OTAVA-ZINC01962606 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 1 0 0 0 0 0999 V2000 -0.2850 1.4510 0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2750 -0.0790 0.0960 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1890 -0.4540 -0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5080 -0.5560 1.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0500 -1.1640 2.1760 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8240 -0.3070 1.3760 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5140 -0.7970 2.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9720 -0.4260 2.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3890 0.1900 1.5180 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8130 -0.7790 3.4680 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1400 -0.3350 3.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4480 0.9180 2.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7580 1.3550 2.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7650 0.5460 3.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4630 -0.7030 3.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1510 -1.1440 3.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7710 -2.7080 4.6060 Cl 0 0 0 0 0 0 0 0 0 0 0 0 9.7290 -1.7150 4.5540 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.6170 -0.5620 0.1810 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3020 -0.6920 -0.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7350 -0.2570 -2.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4320 -0.3900 -3.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6940 -0.9560 -3.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2610 -1.3900 -2.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5650 -1.2630 -0.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5680 -1.1210 -4.8530 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 1.8200 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8510 1.7960 -0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7490 1.8260 0.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0740 -0.3480 3.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4170 -1.8810 2.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4990 -1.3420 4.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6640 1.5500 2.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9980 2.3290 2.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7880 0.8900 3.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7490 0.1850 -2.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9910 -0.0510 -4.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2470 -1.8310 -2.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0070 -1.6060 -0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 19 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 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 32 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 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 19 20 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 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 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 38 1 0 0 0 0 25 39 1 0 0 0 0 M END