IBS-ZINC04000162 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -0.1350 1.6100 0.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 0.0870 0.0430 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7170 -0.5710 1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2010 -0.1990 1.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9260 -0.4730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2040 0.1580 -1.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8530 0.9870 -2.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 -0.2440 -1.2770 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7620 -1.3380 -1.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 0.2790 -2.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4940 -0.0960 -2.5850 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9700 0.6490 -3.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2410 -0.0460 -1.2610 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6180 0.9670 -1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4410 -0.5240 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3750 -0.9050 -1.4390 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1290 -1.7890 -2.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7790 -2.8010 -2.6710 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8740 -1.4500 -3.1840 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1290 -1.3080 -4.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9200 -2.6280 -3.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8110 -5.1220 -3.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5170 -6.2820 -4.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2710 -6.6650 -5.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9850 -7.7230 -5.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9280 -8.3620 -5.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1960 -8.0170 -3.8600 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4880 -6.9910 -3.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8440 2.0950 0.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6980 2.1240 -0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6510 1.8090 1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2290 -0.2990 2.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6430 -1.6640 1.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 0.8570 1.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6770 -0.7740 2.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9590 -0.1130 0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9850 -1.5560 -0.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9030 1.2230 -1.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3730 1.4620 -2.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 1.3750 -2.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4900 -0.0580 -3.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3730 -1.6200 -0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0150 -0.3000 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.4500 -3.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7640 -2.8980 -1.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7490 -5.2420 -2.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2070 -5.0200 -3.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 -6.1520 -5.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8100 -8.0410 -6.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5110 -9.1920 -5.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7430 -6.7470 -2.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5220 -3.8390 -3.6920 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.5140 -3.9290 -3.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5870 -3.6980 -4.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 15 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 19 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 21 52 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 22 52 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 28 51 1 0 0 0 0 52 53 1 0 0 0 0 52 54 1 0 0 0 0 M CHG 1 52 1 M END