IBS-ZINC04802441 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 1 0 0 0 0 0999 V2000 -0.1440 1.6070 0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 0.0840 0.0770 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4530 -0.1920 -0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8090 -0.4310 1.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9050 -1.9570 1.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5060 -2.5510 1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3050 -1.9750 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2450 0.0630 -0.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6810 -0.2600 -0.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9490 -0.9080 0.4170 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7180 0.1910 -1.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5770 0.9300 -2.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7890 1.1670 -3.1190 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9430 1.6680 -3.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7840 0.5990 -2.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1660 -0.0410 -1.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9360 -0.7110 -0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3070 -0.7450 -0.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9190 -0.1160 -1.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1690 0.5570 -2.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8510 2.0420 0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6250 1.9860 -0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7410 1.8780 1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8090 0.0000 1.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3350 -0.1440 2.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4140 -2.2430 0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4640 -2.3310 2.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 -3.6340 1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0010 -2.2970 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8180 -2.2400 -0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3150 -2.3850 0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9870 -0.3570 -1.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1130 1.1450 -0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6380 1.2680 -2.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4610 -1.2010 0.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9080 -1.2630 0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9940 -0.1500 -1.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6560 1.0420 -3.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3690 -0.5130 0.1320 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 39 1 0 0 0 0 4 5 1 0 0 0 0 4 24 1 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 6 29 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 8 39 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 38 1 0 0 0 0 M END