PUBCHEM-ZINC03105158 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 51 0 0 1 0 0 0 0 0999 V2000 -0.4480 1.7820 -0.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2860 0.2730 -0.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5810 -0.4210 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6180 0.2000 0.2040 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5900 -1.9070 0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7950 -2.5460 0.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8470 -3.9380 0.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7010 -4.7120 0.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4990 -4.0770 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4440 -2.6810 -0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8870 -6.0600 0.4630 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7250 -6.8920 0.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1850 -8.3250 0.6540 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7410 -8.3800 1.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 -9.3160 0.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2880 -11.7960 0.1030 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2390 -11.6150 0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 -11.7320 -1.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2670 -13.1380 0.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4410 -13.9210 1.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 -15.1570 1.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2720 -15.6240 1.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9890 -14.8570 0.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4920 -13.6220 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0900 -8.7660 -0.3790 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7320 -8.0340 -0.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5020 2.2500 -0.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1960 2.0500 -1.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7690 2.2070 0.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -0.1070 -1.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 0.0500 0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7030 -1.9680 0.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7910 -4.4180 0.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4170 -4.6350 -0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5130 -2.2300 -0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2990 -6.8230 -0.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -6.5920 1.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 -9.1600 -0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5670 -9.2850 1.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4200 -11.7860 -1.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 -10.8050 -1.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 -12.5640 -1.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 -13.5850 1.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5020 -15.7590 2.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6580 -16.5880 1.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9350 -15.2250 0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0740 -13.0510 -0.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6230 -10.6830 0.5220 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.0850 -10.9420 1.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4030 -10.5570 -0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 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 11 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 25 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 15 48 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 16 48 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 2 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 24 47 1 0 0 0 0 25 26 1 0 0 0 0 48 49 1 0 0 0 0 48 50 1 0 0 0 0 M CHG 1 48 1 M END