IBS-ZINC02232976 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 29 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4480 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6180 -0.6110 1.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 0.0490 1.9050 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 -2.1150 1.0880 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1990 -2.4930 0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 -2.6820 1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6850 -4.1860 1.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3830 -4.7480 0.9920 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8510 -2.5420 2.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5560 -2.9700 3.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8630 -4.2350 3.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5140 -4.1770 4.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5660 -2.8800 5.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9890 -2.1530 4.3040 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8250 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8090 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7990 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2330 -2.3760 2.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3050 -2.3030 0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1840 -1.5430 1.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0850 -3.2420 1.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6530 -5.1250 3.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8970 -5.0130 5.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0010 -2.4880 6.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8200 -4.9030 1.0750 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4000 -2.5290 2.2990 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 -1.9360 3.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7320 -5.8650 1.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 27 1 0 0 0 0 7 8 1 0 0 0 0 7 19 1 0 0 0 0 7 20 1 0 0 0 0 8 9 2 0 0 0 0 8 26 1 0 0 0 0 10 11 1 0 0 0 0 10 21 1 0 0 0 0 10 22 1 0 0 0 0 10 27 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 23 1 0 0 0 0 13 14 2 0 0 0 0 13 24 1 0 0 0 0 14 15 1 0 0 0 0 14 25 1 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 M END