ASINEX-ZINC04454886 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 47 0 0 1 0 0 0 0 0999 V2000 1.2490 2.2250 -0.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1790 0.7050 -0.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2110 0.2010 0.0340 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4570 0.6260 1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2110 -1.3310 0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7370 -2.0510 -0.1220 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3730 -1.8440 0.7380 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5570 -3.2680 0.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6930 -3.8250 2.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4020 -5.7460 3.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6980 -7.2300 3.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1450 -8.0150 2.7980 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7090 -7.6570 1.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4170 -6.1950 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1350 0.5780 -0.9950 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4150 0.8170 -0.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4290 0.1640 -1.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7600 0.3290 -0.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0770 1.1610 0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0660 1.8450 0.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7330 1.6850 0.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2600 2.5490 -0.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 2.6340 -1.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 2.6580 0.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4420 0.3170 -1.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9350 0.3350 0.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1230 -1.2110 1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6190 -3.4290 1.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3220 -3.7580 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3800 -3.7170 1.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9340 -3.3000 2.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8750 -5.1360 4.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -5.5550 3.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2430 -7.5690 4.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7770 -7.4170 3.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2610 -8.3060 0.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7870 -7.8550 1.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6600 -6.0060 1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -5.9130 0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1810 -0.4820 -2.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5510 -0.1810 -1.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1140 1.2930 0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3190 2.5160 1.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9650 2.2570 0.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9680 -5.2990 2.3030 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.9880 -5.4320 2.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 15 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 9 45 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 10 45 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 44 1 0 0 0 0 45 46 1 0 0 0 0 M CHG 1 45 1 M END