PUBCHEM-ZINC06281606 MOE2007 3D CORINA 3.40 0006 02.08.2006 71 75 0 0 1 0 0 0 0 0999 V2000 -0.1570 -0.7260 2.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3760 -1.8990 1.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 -2.7550 2.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8340 -3.8310 1.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4460 -4.0770 0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5080 -3.2060 -0.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 -2.1250 0.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 -3.4550 -1.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6720 -4.5290 -2.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5620 -5.3210 -1.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1160 -6.4190 -2.4040 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9650 -5.1280 -0.5660 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6730 -6.7350 -1.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2770 -4.8780 -3.9580 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9680 -5.6110 -4.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1190 -5.4390 -3.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2270 -4.7320 -4.0770 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2620 -5.6280 -4.0270 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8120 -6.8620 -3.8640 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4760 -6.7540 -3.8000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6710 -7.9350 -3.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6920 -8.4310 -2.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3170 -9.4300 -2.0410 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3410 -9.9790 -0.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5960 -2.8120 -4.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9430 -3.4910 -4.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4740 -4.0480 -6.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7250 -4.6730 -6.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4850 -4.7330 -4.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9820 -4.1560 -3.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7280 -3.5320 -3.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6880 -5.3710 -5.0180 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5560 -5.3470 -3.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -4.1150 -6.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5370 -3.0080 -7.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2410 -2.3870 -8.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3040 -1.3600 -8.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6150 -0.9870 -8.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3990 -1.5650 -7.8230 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8480 -2.5610 -7.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4810 0.1480 2.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1770 -0.4840 2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1920 -0.9440 3.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6540 -2.5950 3.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5580 -4.4900 1.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7370 -1.4520 -0.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6220 -2.8100 -2.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0490 -8.7100 -4.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 -7.7240 -3.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4880 -7.6120 -1.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6730 -8.8560 -1.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6150 -10.4590 -0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1310 -10.7330 -0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5590 -9.1990 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4830 -2.2200 -3.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5410 -2.0830 -5.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9490 -3.9910 -7.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1180 -5.1050 -6.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5380 -4.1690 -2.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3790 -3.0750 -2.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4860 -5.8500 -4.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8070 -4.3200 -3.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1230 -5.8980 -3.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7630 -4.9000 -6.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8810 -4.5890 -6.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2670 -2.6930 -8.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2810 -0.8660 -9.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0850 -0.1930 -9.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5230 -3.0040 -6.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3490 -3.6900 -4.9630 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.4330 -3.0870 -4.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 44 1 0 0 0 0 4 5 1 0 0 0 0 4 45 1 0 0 0 0 5 6 1 0 0 0 0 5 12 2 0 0 0 0 6 7 1 0 0 0 0 6 8 2 0 0 0 0 7 46 1 0 0 0 0 8 9 1 0 0 0 0 8 47 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 13 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 70 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 55 1 0 0 0 0 25 56 1 0 0 0 0 25 70 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 57 1 0 0 0 0 28 29 1 0 0 0 0 28 58 1 0 0 0 0 29 30 2 0 0 0 0 29 32 1 0 0 0 0 30 31 1 0 0 0 0 30 59 1 0 0 0 0 31 60 1 0 0 0 0 32 33 1 0 0 0 0 33 61 1 0 0 0 0 33 62 1 0 0 0 0 33 63 1 0 0 0 0 34 35 1 0 0 0 0 34 64 1 0 0 0 0 34 65 1 0 0 0 0 34 70 1 0 0 0 0 35 36 1 0 0 0 0 35 40 2 0 0 0 0 36 37 2 0 0 0 0 36 66 1 0 0 0 0 37 38 1 0 0 0 0 37 67 1 0 0 0 0 38 39 2 0 0 0 0 38 68 1 0 0 0 0 39 40 1 0 0 0 0 40 69 1 0 0 0 0 70 71 1 0 0 0 0 M CHG 1 70 1 M END