IBS-ZINC04301893 MOE2007 3D CORINA 3.40 0006 02.08.2006 73 76 0 0 1 0 0 0 0 0999 V2000 0.6230 0.9300 0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1490 -0.5000 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3140 -0.5940 0.0450 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0550 -0.4530 -1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3170 -1.8120 -1.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9570 -0.7990 1.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3440 -0.9990 1.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0000 -1.1990 2.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2920 -1.2160 3.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9110 -1.0130 3.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2680 -0.8150 2.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0530 -1.4190 5.0880 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.9540 -1.9950 4.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4870 -0.0620 5.7190 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.1070 0.4460 4.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3210 0.8940 6.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8110 2.2000 6.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6800 1.9600 7.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8330 1.0170 7.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3780 -0.3100 6.9560 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.6670 -1.2110 7.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2290 -2.5270 7.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8200 -3.6290 5.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3480 -3.7460 5.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8420 -2.7850 6.5820 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6680 -4.9050 5.6630 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7360 -5.0520 6.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9380 -6.3200 6.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3870 -7.5480 6.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0680 -7.3320 5.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2280 -6.0450 4.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5420 -1.0110 6.5010 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7110 0.9880 0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1740 1.6100 -0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3600 1.2960 1.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 -0.8150 -1.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6530 -1.1930 0.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9870 0.1070 -1.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4690 0.1480 -1.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3780 -2.3380 -2.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9230 -2.4530 -1.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8470 -1.6890 -2.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9690 -1.0080 0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0810 -1.3390 2.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -0.9830 4.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1940 -0.6530 2.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6040 0.4160 6.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7700 1.1560 5.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9500 2.8210 6.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3830 2.7650 5.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0700 1.5520 8.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0780 2.9170 8.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4130 0.8220 8.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5320 1.5200 6.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7940 -0.7120 8.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3470 -1.4410 8.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6290 -3.1020 8.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0850 -3.1340 7.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9290 -3.6560 4.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4030 -4.4370 6.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3280 -5.0970 5.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0820 -4.1830 6.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0040 -6.4610 7.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4250 -6.2120 7.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9950 -7.7500 5.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4620 -8.4280 6.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4170 -8.1870 5.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6950 -7.2790 6.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2820 -5.8900 4.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6860 -6.1190 3.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2700 -0.8520 7.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3660 -2.2870 6.1370 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.5090 -1.7980 6.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 8 44 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 45 1 0 0 0 0 11 46 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 72 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 20 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 17 18 1 0 0 0 0 17 49 1 0 0 0 0 17 50 1 0 0 0 0 18 19 1 0 0 0 0 18 51 1 0 0 0 0 18 52 1 0 0 0 0 19 20 1 0 0 0 0 19 53 1 0 0 0 0 19 54 1 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 21 22 1 0 0 0 0 21 55 1 0 0 0 0 21 56 1 0 0 0 0 22 57 1 0 0 0 0 22 58 1 0 0 0 0 22 72 1 0 0 0 0 23 24 1 0 0 0 0 23 59 1 0 0 0 0 23 60 1 0 0 0 0 23 72 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 31 1 0 0 0 0 27 28 1 0 0 0 0 27 61 1 0 0 0 0 27 62 1 0 0 0 0 28 29 1 0 0 0 0 28 63 1 0 0 0 0 28 64 1 0 0 0 0 29 30 1 0 0 0 0 29 65 1 0 0 0 0 29 66 1 0 0 0 0 30 31 1 0 0 0 0 30 67 1 0 0 0 0 30 68 1 0 0 0 0 31 69 1 0 0 0 0 31 70 1 0 0 0 0 32 71 1 0 0 0 0 72 73 1 0 0 0 0 M CHG 1 72 1 M END