PUBCHEM-ZINC02852974 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 0 0 0 0 0 0999 V2000 -0.0080 1.4470 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 0.0180 -0.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6110 -0.5890 -1.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6620 -1.9740 -1.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2750 -2.5890 -2.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8370 -1.8250 -3.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -0.4450 -3.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 0.1750 -2.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6190 -2.6130 -4.5820 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5380 -1.6700 -5.1160 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0040 -3.9060 -4.1350 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4590 -2.8450 -5.7410 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -1.8180 -6.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3460 -2.4590 -8.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5520 -3.6960 -8.1750 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8050 -4.7230 -7.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 -4.0840 -5.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3920 -3.8840 -9.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7680 -2.6260 -10.2170 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.0390 -5.0640 -9.1980 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9850 -5.3080 -10.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0050 -6.3630 -9.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9930 -6.6180 -10.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2330 -7.1200 -12.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2140 -6.0650 -12.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2260 -5.8100 -11.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 1.8220 -0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 1.8070 -0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5170 1.8020 0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 -2.5700 -0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3160 -3.6660 -2.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2280 0.1490 -3.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1270 1.2530 -2.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1970 -1.4230 -6.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9320 -1.0110 -6.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9770 -1.7710 -8.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3930 -2.6920 -8.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -5.5290 -7.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8140 -5.1170 -7.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0410 -4.7730 -5.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3780 -3.8540 -5.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8790 -5.7510 -8.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5040 -4.3820 -10.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4860 -7.2900 -9.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5460 -6.0060 -8.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7190 -7.3700 -10.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5110 -5.6920 -11.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7150 -8.0470 -11.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9370 -7.3020 -13.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6730 -6.4220 -13.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7320 -5.1380 -12.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 -5.0580 -11.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 -6.7360 -11.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 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 42 1 0 0 0 0 21 22 1 0 0 0 0 21 26 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 48 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 M END