PUBCHEM-ZINC02548172 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 0 0 0 0 0 0999 V2000 0.6030 1.5670 -0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6550 0.0490 -0.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3720 -0.5440 0.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4260 -2.0660 0.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1080 -2.5400 1.9760 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2050 -3.9650 1.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9260 -4.3840 3.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0690 -5.9010 3.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7290 -6.2520 4.5940 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9110 -7.5530 5.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3190 -7.8430 6.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5720 -6.9410 7.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9600 -7.4640 8.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1070 -8.8260 8.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8600 -9.6860 7.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4690 -9.2280 6.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2500 -10.1820 5.6950 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8490 -9.7780 4.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6600 -8.5180 4.1060 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4360 -5.4330 7.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6460 -4.8790 6.2700 O 0 5 0 0 0 0 0 0 0 0 0 0 1.6110 1.9930 -0.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 1.9690 -1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 1.8990 0.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3670 -0.3440 -0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 -0.2510 -1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3930 -0.1470 0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8700 -0.2380 1.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4120 -2.4800 0.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9640 -2.3880 -0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 -4.3980 1.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7620 -4.3030 1.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9140 -3.9050 3.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 -3.9970 4.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0740 -6.3620 3.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6470 -6.2710 2.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1450 -5.4960 5.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1440 -6.7880 9.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4070 -9.2160 9.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9710 -10.7570 8.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6600 -10.5480 3.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1320 -4.8220 8.4700 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 19 2 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 2 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 2 0 0 0 0 M CHG 1 21 -1 M END