IFLAB-ZINC02722077 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 0 0 0 0 0 0999 V2000 2.7700 0.7720 -0.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 -0.5460 -0.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3430 -1.3290 0.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6980 -2.5160 0.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8010 -2.9490 -0.2220 N 0 3 0 0 0 0 0 0 0 0 0 0 0.5110 -2.2260 -1.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 -0.9990 -1.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4360 -2.9070 -2.0430 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8320 -2.6180 -2.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7160 -4.0800 -1.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -4.0890 -0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -5.0990 0.7260 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4050 -4.8610 1.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9450 -3.8000 2.2080 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2800 -5.8900 3.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7820 -5.6460 4.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6630 -6.6100 5.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0470 -7.8180 4.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4520 -8.0650 3.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3340 -7.1110 2.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 -9.0260 6.2260 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.6740 -5.1260 -1.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7020 -5.5680 -3.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5990 -6.5440 -3.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4710 -7.0870 -2.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4480 -6.6520 -1.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5510 -5.6800 -0.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3480 -8.0420 -2.9250 F 0 0 0 0 0 0 0 0 0 0 0 0 3.6860 0.6100 -1.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1160 1.4490 -1.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0160 1.2090 0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0650 -0.9960 1.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9150 -3.1190 1.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8980 -0.4130 -2.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4460 -5.9710 0.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2610 -4.7040 4.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0500 -6.4230 6.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9310 -9.0090 3.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7200 -7.3070 1.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0230 -5.1450 -3.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6210 -6.8870 -4.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1300 -7.0780 -0.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5310 -5.3460 0.1870 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 39 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 27 43 1 0 0 0 0 M CHG 1 5 1 M END