IBS-ZINC02342866 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 0 0 0 0 0 0999 V2000 0.0050 1.5030 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -0.0040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7790 -0.6910 0.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 -2.0720 0.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 -2.7710 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7180 -2.0780 -0.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7320 -0.6960 -0.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5640 0.0570 -1.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.1700 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1810 -4.8480 1.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 -4.2510 2.1930 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3160 -6.3490 1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4340 -6.8440 2.4940 N 0 3 0 0 0 0 0 0 0 0 0 0 1.5840 -7.0960 3.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2860 -7.5390 4.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0900 -7.5450 4.4720 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5730 -7.1030 3.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0880 -7.0720 3.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4290 -7.1500 4.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1800 -7.8630 5.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2470 -7.9360 5.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6180 -7.7780 5.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5100 -8.1500 6.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0480 -8.6800 7.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6890 -8.8400 7.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7870 -8.4660 6.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1770 -9.1470 8.6290 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.8000 1.8770 -0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.8590 -0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1610 1.8630 1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 -0.1480 1.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3890 -2.6080 1.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3020 -2.6180 -1.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 0.2490 -2.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4380 -0.5380 -2.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8870 1.0040 -1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 -4.6510 -0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5650 -6.7880 0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -6.6280 0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5750 -6.9700 2.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4620 -6.1420 2.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5010 -7.9310 2.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5440 -6.1530 5.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3240 -7.7490 5.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3360 -8.9410 5.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9510 -7.4730 6.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9800 -7.3650 4.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5710 -8.0270 6.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3350 -9.2540 8.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7280 -8.5870 6.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 17 2 0 0 0 0 14 15 2 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 21 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 50 1 0 0 0 0 M CHG 1 13 1 M END