IFLAB-ZINC04940665 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 0 0 0 0 0 0999 V2000 -0.0220 1.4560 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 0.0720 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -0.6050 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3670 0.0990 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3910 1.5000 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 2.1690 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7580 2.0380 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9580 3.2370 -0.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7770 1.1670 -0.0420 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0800 -0.3520 -0.0470 S 0 0 0 0 0 0 0 0 0 0 0 0 4.3530 -0.9440 -1.3090 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3740 -0.9620 1.2030 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2070 1.4830 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6900 1.7040 1.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1620 2.0280 1.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7650 2.0780 0.3230 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8080 2.2640 2.5330 N 0 0 0 0 0 0 0 0 0 0 0 0 10.1930 2.4730 2.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7970 3.1330 1.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1640 3.3380 1.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9330 2.8870 2.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3370 2.2280 3.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9670 2.0240 3.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3800 1.3810 4.6460 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9190 4.1640 0.1480 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9640 1.9830 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9440 -0.4770 -0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 -1.6850 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1290 3.2490 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7590 0.6550 -0.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3760 2.3880 -0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1390 2.5320 1.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5220 0.7990 1.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3140 2.2880 3.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1990 3.4860 0.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0010 3.0490 2.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9400 1.8760 4.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3260 0.4220 4.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 34 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 25 1 0 0 0 0 21 22 2 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 24 38 1 0 0 0 0 M END