IFLAB-ZINC04167015 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 31 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 1.0600 -0.5960 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 -0.6940 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1360 -2.1590 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5710 -2.6880 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5510 -4.1950 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1820 -4.9190 0.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9210 -6.6250 0.5760 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -6.1770 -0.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9170 -4.8790 -0.9200 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3110 -7.1240 -1.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4300 -8.5050 -1.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 -9.3480 -2.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0880 -8.8040 -3.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -7.4980 -3.6800 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5750 -6.6550 -2.8520 C 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 -2.0020 -0.2200 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6260 -2.5100 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6090 -2.5200 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0820 -2.3370 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0980 -2.3270 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7540 -4.5260 1.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9960 -8.9030 -0.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8740 -10.4200 -2.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4020 -9.4600 -4.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4790 -5.5920 -3.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 22 1 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 6 25 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 15 16 2 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 17 30 1 0 0 0 0 M END