IFLAB-ZINC05143642 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 45 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3790 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 1.2060 -0.6850 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 0.0150 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3840 1.4090 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 2.0890 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6590 2.1660 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8000 1.4960 -0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9700 2.1350 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9690 3.5310 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7330 4.2020 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6170 3.4940 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0180 5.5560 -0.0170 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3560 5.7100 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9380 6.7780 -0.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9530 4.5020 -0.0400 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9100 4.3420 -0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0730 6.5930 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7170 6.2970 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7860 7.3170 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2020 8.6390 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5620 8.9390 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4950 7.9160 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7090 10.2960 0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4370 10.8200 0.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4970 9.8090 0.0370 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2450 1.3800 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3040 1.9760 -0.0650 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2290 0.0320 -0.0640 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9080 -0.8410 -0.0380 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -0.5550 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 -1.7650 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 3.1690 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3900 5.2680 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 7.0840 0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5500 8.1460 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4180 10.9450 1.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2250 11.7650 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3840 -0.4430 -0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0640 -0.4620 -0.0740 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 10 11 2 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 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 26 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 37 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 40 1 0 0 0 0 29 41 1 0 0 0 0 M END