PUBCHEM-ZINC00240955 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 50 0 0 1 0 0 0 0 0999 V2000 0.2970 1.0180 0.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2190 -0.3530 0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 -0.8870 -1.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7040 -1.6980 -0.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3420 -3.1590 -0.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -0.5960 -2.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9800 0.0740 -2.4950 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8210 -1.1030 -3.5150 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2470 -2.0880 -3.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9330 -0.1120 -3.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6550 -0.5450 -5.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6940 -0.7350 -6.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1450 -1.2600 -4.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3460 -2.0160 -7.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2750 -2.7960 -8.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5420 -4.1670 -8.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1310 -4.8940 -9.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4650 -4.2630 -10.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 -2.8980 -10.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6090 -2.1620 -9.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5560 -2.2260 -11.6930 N 0 3 0 0 0 0 0 0 0 0 0 0 1.9720 -2.9260 -12.6250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4200 -0.9950 -11.7400 O 0 5 0 0 0 0 0 0 0 0 0 0 1.3540 0.9750 0.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2000 1.7350 -0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2700 1.3980 1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 -1.0560 0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2830 -0.2760 -0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4330 -1.6300 -1.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1870 -1.2890 0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 -3.5850 -1.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2410 -3.7450 -0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6540 -3.2740 0.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 0.8900 -4.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6560 -0.0170 -3.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4070 0.2060 -5.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1950 -1.4810 -4.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 0.2040 -6.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2310 -1.1420 -7.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8990 -2.0240 -4.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6520 -0.3240 -4.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7550 -1.0580 -7.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1760 -2.6010 -6.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2840 -4.6920 -7.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3260 -5.9570 -8.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9230 -4.8480 -11.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4040 -1.0990 -9.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6120 -1.7190 -5.9250 N 0 3 0 0 0 0 0 0 0 0 0 0 1.0730 -2.6100 -5.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 13 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 12 48 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 13 48 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 14 48 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 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 47 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M CHG 1 48 1 M END