PUBCHEM-ZINC00692856 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 50 0 0 0 0 0 0 0 0999 V2000 0.5780 -0.0520 -1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3480 -1.2920 -0.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0520 -1.2950 0.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3790 -2.5860 1.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4360 -2.8830 2.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 -1.7660 3.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5320 -2.1650 4.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8420 -2.5750 1.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4820 -1.5320 1.6640 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3060 -3.8500 1.8720 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5840 -4.2070 2.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6150 -3.2730 2.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8660 -3.6810 3.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0520 -5.0260 3.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0480 -5.9470 3.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8100 -5.5730 2.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5640 -7.2650 3.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9160 -8.2890 3.2700 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8500 -7.0760 3.8270 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.2100 -5.7530 3.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2620 -5.2200 4.1090 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.7230 -8.1530 4.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5450 -8.4200 5.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4290 -9.5580 6.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1810 -10.1030 5.4030 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5850 -0.0670 -1.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1400 -0.0010 -1.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4780 0.8590 -0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4830 -2.1840 -0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1110 -1.3230 0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1730 -0.4160 0.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7910 -1.1760 -0.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2860 -3.4210 0.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7550 -3.8070 2.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 -3.0870 1.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 -0.8510 2.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3580 -1.5320 3.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 -1.3540 5.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 -3.0560 5.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5520 -2.3770 4.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6550 -4.6150 1.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4690 -2.2100 2.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6550 -2.9620 3.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0490 -6.3250 2.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7590 -7.8670 4.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4810 -9.0500 3.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5000 -8.6760 5.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7810 -7.5170 6.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2940 -9.8150 7.4860 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 7 40 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 41 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 42 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 14 15 2 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 44 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 2 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 2 0 0 0 0 24 49 1 0 0 0 0 M CHG 1 49 -1 M END