IBS-ZINC06758995 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 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 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0640 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8200 -4.0190 -0.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2220 -4.5450 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5660 -5.7760 -0.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7320 -6.4180 -1.2920 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8230 -6.2440 -0.5500 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0620 -7.0940 -0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7500 -5.5460 0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8780 -5.9880 0.2330 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4470 -4.3640 0.6980 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1760 -3.8490 0.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8750 -2.6370 1.1610 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4620 -2.2500 1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4290 -3.6550 1.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6000 -3.8700 2.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5690 -3.1710 3.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3680 -2.2560 2.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2000 -2.0400 1.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2290 -2.7320 0.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0420 -2.4910 -0.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0740 -1.0430 0.7220 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -2.4150 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 -2.4250 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1740 -4.5200 0.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4560 -4.2190 -1.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5800 -2.0490 1.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3890 -1.1810 1.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9980 -2.8070 2.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9760 -4.5850 3.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7020 -3.3380 4.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1260 -1.7110 3.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6800 -3.1730 -1.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3120 -1.4620 -0.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0000 -2.6640 -1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6040 -0.0600 0.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2030 -1.3520 -0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0470 -0.9950 1.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7910 -2.5720 0.0150 N 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 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 4 48 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 5 48 1 0 0 0 0 6 7 1 0 0 0 0 6 14 2 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 16 48 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 24 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 23 44 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 M END