IBS-ZINC02094367 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 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 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7800 -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 3 0 0 0 0 0 0 0 0 0 -0.5540 -6.8000 0.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6080 -6.7620 0.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6140 -6.8840 1.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7480 -7.1640 2.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1520 -7.5990 3.8150 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4640 -6.8610 2.4880 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 -7.0220 3.4350 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4700 -6.4050 4.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7750 -8.4700 3.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -9.3600 4.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3500 -10.6590 4.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6130 -11.0660 4.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4660 -10.1830 3.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0530 -8.8710 3.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7160 -7.7170 2.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8410 -7.7270 2.3410 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8970 -6.6500 2.8030 O 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 0.1620 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 -0.9680 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 1.4790 -7.7190 -0.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9180 -5.9900 -0.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3030 -7.7100 1.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1610 -5.9500 1.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0540 -9.0450 4.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3130 -11.3570 5.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9320 -12.0820 4.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4510 -10.5050 3.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 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 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 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 35 1 0 0 0 0 7 8 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 39 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 14 1 0 0 0 0 12 18 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 29 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 M END