IBS-ZINC05148975 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 1 0 0 0 0 0999 V2000 2.2400 1.6870 0.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4730 0.1950 1.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 -0.5240 0.8760 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2990 -1.8720 1.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 -2.6300 0.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1950 -4.0000 0.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3720 -4.6180 1.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5130 -3.8580 1.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4770 -2.4900 1.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4090 -6.0060 1.5750 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6340 -6.8280 0.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 -6.2920 -0.2240 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8090 -7.0510 -1.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8690 -8.4220 -0.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1320 -8.9480 0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 -8.1290 1.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1610 -10.3080 0.5420 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7340 -10.5700 1.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8840 -12.0790 2.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4880 -12.7460 1.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0840 -12.4170 0.5750 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4440 -12.8260 -0.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 -10.8980 0.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4810 -13.0300 0.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6970 -9.3000 -1.6400 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.2100 -9.8250 -2.6250 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8660 -9.4970 -1.3600 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.5260 -6.4830 -2.0560 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4590 2.0470 1.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1630 2.2350 1.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9320 1.8420 -0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2540 -0.1650 0.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7820 0.0390 2.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7560 -2.1490 0.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6920 -4.5900 0.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4290 -4.3380 1.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3650 -1.8990 1.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9780 -6.3930 2.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 -10.1640 2.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7110 -10.0940 1.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2950 -12.2740 3.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5550 -12.4830 1.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 -12.3710 2.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3800 -13.8260 2.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5880 -10.6600 -0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8290 -10.4910 1.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4130 -14.1120 0.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9040 -12.7960 -0.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1210 -12.6200 1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4800 -5.5260 -2.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0750 -7.0410 -2.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 14 15 2 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 18 19 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 20 21 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 M CHG 1 25 1 M CHG 1 27 -1 M END