PUBCHEM-ZINC06869465 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 1 0 0 0 0 0999 V2000 -0.9560 -2.7810 1.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4560 -2.9070 0.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3990 -1.5130 0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0900 -1.3500 -1.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3160 -0.9990 2.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3410 0.5270 2.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5000 1.0710 3.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5020 2.5260 3.7140 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7010 3.3340 3.5200 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.0970 3.0860 2.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1070 4.7060 3.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8930 5.9210 3.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4550 6.1770 1.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5590 7.0240 1.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0790 7.2680 0.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5750 6.7380 -0.5200 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4970 5.9370 -0.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9040 5.6250 0.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1220 6.6880 4.2480 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7910 4.7110 3.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9340 5.7650 3.7930 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3710 3.2990 3.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2150 2.9540 4.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7520 3.1180 4.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0910 2.9060 4.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0750 2.7150 5.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7310 2.7390 6.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4140 2.9500 6.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4300 3.1420 5.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7260 2.5550 7.4540 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3560 2.6440 8.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4900 -3.7710 1.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5050 -2.1590 0.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7030 -2.3450 2.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6540 -3.3750 -0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9310 -3.5050 1.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0050 -0.6690 0.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9400 -2.4410 0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5370 -0.4240 -1.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4990 -2.1840 -1.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0210 -1.3050 -1.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4840 -1.3520 2.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2460 -1.4340 2.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4120 0.9140 1.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1580 0.9040 1.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4230 0.7050 4.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6590 0.7300 4.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0060 7.4860 2.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9390 7.9170 0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1040 5.5440 -1.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0240 4.9930 0.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0550 5.4010 4.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3840 2.8920 3.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1100 2.5540 4.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1340 2.9740 7.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4050 3.3160 6.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1060 -1.5310 0.8750 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.4540 -0.8840 0.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 57 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 57 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 5 57 1 0 0 0 0 6 7 1 0 0 0 0 6 44 1 0 0 0 0 6 45 1 0 0 0 0 7 8 1 0 0 0 0 7 46 1 0 0 0 0 7 47 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 24 1 0 0 0 0 11 12 1 0 0 0 0 11 20 2 0 0 0 0 12 13 1 0 0 0 0 12 19 2 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 48 1 0 0 0 0 15 16 1 0 0 0 0 15 49 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 50 1 0 0 0 0 18 51 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 52 1 0 0 0 0 22 23 2 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 53 1 0 0 0 0 26 27 1 0 0 0 0 26 54 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 29 56 1 0 0 0 0 30 31 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 57 1 M END