IBS-ZINC02221134 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 0 0 0 0 0 0999 V2000 -0.0320 2.2780 2.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0870 0.7830 2.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7680 0.0100 3.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5140 -1.4710 2.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6080 -1.9370 2.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8140 -3.3040 2.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1280 -4.1620 2.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 -5.6240 2.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4610 -5.8420 3.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8480 -7.1660 3.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0720 -8.1490 3.3430 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0450 -7.8950 2.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4480 -6.6660 2.4420 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0190 -7.4490 4.4780 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2180 -8.8980 4.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3820 -9.1710 5.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0450 -8.7010 6.8670 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1750 -6.8130 3.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3930 -7.4360 2.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2860 -7.1190 1.6050 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0070 -4.6480 3.8650 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 -3.6250 3.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3930 -2.3110 3.4910 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6160 -1.0020 1.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4380 0.3190 2.2130 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4390 0.5420 0.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 2.6240 2.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 2.8260 1.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4130 2.4480 3.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8220 0.2170 2.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 0.3240 4.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6850 -3.6930 1.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6470 -8.7220 2.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -9.3570 4.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4440 -9.3210 3.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5760 -10.2430 5.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2720 -8.6530 5.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7390 -8.8420 7.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9880 -5.7450 3.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0630 -6.9660 4.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3100 -7.0390 2.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4770 -8.5180 2.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3200 -7.5440 0.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4880 -0.9900 0.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6220 -1.3480 1.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4700 0.8890 0.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3980 -0.5240 0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 1.0880 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 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 5 1 0 0 0 0 4 23 2 0 0 0 0 5 6 2 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 22 2 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 M END