IBS-ZINC02262480 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 1 0 0 0 0 0999 V2000 0.2860 -3.5270 0.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 -2.1720 0.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -0.9270 0.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0520 0.0490 -0.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 1.4590 -0.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2070 2.1510 -1.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1780 1.4450 -2.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0900 0.0470 -2.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -0.6320 -1.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -1.9780 -1.0890 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -3.0320 -2.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2920 3.5130 -1.2710 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3840 4.2710 -2.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -0.6600 2.3600 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2800 -1.5560 2.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4210 -0.2120 2.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1380 -0.4910 5.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7730 0.2550 6.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7640 1.3800 6.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8600 2.3290 5.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2180 1.5820 4.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3310 2.1210 8.0740 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2250 1.7370 9.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5030 1.4360 8.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0550 0.8040 7.1850 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8910 0.3760 2.7430 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6690 -4.0600 0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0290 -4.1210 0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 -3.4620 1.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1670 2.0220 0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2240 1.9490 -3.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0680 -0.4870 -3.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4120 -3.9280 -1.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5140 -2.7140 -2.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0970 -3.2330 -2.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2870 4.0120 -3.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4560 5.3270 -2.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5150 4.1480 -3.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1320 -1.0360 2.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8530 0.5380 2.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1080 -0.9950 5.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 -1.2310 5.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2440 0.6600 6.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7610 -0.4540 7.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 2.8660 5.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6220 3.0950 5.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1750 2.2600 3.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2110 1.1220 4.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3250 2.5360 9.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8180 0.8430 9.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0340 2.3530 8.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1790 0.7800 8.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7200 0.1850 2.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 0.4810 4.2240 N 0 3 0 0 0 0 0 0 0 0 0 0 0.2740 0.9090 4.0910 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 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 14 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 30 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 7 8 2 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 26 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 16 54 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 54 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 19 25 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 21 54 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 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 24 52 1 0 0 0 0 26 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END