IFLAB-ZINC04337313 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3700 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 1.2640 -0.5270 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4320 0.7880 -0.0170 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 1.9550 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5920 -1.9560 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7020 -2.7850 -0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8810 -2.3510 -0.0380 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0780 -1.4820 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1770 -2.4170 -0.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8180 -3.6960 -0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3810 -3.7360 -0.0440 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0360 -4.2480 -0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8740 -4.4730 1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3520 -3.7890 2.4010 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0260 -4.2640 3.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3380 -5.2580 3.7200 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5140 -3.5660 4.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2030 -2.5720 4.7490 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1890 -4.0410 6.0670 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6660 -3.3580 7.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1670 -4.0840 8.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9220 -5.0990 9.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4640 -5.7660 10.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2500 -5.4170 10.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4950 -4.4010 10.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9560 -3.7310 9.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6740 -6.2540 12.1430 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9360 1.9380 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8920 -0.6100 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3500 3.0220 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9280 -0.6240 -0.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3260 -1.1580 0.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.4550 -1.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1640 -2.1040 -0.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7840 -4.4830 1.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2470 -5.4970 1.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9020 -2.9950 2.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6380 -4.8360 6.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7560 -3.3470 7.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2940 -2.3330 7.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8690 -5.3720 8.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0530 -6.5590 10.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5470 -4.1280 10.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3690 -2.9350 8.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 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 28 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 27 45 1 0 0 0 0 M END