IBS-ZINC02214972 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 0 0 0 0 0 0999 V2000 0.1990 1.7060 -0.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2930 0.2630 -0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5300 -0.1250 1.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7060 0.7560 2.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9370 0.2580 3.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9950 -1.1150 3.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8210 -1.9800 2.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -1.5090 1.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 -2.3940 0.3790 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2080 -1.9390 -0.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1360 -0.6300 -1.1610 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -2.7890 -1.9520 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -4.1530 -1.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 -6.3850 -1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1400 -6.0260 -3.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -4.6130 -3.2740 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4570 -8.2700 -2.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2060 -9.1370 -1.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1820 -10.6070 -2.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5080 -12.9480 -1.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1740 -13.7840 -0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5900 -13.5840 -0.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9230 -12.2200 0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3530 -11.2940 -0.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1360 2.2270 -0.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 1.8000 -1.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6250 2.1970 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6640 1.8340 2.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0720 0.9390 4.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 -1.5200 4.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 -3.0540 2.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0920 -2.2520 -2.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 -6.7100 -1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3040 -6.8530 -0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8090 -6.1770 -4.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8530 -6.3680 -3.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -3.9950 -4.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -8.5570 -2.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8790 -8.4870 -3.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7530 -9.0350 -0.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2390 -8.7810 -1.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7040 -10.7800 -3.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 -10.9510 -2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4190 -13.0500 -1.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8860 -13.2150 -2.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9880 -14.8470 -0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7700 -13.5430 0.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0150 -12.1420 0.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5590 -11.9460 1.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7510 -11.5400 -1.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5620 -10.2510 -0.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1120 -4.9400 -0.9660 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6150 -6.8400 -2.3970 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8400 -11.4750 -1.0130 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.4460 -11.2010 -0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 11 2 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 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 2 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 16 1 0 0 0 0 13 52 2 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 14 52 1 0 0 0 0 14 53 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 15 53 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 17 53 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 19 54 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 20 54 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 24 54 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END