IBS-ZINC03021050 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 39 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 0 0 0 0 0 0 0 0 0 0 0.7040 -0.4850 1.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 -1.8150 1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3350 -2.5530 0.4930 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5270 -2.3880 2.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 -3.8510 2.4450 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0920 -4.5830 3.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6340 -4.0300 4.3480 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0730 -6.0880 3.3380 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0410 -6.4380 3.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7750 -6.5430 2.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0910 -5.9870 2.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7680 -6.6450 4.5010 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4710 -7.8860 4.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6260 -8.5440 4.3570 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1730 -8.4480 6.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8680 -9.7340 6.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5270 -10.2530 7.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4880 -9.5010 8.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7960 -8.2260 7.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1480 -7.6980 6.7650 C 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 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5600 -2.0380 2.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0270 -2.0640 3.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -4.2930 1.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8400 -7.6310 2.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2080 -6.2030 1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5960 -6.2340 1.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4430 -6.1200 4.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1170 -10.3210 6.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2920 -11.2470 8.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0010 -9.9120 9.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5470 -7.6450 8.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3920 -6.7040 6.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 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 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 14 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 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 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 M END