IFLAB-ZINC04569423 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 0.2310 1.2480 0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 -0.1800 0.2000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9880 -0.7930 0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0680 -2.1770 0.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3020 -2.7980 0.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4560 -2.0410 0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3780 -0.6610 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1480 -0.0350 0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0270 -2.8350 0.0180 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.9200 -1.9180 -0.6000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7970 -4.1480 -0.4760 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5440 -3.0090 1.5820 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2460 -1.9820 2.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9550 -2.3520 3.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9870 -3.9020 3.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3830 -4.2140 2.4090 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.3240 -4.4530 2.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1240 -5.3880 1.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5200 -5.0140 1.5300 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.3930 -5.9280 1.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0030 -7.0370 0.7500 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.8240 -5.5830 0.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7480 -6.5590 0.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0820 -6.2310 0.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5060 -4.9380 0.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5960 -3.9650 1.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2580 -4.2820 1.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1380 -2.3460 1.3630 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2590 1.6080 0.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 1.5860 -0.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3250 1.6400 1.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1670 -2.7700 0.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3650 -3.8760 0.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2810 -0.0710 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0880 1.0430 0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8520 -0.9920 2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3180 -2.0190 2.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9730 -1.9920 4.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7340 -1.9690 4.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3760 -4.3290 4.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0120 -4.2690 3.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6500 -5.6420 0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0860 -6.2500 2.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8170 -4.1080 1.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4180 -7.5680 0.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7970 -6.9850 0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5520 -4.6870 0.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5490 -3.5240 1.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 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 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 2 0 0 0 0 20 22 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 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 48 1 0 0 0 0 M END