IFLAB-ZINC05146829 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -0.6180 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6810 -2.0040 1.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3140 -2.6310 2.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8980 -1.8710 3.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8410 -0.4790 3.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 0.1420 2.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5790 -2.5410 4.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1840 -1.9230 5.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6920 -2.9140 6.1690 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3910 -3.0150 7.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6850 -4.2170 7.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0100 -5.3590 6.6380 S 0 0 0 0 0 0 0 0 0 0 0 0 3.3630 -4.0960 5.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6980 -3.8720 4.4710 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8140 -1.7780 8.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1210 -1.2750 7.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6560 -1.8630 6.6280 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6950 -0.1720 8.0630 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9660 0.3160 7.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3890 1.5530 8.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1470 1.5650 9.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4070 2.8230 9.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8600 3.8330 9.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9650 3.2020 7.8300 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2270 -2.5930 0.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3560 -3.7090 2.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2930 0.1130 3.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 1.2200 1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2590 -0.8560 5.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2240 -4.4530 8.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0520 -1.0070 7.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9370 -2.0180 9.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2670 0.2980 8.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7280 -0.4540 7.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8420 0.5560 6.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5290 0.6620 9.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0070 2.9760 10.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9550 4.8780 9.4600 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 16 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 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 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 M END