IBS-ZINC02271081 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 46 0 0 1 0 0 0 0 0999 V2000 -0.5160 -1.3590 0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1770 -1.4630 1.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9770 0.0390 3.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3340 0.5450 3.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2130 0.0000 1.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5860 1.4860 0.9370 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3020 2.1030 1.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1000 1.6110 0.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4620 2.9900 0.8180 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8530 3.1950 0.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2030 4.6480 0.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3860 5.0100 1.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7360 6.3540 1.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9110 7.3510 1.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7380 7.0040 0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3870 5.6610 0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9530 2.0470 -0.2460 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6120 2.2540 -0.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1110 1.8580 0.7090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 2.9730 -1.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1830 -1.1300 -0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0030 -2.3100 -0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2900 -0.5850 0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5670 -1.6820 2.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9370 -2.2520 1.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7630 0.7760 3.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2810 -0.9170 3.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6190 1.5020 3.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1540 -0.1610 3.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2310 0.7000 4.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1370 -0.4910 0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9390 -0.5400 1.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6470 1.0520 1.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3750 1.2380 -0.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4340 2.5730 1.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0930 2.9010 -0.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0470 4.2470 1.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6540 6.6240 2.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1860 8.3960 1.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0960 7.7800 -0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4710 5.4030 -0.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2570 2.3290 -2.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9170 3.2280 -1.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7040 3.9000 -1.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8610 -0.1570 1.8330 N 0 3 0 0 0 0 0 0 0 0 0 0 0.2530 0.6270 1.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 2 45 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 45 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 5 45 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 17 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 2 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 45 46 1 0 0 0 0 M CHG 1 45 1 M END