PUBCHEM-ZINC05598216 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 -0.1920 -0.4680 -1.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1710 -0.9650 -0.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9350 -2.0810 -0.8030 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8450 -2.6370 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9990 -2.2060 1.1300 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6750 -3.8000 -0.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8510 -5.0860 -0.3800 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0530 -5.0660 -1.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7560 -6.3030 -0.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7620 -6.3370 0.3950 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3600 -6.2150 1.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1910 -6.6520 2.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7920 -6.5300 4.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5650 -5.9730 4.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7290 -5.5350 3.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1240 -5.6560 2.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2740 -5.2190 0.9690 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9790 -4.9320 1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5680 -4.8710 2.3480 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -4.6910 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 -4.1470 -1.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3280 -3.9250 -2.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6690 -4.2410 -2.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1510 -4.7810 -0.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2980 -5.0020 0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5880 -5.1160 -0.7390 N 0 3 0 0 0 0 0 0 0 0 0 0 4.3430 -4.9160 -1.6730 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0140 -5.5920 0.2980 O 0 5 0 0 0 0 0 0 0 0 0 0 0.3820 0.3700 -0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4880 -1.2750 -1.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7460 -0.1440 -2.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6170 -1.2890 0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8500 -0.1580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5630 -3.8940 0.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9750 -3.6310 -1.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2280 -6.2190 -1.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1610 -7.2150 -0.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1510 -7.0880 2.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4420 -6.8710 4.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2590 -5.8790 5.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7710 -5.0990 3.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5840 -3.9000 -1.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0430 -3.5040 -3.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3420 -4.0650 -2.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6770 -5.4190 1.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 17 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 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 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 45 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 M CHG 1 26 1 M CHG 1 28 -1 M END