IBS-ZINC05246706 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 0 0 0 0 0 0999 V2000 0.1250 2.2300 1.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2480 0.9460 1.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7190 0.0330 0.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0930 0.3760 0.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4490 1.6910 1.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4660 2.5980 1.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7880 2.0920 1.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7960 1.2170 0.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4780 -0.0770 0.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1260 -0.5110 0.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7870 -1.9360 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5410 -3.9860 -1.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7120 -4.4750 -2.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8070 -6.4000 -3.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5440 -7.7930 -3.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4890 -7.7090 -4.6280 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3740 -8.6030 -4.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4120 -1.0070 0.0550 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7770 -0.5930 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5260 -1.7500 -0.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7650 -1.7900 -2.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4240 -2.8810 -2.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8380 -3.9310 -1.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6050 -3.9130 -0.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9460 -2.8240 0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4590 -4.9830 -2.3620 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.6220 2.9430 2.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2920 0.6480 1.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3590 -0.9590 0.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7390 3.6090 2.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0670 3.0990 1.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8170 1.5850 0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8340 -2.5800 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7960 -2.0040 -0.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5780 -4.1180 -1.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5290 -4.4970 -0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7580 -3.8940 -3.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6420 -4.2970 -1.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6350 -6.4430 -2.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0830 -5.7300 -3.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4400 -8.1700 -4.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 -8.4980 -2.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8690 0.2880 -0.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1920 -0.3620 0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4450 -0.9710 -2.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6170 -2.9160 -3.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9360 -4.7460 0.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7630 -2.8170 1.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7020 -2.5250 -1.0060 N 0 3 0 0 0 0 0 0 0 0 0 0 3.6160 -1.9820 -1.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6610 -2.3270 -0.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5900 -5.8990 -2.4360 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8150 -6.0700 -3.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 10 2 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 18 1 0 0 0 0 10 11 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 11 49 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 12 49 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 13 52 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 14 52 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 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 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 48 1 0 0 0 0 49 50 1 0 0 0 0 49 51 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 49 1 M END