IFLAB-ZINC04032876 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 -0.6180 1.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 0.1500 2.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8370 -0.4500 3.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9010 -1.8470 3.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5680 -2.5190 4.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5990 -3.8760 4.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9970 -4.6110 3.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0360 -5.8290 3.2880 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -4.0030 2.2260 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9760 -4.5400 1.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3140 -2.6280 2.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6720 -2.0000 1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2790 -4.5990 5.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2420 -4.9740 6.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9040 -5.6770 7.5920 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1830 -6.1060 8.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9870 -5.9100 8.6840 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8630 -6.8300 9.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8420 -7.1990 10.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6370 -6.3870 11.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6970 -6.7120 12.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 -7.8510 12.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1410 -8.7140 11.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0930 -8.3810 10.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 -9.2410 9.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5280 -10.3770 9.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4110 -10.7020 10.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6040 -9.8990 11.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1590 1.2280 1.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2860 0.1520 3.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0280 -1.9480 5.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 -2.5880 0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7540 -5.5040 5.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0350 -3.9510 5.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7670 -4.0700 6.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4870 -5.6230 6.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8610 -5.8340 7.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3380 -7.7340 9.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6190 -6.1810 10.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2110 -5.4780 11.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5540 -6.0500 13.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7670 -8.0900 13.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9970 -9.0020 8.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 -11.0360 8.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9880 -11.6090 10.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3350 -10.1640 12.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 14 2 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 13 2 0 0 0 0 7 8 2 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 15 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 2 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 M END