PUBCHEM-ZINC05594107 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 0 0 0 0 0 0999 V2000 -0.3810 1.9860 0.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5830 0.6060 0.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 -0.2580 0.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7850 0.2410 0.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9860 1.6460 0.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8750 2.5070 0.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2980 2.1580 0.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3620 1.2350 0.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0790 -0.1570 0.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8220 -0.5950 0.4670 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1530 -1.0690 0.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4320 -0.6090 0.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7060 0.7580 0.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6970 1.6720 0.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0060 3.1200 0.4050 N 0 3 0 0 0 0 0 0 0 0 0 0 6.6990 3.5920 -0.4780 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5660 3.8400 1.2830 O 0 5 0 0 0 0 0 0 0 0 0 0 3.5330 3.5160 0.4520 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4200 4.0650 -0.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5650 5.5870 -0.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4490 6.1500 -2.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5110 7.1300 -2.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4120 7.6410 -3.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2650 7.1450 -4.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1780 6.1640 -4.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2470 5.7050 -3.1990 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2330 2.6490 0.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5900 0.2170 0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 -1.3240 0.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0190 3.5780 0.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9610 -2.1320 0.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2500 -1.3140 0.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7310 1.0970 0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9110 3.9930 1.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2060 3.6460 -1.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4460 3.8060 -1.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7780 6.0060 -0.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5380 5.8450 -0.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8620 7.4920 -1.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6890 8.4070 -4.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2160 7.5200 -5.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8450 5.7730 -5.1870 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 10 2 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 18 1 0 0 0 0 8 9 1 0 0 0 0 8 14 2 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 13 2 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 25 2 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M END