PUBCHEM-ZINC00239772 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 0.0630 1.4250 -0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 0.0460 -0.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2480 -0.6300 -0.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4640 0.0610 -0.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4740 1.4400 -0.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2770 2.1320 -0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2930 3.6110 0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7050 5.4140 1.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3400 5.7130 3.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3690 5.2000 4.1140 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7860 3.8050 3.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1670 3.5280 2.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8660 5.9820 5.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2080 5.8980 5.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7070 6.6870 6.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8650 7.5760 7.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5360 7.6920 6.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 6.9010 5.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3390 8.3310 8.2500 F 0 0 0 0 0 0 0 0 0 0 0 0 1.2340 -2.0780 -0.8490 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1370 -2.6530 -0.8220 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3200 -2.6410 -1.0430 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.8810 1.9390 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9100 -0.4780 -0.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4070 -0.4510 -0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4280 1.9650 -0.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2500 4.0720 -0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5080 4.0960 -0.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 5.6560 1.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5910 5.9800 1.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2120 6.7980 3.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6210 5.2460 3.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6220 3.5170 4.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9470 3.1590 4.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0530 4.0960 2.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3440 2.4580 2.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9030 5.2340 5.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7470 6.6110 6.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8860 8.3870 7.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 6.9910 5.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0270 3.9410 1.5470 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1960 3.4080 1.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 12 41 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 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 40 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 41 42 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M CHG 1 41 1 M END