PUBCHEM-ZINC06379153 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 48 0 0 1 0 0 0 0 0999 V2000 0.1890 0.3090 1.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2330 2.7940 1.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9650 3.3180 0.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3410 4.7080 1.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2010 4.8930 2.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5270 6.1800 2.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9950 7.2920 2.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 7.1180 1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8090 5.8330 0.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1680 1.1760 1.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9950 1.8840 0.4590 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.0600 2.9590 0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3960 1.2910 0.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0760 2.0740 -0.6690 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4010 1.8040 -0.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0580 2.7150 -1.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4150 2.5640 -2.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1180 1.4850 -1.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4700 0.5620 -0.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1100 0.7240 -0.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5440 1.3170 -1.7700 N 0 3 0 0 0 0 0 0 0 0 0 0 -11.0850 2.1670 -2.4910 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.1230 0.3360 -1.2830 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.2570 1.7440 -0.7760 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8770 2.0110 -1.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1670 0.1920 2.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.5210 1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1850 -0.5890 1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 2.6600 2.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0720 3.4930 1.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8340 2.6610 1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7350 3.3310 -0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6270 4.0390 3.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1980 6.3170 3.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2520 8.2940 2.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7240 7.9860 0.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 5.7190 -0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3940 1.5050 2.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3040 0.0910 1.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3290 0.2540 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9200 1.3470 1.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5090 3.5540 -2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8970 3.2920 -2.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0010 -0.2870 -0.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6380 -0.0130 0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7020 1.4580 1.2290 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.7310 1.5240 0.1870 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 46 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 46 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 9 2 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 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 10 46 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 24 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 24 25 1 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M CHG 1 46 1 M END