IFLAB-ZINC05258138 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 47 0 0 1 0 0 0 0 0999 V2000 0.0050 1.5030 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -0.0040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7790 -0.6910 0.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 -2.0720 0.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 -2.7710 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7180 -2.0780 -0.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7320 -0.6960 -0.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5640 0.0570 -1.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.1700 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1810 -4.8480 1.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 -4.2510 2.1930 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3160 -6.3490 1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4390 -6.8660 2.5550 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2660 -6.3620 3.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6960 -8.3510 2.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 -9.1070 3.0680 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5680 -6.5120 4.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8880 -6.2300 5.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6360 -6.1420 6.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7000 -5.7800 9.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8000 1.8770 -0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.8590 -0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1610 1.8630 1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 -0.1480 1.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3890 -2.6080 1.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3020 -2.6180 -1.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 0.2490 -2.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4380 -0.5380 -2.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8870 1.0040 -1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 -4.6510 -0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5650 -6.7880 0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -6.6280 0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1370 -5.7060 4.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1540 -7.4550 5.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3010 -5.2860 5.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5930 -7.0350 5.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2230 -7.0860 7.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9310 -5.3360 7.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2940 -6.7210 9.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6540 -5.5790 9.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0030 -4.9720 9.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -8.8340 1.9200 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8090 -6.5960 3.2820 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2520 -5.7570 2.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9030 -5.8710 7.6490 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3390 -5.0340 7.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9100 -9.7940 1.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 30 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 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 43 1 0 0 0 0 15 16 2 0 0 0 0 15 42 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 19 45 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 20 45 1 0 0 0 0 42 47 1 0 0 0 0 43 44 1 0 0 0 0 45 46 1 0 0 0 0 M END