IBS-ZINC06664292 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 0 0 0 0 0 0999 V2000 0.0190 1.5510 0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 0.1600 -0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -0.5500 -0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4200 0.1390 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4330 1.5240 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2340 2.2370 0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7300 2.2180 0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7470 3.4410 0.2010 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8730 1.4170 0.0070 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8560 0.0280 -0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8650 -0.6740 -0.1770 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6220 -0.5620 -0.1440 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6210 -1.5710 -0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1750 2.0730 0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6910 2.1240 1.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0820 2.7450 1.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5980 2.8850 2.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9770 2.4100 3.9330 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7870 3.5860 3.1310 N 0 0 0 0 0 0 0 0 0 0 0 0 10.2740 3.9130 4.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3560 5.4290 4.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1880 6.0820 3.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7170 5.6120 2.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6300 4.0920 2.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1630 7.6230 3.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6900 8.1370 4.6110 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9170 2.1010 0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9410 -0.3720 -0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1820 -1.6330 -0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2390 3.3210 0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8840 1.5260 -0.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0970 3.0890 -0.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9950 2.7020 2.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7200 1.1140 1.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7840 2.1200 0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0440 3.7410 1.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6230 3.4950 5.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2630 3.4560 4.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3390 5.8440 4.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7870 5.6660 5.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2360 5.7810 3.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7320 6.0450 1.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4000 5.9660 1.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6240 3.6460 2.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2660 3.7910 1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6540 8.2000 2.5470 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 37 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 1 0 0 0 0 22 25 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 46 1 0 0 0 0 M CHG 1 46 -1 M END