IBS-ZINC02273688 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 61 0 0 0 0 0 0 0 0999 V2000 0.0370 1.4930 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0010 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2990 -0.8890 1.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -2.2150 0.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1960 -3.5220 1.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1420 -4.6370 0.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 -4.4760 -0.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7160 -3.2030 -1.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3680 -2.0880 -0.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3520 -0.7430 -1.0820 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6630 -0.1940 -2.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 -0.4690 2.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3570 0.5950 2.5470 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4550 -1.3940 3.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4240 -1.5940 5.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4010 -0.8650 7.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8100 1.0170 6.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7690 0.2340 4.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0240 0.6430 8.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4800 1.0980 8.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7150 1.6690 10.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7300 2.7890 10.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2810 2.3430 10.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 1.7770 9.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0330 1.8440 -0.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6950 1.9120 -0.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2070 1.9020 0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 -3.6940 2.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 -5.6350 0.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8610 -5.3490 -1.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0650 -3.0940 -2.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 0.6550 -2.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 -0.9470 -3.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7100 0.1190 -2.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4900 -1.9250 3.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2770 -2.1200 3.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3370 -2.2010 5.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4290 -2.2840 5.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3260 -1.5880 8.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 -0.2420 7.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 1.6590 6.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7210 1.6180 6.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6970 -0.3430 4.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7470 0.9680 4.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8510 -0.1810 9.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7360 1.8680 8.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1630 0.2560 8.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7410 2.0470 10.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6140 0.8680 11.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9310 3.6500 10.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8820 3.1250 11.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3910 3.1910 10.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 1.5800 11.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9950 1.4240 9.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1520 2.5940 8.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4040 -0.6570 4.8620 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8210 0.0420 7.4310 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.6290 -0.5760 7.2770 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 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 12 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 14 56 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 15 56 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 16 57 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 17 57 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 18 56 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 19 45 1 0 0 0 0 19 57 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 23 53 1 0 0 0 0 24 54 1 0 0 0 0 24 55 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 57 1 M END