IFLAB-ZINC04223543 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 0 0 0 0 0 0999 V2000 0.9300 1.4980 -0.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 0.0850 -0.6740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 -0.6460 -1.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8820 -0.1630 -1.7120 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3940 -2.0910 -1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5130 -2.8050 -0.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4320 -4.1630 -0.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -4.5890 -1.7370 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.4950 -2.9770 -1.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6840 -2.6260 -2.4490 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5960 -3.4660 -3.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5760 -4.6840 -3.1390 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7570 -2.7250 -3.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1270 -2.9320 -5.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5590 -1.6170 -4.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4320 -5.1860 -0.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4580 -3.3230 0.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6810 -2.2400 0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7020 -5.4950 0.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2350 -6.5290 -0.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1630 -6.1700 -1.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6490 -7.1260 -2.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2130 -8.4470 -2.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2930 -8.8150 -1.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8050 -7.8620 -0.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8440 1.8700 -1.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 1.7490 -0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7950 1.9730 -0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8870 -1.6240 -2.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5900 -2.6290 -2.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5030 -3.5820 -5.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1810 -2.9740 -5.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2290 -0.7660 -4.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5550 -1.3730 -4.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0520 -5.7610 0.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6870 -5.8580 -1.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4230 -2.9280 1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8970 -3.6930 1.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3520 -1.7430 -0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3430 -1.4920 0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1920 -5.9520 1.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5420 -4.9070 1.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5260 -5.1480 -1.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3710 -6.8430 -2.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5920 -9.1910 -2.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9550 -9.8460 -1.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0930 -8.1780 0.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.5220 -0.0160 N 0 3 0 0 0 0 0 0 0 0 0 0 4.1790 -4.1700 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 9 2 0 0 0 0 6 7 2 0 0 0 0 6 18 1 0 0 0 0 7 8 1 0 0 0 0 7 16 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 30 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 33 1 0 0 0 0 15 34 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 16 48 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 17 48 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 47 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 48 1 M END