IFLAB-ZINC04519444 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9340 -0.8320 -0.0390 S 0 0 0 0 0 0 0 0 0 0 0 0 4.8490 0.0740 0.5610 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6410 -2.0850 0.5630 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3120 -1.0450 -1.8010 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4750 -0.0690 -2.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5750 -1.8950 -1.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6970 -1.2260 -1.2880 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9190 -1.7950 -1.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0900 -2.8640 -1.8460 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0480 -1.1200 -0.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8520 -0.2230 -1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9080 0.4040 -0.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1720 0.1460 0.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3830 -0.7400 1.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3190 -1.3710 0.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5450 -2.2310 1.4230 F 0 0 0 0 0 0 0 0 0 0 0 0 9.5960 0.0290 -2.6380 F 0 0 0 0 0 0 0 0 0 0 0 0 3.1580 -1.7340 -2.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4470 -1.2260 -3.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4320 -2.0430 -3.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3190 -3.2150 -3.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5490 -3.3330 -2.0770 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4130 -2.8710 -1.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8020 -2.0240 -3.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5600 -0.3730 -0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5300 1.0970 -1.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0000 0.6400 1.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5960 -0.9360 2.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6470 -0.2510 -3.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7800 -1.7540 -4.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5880 -3.9760 -3.5570 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 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 31 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 24 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 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 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 38 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 24 25 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 40 1 0 0 0 0 26 27 2 0 0 0 0 26 41 1 0 0 0 0 27 28 1 0 0 0 0 27 42 1 0 0 0 0 M END