IBS-ZINC05309701 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 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 -0.6740 -9.2520 -1.2460 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6480 -9.4960 -4.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7930 -10.6000 -1.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2300 -10.8720 -2.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3600 -9.6460 -3.2900 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4380 -12.1860 -3.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2040 -13.1910 -2.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7740 -12.8550 -0.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5830 -11.6000 -0.4990 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4490 -14.8540 -2.5540 Cl 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 -1.7740 -12.4210 -4.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5930 -13.6390 -0.1290 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 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 4 5 1 0 0 0 0 4 25 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 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 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 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 23 2 0 0 0 0 18 19 1 0 0 0 0 18 20 2 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 35 1 0 0 0 0 25 36 1 0 0 0 0 25 37 1 0 0 0 0 25 38 1 0 0 0 0 M END