PUBCHEM-ZINC06169415 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 1 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 1.0860 2.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8670 2.2790 2.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0450 3.4870 2.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7550 3.0330 1.2500 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2400 3.4430 0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1890 3.4960 1.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1460 2.7970 1.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4530 3.2600 1.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7560 4.3950 1.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8190 5.0340 0.5630 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.5650 4.6260 0.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1790 6.2340 -0.1970 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4680 6.3810 -1.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1670 7.4570 0.7300 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1830 7.5620 1.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4820 8.6990 -0.1110 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6210 8.9430 -0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6730 8.4220 -0.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0940 7.1920 -1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4980 6.0870 -0.7320 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2650 7.0170 -2.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8210 7.9890 -2.5900 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7710 9.7990 0.7540 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1570 7.3000 1.7480 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.4470 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6080 0.2190 2.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 0.8390 3.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0720 2.2340 3.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7940 2.3160 2.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7690 3.6590 3.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5510 4.3810 2.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8810 1.9120 2.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2250 2.7400 2.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7710 4.7620 1.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8240 5.1790 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2030 9.2550 -1.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9800 10.6200 0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2030 8.0390 2.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 1.5600 1.2170 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7200 5.7790 -2.3960 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4910 5.7150 -2.9770 H 0 0 0 0 0 0 0 0 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 1 42 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 2 42 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 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 42 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 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 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 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 21 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 25 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 24 1 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 43 44 1 0 0 0 0 M CHG 1 11 1 M END