PUBCHEM-ZINC06482107 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 47 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.2720 0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2120 -0.1370 0.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9110 -0.6200 1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3420 0.0210 2.1560 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0550 -2.0680 1.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6360 -2.7830 1.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7500 -4.2450 1.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4620 -4.8260 0.8010 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1900 -4.8450 2.9870 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3450 -6.2790 3.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1130 -6.6590 4.6080 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0480 -6.5680 4.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5720 -8.0950 4.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -8.3540 5.3150 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6490 -9.0320 4.4440 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -8.7820 3.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8100 -10.4850 4.6020 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8760 -10.7320 4.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 -11.0030 5.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8420 -10.4730 7.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -9.4880 7.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8140 -8.9850 9.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0620 -9.4700 9.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7060 -10.4500 8.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0970 -10.9510 7.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6910 -8.9940 10.5860 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1890 -8.2220 10.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0150 -11.2440 3.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 -10.5580 2.9750 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9300 1.8160 0.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6040 1.5510 -0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5920 1.5360 1.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6630 -2.5140 0.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0120 -2.3220 2.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4400 -4.3110 3.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6450 -6.8020 2.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3620 -6.5290 2.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 -10.7600 5.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2350 -12.1000 5.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2340 -9.1040 7.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3010 -8.2270 9.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6810 -10.8150 9.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6090 -11.7100 6.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3860 -12.4280 3.2800 O 0 5 0 0 0 0 0 0 0 0 0 0 2.8570 -5.7370 5.5080 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8520 -5.9710 5.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6420 -6.0060 6.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 45 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 28 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 28 29 2 0 0 0 0 28 44 1 0 0 0 0 45 46 1 0 0 0 0 45 47 1 0 0 0 0 M CHG 1 44 -1 M END