IFLAB-ZINC04072134 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 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 -1.3390 -0.4990 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 -1.8460 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7760 -2.3930 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9420 -3.7600 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8240 -4.5980 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 -4.0440 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3830 -2.6760 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9970 -6.0630 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1140 -6.5430 -0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9180 -6.8700 -0.0260 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0810 -8.2480 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2170 -8.8870 -0.0240 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1810 -10.1470 -0.0300 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0100 -10.7200 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 -9.4480 -0.0570 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.7530 -12.1760 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8190 -13.0760 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5720 -14.4330 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2710 -14.9030 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 -14.0180 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 -12.6560 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8920 -11.5450 -0.0870 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6400 -1.7450 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9360 -4.1840 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3260 -4.6880 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6080 -2.2480 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -6.4870 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8360 -12.7110 -0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3970 -15.1310 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 -15.9670 -0.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8040 -14.3910 -0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 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 31 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 33 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 34 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 M END