IFLAB-ZINC04275242 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 -0.0240 1.5030 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 -0.6150 1.0440 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 -0.6730 -1.1630 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1940 -2.1410 -1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5630 -2.5390 -1.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8500 -1.7210 -2.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2180 -0.5800 -3.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8190 0.0840 -4.8100 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.9250 -1.1930 -5.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8420 -2.0840 -3.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6520 -3.2610 -3.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2940 -4.1950 -3.8310 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7930 -1.3120 -6.0990 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7970 -0.3750 -7.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0400 0.5750 -7.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7130 -0.5000 -8.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7180 0.4370 -9.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6380 0.3110 -10.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5110 -0.7790 -10.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3710 -0.8900 -11.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3740 0.0740 -12.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5140 1.1550 -12.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6500 1.2840 -11.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5770 2.6460 -11.2260 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.1320 0.0420 -2.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9790 1.8840 -0.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7030 1.8590 -0.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3660 1.8550 0.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 -2.5450 -1.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0830 -2.5320 -0.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5590 -3.6000 -2.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3310 -2.3450 -0.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3970 -2.0690 -6.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3860 -1.3430 -8.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0450 1.2800 -9.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5100 -1.5320 -9.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0450 -1.7320 -11.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0500 -0.0190 -13.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5220 1.9030 -13.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3540 1.0960 -2.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8300 -0.0580 -2.9510 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 4 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 12 13 3 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 M END