IFLAB-ZINC05153187 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 -0.0610 1.0740 0.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0980 -0.2920 0.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 -0.9750 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3020 -0.2930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3420 1.0810 0.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1530 1.7590 0.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6370 1.8430 0.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8560 0.9340 0.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5540 -1.0620 -0.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0760 -0.9690 -0.8010 C 0 0 3 0 0 0 0 0 0 0 0 0 6.3380 -1.2550 0.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9160 -2.2520 -1.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1250 -3.0520 -1.7600 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6230 -3.7240 -0.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1070 -3.6450 0.4520 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8870 -4.5180 -0.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7050 -5.5720 -1.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3940 -5.4810 -3.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1990 -6.4420 -4.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3200 -7.5000 -3.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6370 -7.6090 -2.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8300 -6.6480 -1.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0760 -8.6800 -5.2050 Cl 0 0 0 0 0 0 0 0 0 0 0 0 7.1790 -0.0940 -1.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4300 0.1400 -0.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2120 1.0190 -1.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5360 1.4300 -2.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9670 0.7590 -2.8400 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9770 1.6070 0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 -0.8270 0.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0250 -2.0430 -0.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 2.8280 0.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6740 2.3820 -0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6740 2.5880 1.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7630 1.5100 0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9360 0.4780 1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8390 -1.6870 0.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3620 -1.6820 -1.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1540 -2.9130 -1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6120 -2.0070 -2.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6010 -3.1290 -2.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6790 -3.8120 -1.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2040 -5.0010 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0870 -4.6640 -3.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7370 -6.3600 -5.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9540 -8.4360 -2.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2900 -6.7430 -0.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7760 -0.2990 0.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2210 1.3360 -1.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8900 2.0930 -3.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7510 -0.1970 -0.6670 N 0 3 0 0 0 0 0 0 0 0 0 0 4.5660 0.2330 -1.5830 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 8 51 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 9 51 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 24 1 0 0 0 0 10 51 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 47 1 0 0 0 0 24 25 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 51 1 M END