IBS-ZINC02221459 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -0.4900 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7040 -1.1740 -1.1400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2310 -0.1640 -2.4560 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9170 -0.6370 -3.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1770 -0.1300 -4.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8930 -0.6230 -6.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1530 -0.1160 -7.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 -0.6100 -8.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 -0.1110 -9.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8500 0.5700 -9.7550 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7110 -0.4890 1.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 -1.2810 2.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0920 -1.6050 1.9210 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8370 -1.7360 3.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 -2.5550 4.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0250 -2.9560 5.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3480 -2.5510 5.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9290 -1.7430 4.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1810 -1.3230 3.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7210 -0.5280 2.4160 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0470 -0.1390 1.3950 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 0.3830 -2.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9390 -0.2590 -3.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9310 -1.7260 -3.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8460 -0.5070 -4.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 0.9600 -4.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9150 -0.2460 -6.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9080 -1.7130 -6.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8700 -0.4940 -7.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 0.9740 -7.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8920 -0.2320 -8.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8840 -1.7000 -8.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7610 -2.8720 4.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5870 -3.5900 6.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9280 -2.8740 6.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9580 -1.4350 4.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 -0.4220 -11.1040 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -0.0790 -11.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 14 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 2 0 0 0 0 12 43 1 0 0 0 0 14 15 1 0 0 0 0 14 24 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 43 44 1 0 0 0 0 M END