PUBCHEM-ZINC02135273 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 49 0 0 1 0 0 0 0 0999 V2000 -0.4020 0.1590 -0.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4670 1.2010 -0.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8510 1.0130 -0.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 -0.2190 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4930 -1.2620 0.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 -1.0740 0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7580 -0.4910 0.0730 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8130 0.3760 -0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7390 1.5500 -0.5190 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1530 -0.3100 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3290 0.6060 -0.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6620 -0.1050 -0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7690 -1.2490 0.2870 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7090 0.6940 -0.5690 N 0 0 0 0 0 0 0 0 0 0 0 0 11.0010 0.2000 -0.5670 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6120 -0.1320 -1.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0780 0.0380 -2.8540 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0000 -0.7860 -1.5840 C 0 0 3 0 0 0 0 0 0 0 0 0 12.8270 -1.6680 -0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5330 -1.2980 -2.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0300 -0.1760 -3.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0190 0.7480 -3.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4870 1.2600 -1.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0740 0.0970 -0.9040 C 0 0 3 0 0 0 0 0 0 0 0 0 14.9620 -0.5420 -0.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7950 0.5850 0.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7180 0.1470 1.0440 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4770 0.3070 -0.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 2.1640 -0.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4930 1.8510 -0.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8660 -2.2340 0.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 -1.8900 0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0060 -1.4300 0.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2060 -0.6410 1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1890 -1.2050 -0.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2400 0.9870 -1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3320 1.4700 0.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5840 1.6410 -0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5300 0.1000 0.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3650 -1.9890 -2.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7630 -1.8780 -3.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5030 -0.6140 -4.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1830 0.4150 -4.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9600 0.2100 -2.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2540 1.5970 -3.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2660 1.8720 -1.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6320 1.9260 -1.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6600 1.3490 1.0380 O 0 5 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 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 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 24 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 26 48 1 0 0 0 0 M CHG 1 48 -1 M END