PUBCHEM-ZINC03819770 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 0 0 0 0 0 0999 V2000 -0.0220 1.8100 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4580 -0.4780 1.2620 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7090 -0.4240 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3900 -0.5810 -1.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7300 -0.9100 -1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3990 -1.0830 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7060 -0.9230 1.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3650 -0.6000 1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8350 -1.4340 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5840 -1.6090 -1.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2880 -1.5720 2.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8350 -1.9180 -0.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8650 -1.9360 0.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5920 -1.6340 1.1690 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0320 -2.2280 1.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9020 -3.0840 2.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9960 -3.3520 3.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2210 -2.7750 3.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3580 -1.9260 2.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2700 -1.6450 1.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.2180 -1.0610 1.7050 I 0 0 0 0 0 0 0 0 0 0 0 0 -8.9780 -2.1900 -1.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1160 -1.5050 -2.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1950 -1.7900 -3.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0900 -2.6920 -3.2040 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.9980 -3.3600 -2.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9470 -3.1420 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 2.1870 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 2.1710 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 2.1610 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8700 -0.4470 -2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2600 -1.0320 -2.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2180 -1.0550 2.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8270 -0.4800 2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9460 -3.5350 2.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8960 -4.0130 4.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0740 -2.9890 3.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3770 -0.9790 0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3880 -0.7640 -3.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3100 -1.2660 -4.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7530 -4.0900 -1.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8750 -3.6960 -0.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 4 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 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 2 0 0 0 0 13 23 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 39 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 27 42 1 0 0 0 0 28 43 1 0 0 0 0 M END