IBS-ZINC02276893 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 0 0 0 0 0 0999 V2000 -0.0140 1.5030 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 -0.0040 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.6990 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 -2.0810 1.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7680 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -2.0730 -1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 -0.6910 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -4.5300 -0.0220 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -4.9200 -1.2790 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -4.9280 1.2200 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5110 -5.0420 -0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3150 -4.7770 -1.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9120 -4.0850 -1.9730 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5650 -5.2800 -1.0920 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4300 -5.0990 -2.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7030 -6.4790 -2.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1060 -7.4570 -1.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7880 -8.6020 -2.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1800 -9.5470 -1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8890 -9.3520 0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2140 -8.2110 0.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8270 -7.2620 -0.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1160 -6.0340 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2660 -10.2760 1.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9310 -10.0070 2.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8470 -10.6620 -1.6660 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1100 -10.7940 -3.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0090 1.8800 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.8630 -0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5240 1.8570 0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 -0.1620 2.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6240 2.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.6100 -2.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -0.1480 -2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8550 -5.5320 0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3690 -4.6350 -1.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9260 -4.4720 -3.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5050 -6.3990 -3.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8010 -6.8400 -3.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0130 -8.7530 -3.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9860 -8.0570 1.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3060 -6.3310 0.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8210 -5.4060 0.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2880 -10.8210 2.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8490 -9.9190 2.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4010 -9.0740 2.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6470 -11.7260 -3.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7170 -9.9540 -3.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1680 -10.8040 -3.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 23 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 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 40 1 0 0 0 0 19 20 1 0 0 0 0 19 26 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 M END