PUBCHEM-ZINC05761018 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 0 0 0 0 0 0999 V2000 0.0490 1.6700 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 0.1450 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4890 -0.4200 -1.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8650 -0.5320 1.4100 P 0 0 0 0 0 0 0 0 0 0 0 0 0.3210 0.0130 2.6730 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7360 -2.1370 1.4190 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 -2.5920 1.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4780 -2.8410 0.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7090 -3.3040 1.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9420 -3.5180 2.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9450 -3.2720 3.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7100 -2.8140 3.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2620 -4.0130 3.1260 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.1420 -4.2310 2.3120 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4690 -4.2030 4.3110 O 0 5 0 0 0 0 0 0 0 0 0 0 2.4150 -0.1190 1.2700 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1860 -0.5030 2.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7580 -1.7680 2.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5420 -2.1560 3.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7570 -1.2850 4.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1890 -0.0250 4.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4090 0.3700 3.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5970 -1.7040 5.6040 N 0 3 0 0 0 0 0 0 0 0 0 0 6.0980 -2.8140 5.6180 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7880 -0.9380 6.5320 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0980 1.9500 -0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5120 2.0750 -0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3520 2.0720 0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1230 -0.1350 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5380 -0.1400 -1.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4010 -1.5060 -1.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 -0.0150 -2.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2960 -2.6720 -0.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4890 -3.4970 0.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1300 -3.4400 4.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -2.6250 3.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5890 -2.4480 1.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9870 -3.1400 3.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3590 0.6530 5.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9690 1.3560 3.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 4 16 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 M CHG 1 13 1 M CHG 1 15 -1 M CHG 1 23 1 M CHG 1 25 -1 M END