IFLAB-ZINC05300039 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7110 -0.4890 1.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8540 -1.8140 1.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3960 -2.6050 0.5950 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5740 -2.3070 2.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0340 -1.5150 3.4020 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7240 -3.6950 2.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3730 -4.2950 3.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2760 -5.6980 3.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5830 -5.8930 2.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2520 -4.7000 1.9980 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7580 -4.5640 1.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2480 -7.2320 1.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8140 -6.7470 4.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1300 -7.1950 5.4750 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0650 -7.2100 4.3850 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5300 -8.2450 5.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9600 -8.6420 4.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0290 -3.6070 5.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2720 -2.8440 5.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8910 -2.2050 6.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2600 -2.3180 7.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0160 -3.0710 6.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4090 -3.7210 5.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0770 0.1420 1.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2820 -7.5690 2.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 -7.1380 0.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0170 -7.9550 2.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5090 -7.8680 6.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8790 -9.1160 5.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9810 -9.0190 3.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6110 -7.7710 5.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3090 -9.4180 5.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 -2.7550 5.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3070 -1.6150 7.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7390 -1.8140 7.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0830 -3.1550 6.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 -4.3120 4.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 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 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 20 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 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 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 M END