IBS-ZINC04316454 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 0 0 0 0 0 0999 V2000 -3.3500 1.9820 4.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0700 1.0290 3.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3690 1.7370 2.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6010 0.6040 3.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3320 -0.2120 4.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -0.7490 4.6490 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 -0.1200 5.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4590 1.1240 5.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5570 1.9120 5.9150 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7320 1.4340 6.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9250 2.2920 6.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7360 0.5740 5.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8710 0.8880 6.0780 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5170 -0.6260 5.2050 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2310 -1.0020 4.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7130 -2.0950 4.2890 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4080 -1.9630 4.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4400 -2.9040 3.6300 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4960 -4.1050 4.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5080 -5.0920 3.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0550 -4.2370 1.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 -3.2490 2.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0170 -6.4430 1.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4460 -6.9500 0.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 -6.5170 0.2360 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1100 -7.8860 -0.0630 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6390 -1.5360 4.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7150 2.8640 4.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3970 2.2850 4.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1370 1.4780 5.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7050 0.1480 3.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7340 2.6180 1.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1700 1.0570 1.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4160 2.0390 2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3800 -0.0040 2.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9660 1.4900 3.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4420 0.4280 5.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0450 -1.0350 4.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4880 -4.5710 4.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 -3.8250 5.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5300 -5.9950 4.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4970 -4.6360 3.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0390 -3.7710 1.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7470 -4.5160 0.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 -2.3460 1.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9460 -3.7060 2.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9920 -5.9910 1.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1260 -7.2730 2.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9550 -8.2320 0.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7430 -8.2120 -0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5640 -1.0710 5.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4780 -2.4660 5.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7090 -1.7460 3.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1110 -5.4370 2.5170 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 7 15 2 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 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 27 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 20 54 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 54 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 23 54 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 M END