PUBCHEM-ZINC01433162 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 1 0 0 0 0 0999 V2000 0.0390 1.3720 0.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1130 -0.0300 0.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3400 -0.6750 0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4780 0.1080 0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4090 1.5170 0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1910 2.1550 0.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7440 2.0590 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1900 3.3710 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5590 3.6090 -0.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4630 2.5450 -0.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0160 1.2220 -0.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6570 0.9920 -0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9200 -0.3450 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1200 -1.1730 -1.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4230 -1.7780 -1.3150 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7700 -2.5000 -2.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0270 -2.6330 -3.3850 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0370 -3.0510 -2.3090 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9210 -2.8540 -1.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3510 -4.1960 -0.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9580 -5.0940 -1.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9990 -5.2620 -2.8500 C 0 0 3 0 0 0 0 0 0 0 0 0 7.1020 -5.7810 -2.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5650 -3.8850 -3.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6620 -6.1090 -3.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6810 -6.4030 -5.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6850 -7.1090 -4.7560 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 1.8520 0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7960 -0.6200 0.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3920 -1.7580 0.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1220 3.2370 0.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5020 4.2020 0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9290 4.6320 -0.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5230 2.7540 -0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7160 0.4010 -0.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2500 -0.8880 0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3780 -1.9790 -1.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0320 -0.5500 -2.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7950 -2.2950 -1.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4490 -2.2510 -0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0770 -4.0370 0.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4820 -4.6990 -0.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9070 -4.6600 -1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1920 -6.0740 -1.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8180 -3.9980 -4.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4200 -3.3510 -3.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5520 -5.6020 -4.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9970 -7.0680 -3.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9900 -5.8900 -6.1870 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 13 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 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 24 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 M CHG 1 49 -1 M END