PUBCHEM-ZINC05157671 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 47 0 0 0 0 0 0 0 0999 V2000 0.0840 1.3400 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 0.0070 0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2680 -0.7720 0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3170 -1.7300 -1.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6190 -2.5340 -1.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6700 -3.4940 -2.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9710 -4.2970 -2.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0220 -5.2570 -3.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3240 -6.0610 -3.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3760 -7.0220 -4.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6770 -7.8260 -4.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7270 -8.7890 -5.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0280 -9.5940 -5.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0780 -10.5590 -7.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3760 -11.3610 -7.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4810 -12.5010 -8.4950 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.4040 -11.6380 -9.6710 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3320 -13.3820 -8.2940 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0430 1.8490 0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8060 1.9510 -0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9360 -0.5600 0.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3440 -1.3390 0.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1310 -0.0970 0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2280 -1.1630 -2.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4630 -2.4180 -1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7090 -3.1030 -0.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4740 -1.8490 -1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5800 -2.9250 -3.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8150 -4.1790 -2.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0610 -4.8650 -1.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8260 -3.6110 -2.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9340 -4.6890 -4.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1680 -5.9430 -3.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4130 -6.6280 -2.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1790 -5.3750 -3.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2870 -6.4540 -5.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5200 -7.7070 -4.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7650 -8.3920 -3.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5320 -7.1410 -4.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6400 -8.2230 -6.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8720 -9.4730 -5.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1160 -10.1590 -5.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8840 -8.9100 -5.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9850 -9.9950 -8.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2190 -11.2390 -7.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4700 -11.9490 -6.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2420 -10.6940 -7.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7810 -13.1360 -8.2860 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 24 1 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 16 17 2 0 0 0 0 16 18 2 0 0 0 0 16 48 1 0 0 0 0 M CHG 1 48 -1 M END