PUBCHEM-ZINC05804329 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 62 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7020 1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7730 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0810 -1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6920 -1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 0.0130 -2.4140 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 0.4090 -3.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 1.0520 -4.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6200 1.0620 -4.2110 N 0 3 0 0 0 0 0 0 0 0 0 0 1.0550 0.4420 -3.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4320 0.4550 -3.1270 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0060 0.0670 -2.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8440 1.1130 -4.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7030 1.4900 -4.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8420 2.1990 -6.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8570 2.5570 -6.7750 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0790 2.4750 -6.6160 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1730 2.0860 -5.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2730 2.3520 -6.3840 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0800 1.4300 -4.7660 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2960 1.0290 -4.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2320 3.2090 -7.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2780 4.7110 -7.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7170 6.8670 -8.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9280 7.5810 -9.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7720 7.3980 -10.7590 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4650 6.0260 -11.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2390 5.2950 -9.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5860 0.1650 -2.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.1670 2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6280 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -3.8530 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.6190 -2.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3780 1.4880 -4.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6080 0.0420 -4.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0880 1.7500 -4.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0970 0.9970 -2.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1570 2.9030 -8.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3870 2.9900 -8.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3530 5.0160 -7.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1230 4.9300 -6.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6190 6.9560 -7.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8780 7.3200 -8.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0840 8.6460 -9.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8010 7.1640 -10.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5620 5.9650 -11.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2950 5.5630 -11.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3750 5.7240 -9.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0600 4.2380 -9.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9360 0.9940 -2.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2090 0.0860 -3.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6490 -0.7620 -2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4320 5.4460 -8.8500 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 5 6 2 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 2 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 22 1 0 0 0 0 16 17 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 24 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 58 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 26 58 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 30 58 1 0 0 0 0 31 55 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 M CHG 1 11 1 M END