PUBCHEM-ZINC03648669 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 67 0 0 1 0 0 0 0 0999 V2000 2.3020 2.0650 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6230 1.1570 0.8360 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7810 1.2150 2.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3900 2.1860 3.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4880 1.9340 4.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0070 0.7470 4.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4100 -0.2180 4.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2820 0.0130 2.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 -0.7390 1.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8080 0.0990 0.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2540 -0.2700 -0.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 -1.5860 -0.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4100 -1.6380 -2.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7040 -2.6730 -3.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9120 -2.3880 -4.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8590 -1.0690 -5.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6060 -0.0170 -4.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3810 -0.3220 -2.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1940 0.4970 -1.7390 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5190 1.9180 -1.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0340 2.1690 -1.7900 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5000 1.6430 -2.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3310 3.6740 -1.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9500 5.1810 -0.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7890 3.6860 -2.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6940 1.7220 -0.5860 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4980 0.7700 -0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 -3.4880 -5.4200 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2870 -3.2770 -6.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0990 -2.4670 0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2670 -2.0290 1.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -3.1660 2.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3000 -3.1680 3.5160 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3230 -4.2110 1.5510 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4690 -3.8750 0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8410 -4.5970 -0.6680 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2710 1.6780 -1.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8250 3.0460 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3500 2.1380 0.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7900 3.1060 2.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9600 2.6690 5.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0990 0.5590 6.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0450 -1.1390 4.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 -3.7060 -2.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.8180 -6.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5810 1.0050 -4.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 2.3450 -0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 2.3850 -2.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6850 4.2310 -1.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2190 4.0790 -2.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7570 6.0060 -1.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2530 5.2020 0.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9770 5.2130 -0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6390 2.6970 -2.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6690 4.4700 -3.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7770 3.7370 -2.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4360 -4.2530 -7.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1640 -2.6610 -7.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3760 -2.8390 -7.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5100 -5.1330 1.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7590 3.8900 -1.4110 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.8650 3.1130 -0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 6 7 2 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 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 44 1 0 0 0 0 15 16 1 0 0 0 0 15 28 1 0 0 0 0 16 17 2 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 26 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 23 61 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 24 61 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 25 56 1 0 0 0 0 25 61 1 0 0 0 0 26 27 1 0 0 0 0 28 29 1 0 0 0 0 29 57 1 0 0 0 0 29 58 1 0 0 0 0 29 59 1 0 0 0 0 30 31 2 0 0 0 0 30 35 1 0 0 0 0 31 32 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 34 35 1 0 0 0 0 34 60 1 0 0 0 0 35 36 2 0 0 0 0 61 62 1 0 0 0 0 M CHG 1 61 1 M END