PUBCHEM-ZINC06912765 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 0.2820 0.6580 2.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1970 -0.0080 1.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 0.7480 0.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1490 0.1460 -0.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 -1.2530 -0.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 -2.0300 0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2920 -1.4040 1.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -3.3830 -0.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -3.4390 -1.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 -2.1200 -2.0680 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3010 -1.7110 -3.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -4.5990 -2.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 -4.5240 -3.7480 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2270 -5.8110 -1.9190 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2330 -7.0900 -2.6260 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8020 -6.9620 -3.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1900 -7.5520 -2.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9270 -8.0890 -1.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8370 -7.9410 -0.4650 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6040 -9.1420 -2.2670 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7080 -9.4700 -3.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0110 -10.9570 -3.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9030 -11.1280 -2.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3640 -10.1020 -1.4450 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6610 -10.5620 -0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5900 -9.5270 -0.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2160 -8.5910 -1.2650 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7170 0.7420 3.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9210 0.0880 3.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7150 1.6600 2.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1300 1.8300 0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3250 0.7600 -1.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4550 -2.0120 2.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3870 -4.2250 0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5460 -2.0650 -4.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2430 -2.1390 -3.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3530 -0.6240 -3.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3980 -5.8710 -0.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7800 -7.6220 -1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7030 -6.8500 -3.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2060 -8.5390 -3.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7990 -9.2290 -4.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5420 -8.8930 -4.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0850 -11.5290 -3.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4870 -11.2940 -4.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8610 -12.1480 -2.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9450 -10.9270 -2.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8440 -10.0990 0.4150 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 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 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 26 48 1 0 0 0 0 M CHG 1 48 -1 M END