IFLAB-ZINC04503825 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 0 0 0 0 0999 V2000 -0.3520 0.9900 2.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 -0.4040 1.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5030 -0.7630 1.1880 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5810 -1.9820 0.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4730 -2.8130 0.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 -4.0520 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7390 -4.4650 -0.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8490 -3.6420 -0.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7770 -2.4000 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9020 -1.5660 0.0420 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1380 -2.0970 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2810 -3.3020 -0.0500 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3420 -1.1950 -0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8430 -2.2010 -0.2400 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.0580 -0.9280 -0.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3450 -1.2530 -0.4250 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.2710 -0.2960 -0.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6310 -0.6290 -0.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5580 0.3690 -0.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1380 1.7060 -0.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8230 2.0060 -0.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8900 1.0180 -0.4740 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.5790 1.3240 -0.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2220 2.4900 -0.3600 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6780 0.3470 -0.3060 N 0 0 0 0 0 0 0 0 0 0 0 0 -15.0240 0.0370 -0.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 1.2640 2.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6160 1.7130 1.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1200 0.9860 3.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 -0.4000 0.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -1.1270 2.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 -2.4930 1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3110 -4.6980 -0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7980 -5.4340 -1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7740 -3.9670 -1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7920 -0.6060 0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3890 -0.5620 0.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2610 -0.5700 -1.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9400 -1.6630 -0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8680 2.5000 -0.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5100 3.0400 -0.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.4520 -0.0400 0.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.5370 0.8220 -1.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.1450 -0.9140 -1.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 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 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 25 2 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 26 1 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 M END