.6100 0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2860 -7.2950 0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4590 -7.0050 -1.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0410 -1.2400 1.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9870 -0.7320 0.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8900 -9.0210 -3.1250 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1150 -4.4740 -1.0350 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.8150 -3.6700 -1.5550 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 7 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 2 0 0 0 0 9 23 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 2 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 21 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 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 40 2 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 26 27 2 0 0 0 0 26 42 1 0 0 0 0 M CHG 1 9 1 M CHG 1 20 -1 M CHG 1 41 -1 M CHG 1 42 -1 M END