IBS-ZINC01816817 MOE2007 3D CORINA 3.40 0006 02.08.2006 68 70 0 0 1 0 0 0 0 0999 V2000 -0.8310 1.2350 3.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7730 -0.2680 3.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5600 0.0080 1.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 0.1480 -0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8840 -1.9210 1.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3640 -2.2880 1.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5390 -3.7160 1.4820 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4790 -4.8010 2.4690 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4970 -4.8250 2.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7200 -6.0810 1.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7550 -7.4390 2.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5150 -8.2320 2.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 -9.5740 2.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0860 -9.9100 2.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6150 -8.8140 2.2420 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5740 -8.7810 2.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 -7.8030 2.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1270 -6.4330 1.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4900 -11.2130 3.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2310 -12.1100 3.4430 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8180 -11.4170 2.9310 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3170 -12.7310 3.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5340 -10.4670 3.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8080 -7.9110 2.6440 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8960 -5.7340 0.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1380 -6.5940 -0.6090 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7880 -4.2660 0.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9040 -3.6460 -0.7600 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5500 -4.6110 3.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2400 -4.7500 4.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2200 -4.5770 5.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5160 -4.2630 5.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8240 -4.1240 4.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8400 -4.2930 3.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4810 -4.0920 6.3680 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7930 -3.7700 5.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8830 1.4060 4.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 1.7130 3.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7150 1.6580 3.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 -0.6920 3.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6670 -0.7460 3.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3640 -0.6890 1.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7840 0.9810 1.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4390 0.7580 -0.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3280 0.6240 -0.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3170 -0.8390 -0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2970 -2.5250 2.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 -2.1110 0.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7040 -2.0700 2.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9480 -1.7060 1.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2360 -5.7500 2.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0680 -6.4880 0.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 -6.0690 0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3980 -12.7600 3.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0810 -12.9340 4.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8480 -13.4850 2.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9400 -11.0000 2.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1600 -11.1850 3.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3170 -9.8600 3.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2370 -6.1670 -1.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2310 -4.9950 5.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9770 -4.6860 6.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8320 -3.8800 3.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0780 -4.1800 2.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4650 -3.6610 6.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7600 -2.8350 5.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1540 -4.5690 5.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7040 -0.4980 1.9440 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 40 1 0 0 0 0 2 41 1 0 0 0 0 2 68 1 0 0 0 0 3 4 1 0 0 0 0 3 42 1 0 0 0 0 3 43 1 0 0 0 0 3 68 1 0 0 0 0 4 44 1 0 0 0 0 4 45 1 0 0 0 0 4 46 1 0 0 0 0 5 6 1 0 0 0 0 5 47 1 0 0 0 0 5 48 1 0 0 0 0 5 68 1 0 0 0 0 6 7 1 0 0 0 0 6 49 1 0 0 0 0 6 50 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 29 1 0 0 0 0 10 11 1 0 0 0 0 10 25 2 0 0 0 0 11 12 1 0 0 0 0 11 24 2 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 23 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 51 1 0 0 0 0 18 52 1 0 0 0 0 18 53 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 22 54 1 0 0 0 0 22 55 1 0 0 0 0 22 56 1 0 0 0 0 23 57 1 0 0 0 0 23 58 1 0 0 0 0 23 59 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 60 1 0 0 0 0 27 28 2 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 61 1 0 0 0 0 31 32 1 0 0 0 0 31 62 1 0 0 0 0 32 33 2 0 0 0 0 32 35 1 0 0 0 0 33 34 1 0 0 0 0 33 63 1 0 0 0 0 34 64 1 0 0 0 0 35 36 1 0 0 0 0 36 65 1 0 0 0 0 36 66 1 0 0 0 0 36 67 1 0 0 0 0 M END