ASINEX-ZINC04966372 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 0 0 0 0 0 0999 V2000 -0.1290 -0.3940 1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 0.5210 0.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1070 -0.1380 -0.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2850 -0.0250 -2.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6320 -0.6480 -3.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -1.3990 -3.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6250 -1.5180 -2.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2790 -0.8950 -1.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2280 -2.0600 -4.5140 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5830 -2.0710 -5.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5330 -1.5070 -6.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3110 -2.8860 -6.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1220 -3.2720 -9.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 -3.3870 -10.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 -4.5620 -10.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 -4.4590 -8.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4710 -4.3450 -7.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8110 -4.7230 -11.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8230 -5.7830 -12.1490 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8140 -5.6640 -13.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1180 -6.6090 -14.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1510 -6.3540 -15.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8810 -5.1720 -14.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5990 -4.2180 -13.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5600 -4.4850 -13.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9820 -3.5220 -11.7500 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.0580 -0.6740 0.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4070 -1.3160 1.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3940 0.1090 2.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 1.4500 0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6260 0.8150 0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6370 0.5520 -1.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 -0.5240 -4.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5450 -2.0960 -2.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9310 -1.0050 -0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1000 -2.5720 -4.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1500 -2.2860 -7.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6700 -3.8440 -6.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7790 -4.1470 -9.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7270 -2.3670 -9.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 -2.4430 -10.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6700 -3.5110 -11.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 -5.4780 -10.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2060 -3.5870 -8.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1720 -5.3400 -8.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 -4.1770 -6.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1010 -5.2380 -7.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5480 -7.5320 -14.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3840 -7.0840 -15.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6820 -4.9860 -15.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1700 -3.2970 -13.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3810 -3.1650 -7.9890 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7710 -2.3270 -8.0230 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 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 12 52 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 13 52 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 17 52 1 0 0 0 0 18 19 2 0 0 0 0 18 26 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 48 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 23 24 2 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 52 1 M END