PUBCHEM-ZINC01126401 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 0 0 0 0 0 0999 V2000 1.9190 -4.4100 3.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2470 -3.8210 2.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6220 -2.5900 2.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -2.0420 1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -2.7210 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6330 -3.9640 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2610 -4.5080 1.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9360 -5.8220 0.9080 N 0 3 0 0 0 0 0 0 0 0 0 0 1.3130 -6.8440 1.1350 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1140 -5.8820 0.6040 O 0 5 0 0 0 0 0 0 0 0 0 0 0.6390 -4.6970 -1.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 -5.7790 -1.4840 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -4.1660 -2.4870 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 -4.8130 -3.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1370 -6.2000 -3.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 -6.8360 -5.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2980 -6.0920 -6.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2860 -4.7100 -6.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1930 -4.0690 -4.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4100 -6.9070 -7.7290 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0110 -5.9810 -8.6240 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9470 -8.1970 -7.4700 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1370 -7.1440 -8.2700 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9820 -5.9940 -8.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1910 -6.4640 -9.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0610 -5.2810 -9.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8430 -4.5740 -10.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6410 -3.4880 -11.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6570 -3.1100 -10.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8750 -3.8180 -9.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0800 -4.9060 -8.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 -5.0160 3.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7560 -5.0340 3.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2850 -3.6060 4.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6180 -2.0540 3.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 -1.0800 1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4790 -2.2920 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4590 -3.3360 -2.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -6.7820 -2.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2340 -7.9150 -5.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3440 -4.1330 -7.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 -2.9900 -4.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4830 -8.0450 -8.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3250 -5.5200 -7.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4080 -5.2760 -9.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8480 -6.9380 -10.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7650 -7.1820 -8.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0500 -4.8690 -11.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4710 -2.9360 -12.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2800 -2.2620 -10.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6690 -3.5220 -8.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2530 -5.4610 -7.9830 H 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 2 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 29 30 2 0 0 0 0 29 50 1 0 0 0 0 30 31 1 0 0 0 0 30 51 1 0 0 0 0 31 52 1 0 0 0 0 M CHG 1 8 1 M CHG 1 10 -1 M END