IFLAB-ZINC05146699 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 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 0.6820 -2.0030 1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 -2.6260 2.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8950 -1.8690 3.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8400 -0.4880 3.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 0.1390 2.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5870 -2.5500 4.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0630 -2.7600 3.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7360 -3.4220 5.0880 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0500 -3.7100 5.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6760 -3.4200 4.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7420 -4.3910 6.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1960 -4.5970 5.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1070 -3.7220 6.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6530 -4.3480 5.6110 S 0 0 0 0 0 0 0 0 0 0 0 0 9.9360 -5.7830 4.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6000 -5.7040 5.1130 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0380 -6.8330 4.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0460 -7.5400 3.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1970 -6.8700 4.1760 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9070 -8.8220 3.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0310 -9.4480 2.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8950 -10.6400 2.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6460 -11.2140 1.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5270 -10.5980 2.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6510 -9.4080 3.0810 C 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 0.2300 -2.5950 0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3610 -3.7040 2.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2920 0.1000 3.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 1.2170 2.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5060 -1.9280 5.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1170 -3.5160 4.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1440 -3.3820 3.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5340 -1.7940 3.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2350 -3.6530 5.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6600 -3.7690 7.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2710 -5.3560 6.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9440 -2.8160 6.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9920 -7.0990 4.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0070 -9.0000 2.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7660 -11.1260 1.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5440 -12.1470 1.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5540 -11.0500 2.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7770 -8.9300 3.4980 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 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 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 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 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 22 2 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 23 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 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 2 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 M END