IFLAB-ZINC04338382 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7530 1.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.0780 0.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -2.4400 -0.7460 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -0.7260 -1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0310 -0.1640 -2.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0510 1.1530 -2.6530 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0750 1.7040 -3.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0790 0.8640 -4.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -0.5280 -4.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -0.9950 -3.5410 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0670 -1.1130 -6.0310 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0930 -0.1350 -6.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1070 -0.3120 -8.1610 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1010 1.0680 -6.3500 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1190 1.9290 -6.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0510 -2.4910 -6.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2430 -3.1910 -6.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2250 -4.5480 -6.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 -5.2120 -6.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 -4.5210 -6.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 -3.1590 -6.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3330 -2.4770 -6.3420 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5380 -3.2270 -6.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0980 3.1760 -4.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1200 3.6640 -5.1430 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 3.9740 -2.9440 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -0.3040 2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -2.8140 1.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1850 -2.6750 -6.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1540 -5.0920 -6.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 -6.2730 -7.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1100 -5.0430 -6.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3960 -2.5640 -6.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5860 -4.0110 -5.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5490 -3.6780 -7.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 3.5840 -2.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 4.9380 -3.0510 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 2 6 2 0 0 0 0 3 4 2 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 6 7 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 26 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 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 22 2 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 41 1 0 0 0 0 28 42 1 0 0 0 0 M END