IBS-ZINC02265144 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 -0.0200 1.5030 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.0040 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 -0.6770 -0.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1790 -2.0580 -0.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7710 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1220 -2.0930 0.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1360 -0.7110 0.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5500 -2.9800 0.7730 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.1710 -0.0190 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3420 -4.8450 -1.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6330 -4.2410 -2.1250 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4290 -6.3490 -1.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9930 -6.9540 -2.6940 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.0030 -8.6880 -2.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6730 -9.2810 -1.2560 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7940 -10.5550 -1.3760 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2070 -10.8540 -2.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3590 -9.6660 -3.2660 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8070 -9.4900 -4.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6150 -9.5170 -5.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5800 -10.3620 -6.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4660 -12.2080 -3.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2710 -13.3220 -2.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -14.5830 -2.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9530 -14.6930 -4.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1260 -13.5480 -4.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8890 -12.3570 -4.3670 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4400 -2.7900 -0.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3230 1.8660 -0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7280 1.8530 0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9750 1.8790 0.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0430 -0.1220 -0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0360 -0.1820 0.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3610 -4.6560 0.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5540 -6.7660 -0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1350 -6.6570 -0.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4910 -10.2960 -4.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3200 -8.5330 -4.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2100 -8.8390 -5.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4050 -11.0400 -6.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2740 -10.3810 -7.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9320 -13.2000 -1.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 -15.4630 -2.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1540 -15.6640 -4.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4630 -13.6320 -5.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0420 -2.9660 0.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1810 -3.7440 -1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0080 -2.1880 -1.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 32 1 0 0 0 0 4 5 1 0 0 0 0 4 28 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 8 1 0 0 0 0 7 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 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 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 26 2 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 M END