IBS-ZINC02090678 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 56 0 0 1 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 3 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -0.5030 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0220 -0.4740 1.3840 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3420 -1.0000 2.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5510 -1.2100 3.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5500 -1.7760 4.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3590 -2.1480 5.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 -1.9510 4.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1360 -1.3760 3.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1350 -1.0440 2.3200 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3030 -1.2410 2.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7070 -2.6200 1.9930 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3940 -2.7190 0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2260 -2.7770 2.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6240 -4.0470 1.4740 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7240 -5.2520 2.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5030 -5.6040 3.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6830 -6.9090 3.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0830 -7.8800 2.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3070 -7.5510 1.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1300 -6.2360 1.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2790 -5.5620 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9590 -4.2130 0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0180 -3.3240 -0.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3910 -3.7710 -2.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7110 -5.1040 -2.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6500 -6.0020 -1.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0750 -3.6330 2.7790 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6710 -0.4650 -1.1740 O 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 4.4830 -0.9250 2.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4860 -1.9360 5.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3760 -2.5950 6.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -2.2420 4.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5360 -1.1740 3.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8530 -0.4710 1.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5290 -2.7670 3.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7090 -1.9530 1.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1900 -4.8550 4.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5100 -7.1760 4.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2200 -8.9000 3.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6200 -8.3090 0.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7720 -2.2830 -0.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4360 -3.0760 -3.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0020 -5.4420 -3.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9010 -7.0390 -1.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3080 -3.6050 3.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5880 -0.1670 -1.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 31 1 0 0 0 0 4 5 2 0 0 0 0 4 12 1 0 0 0 0 5 6 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 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 30 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 25 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 28 2 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 31 52 1 0 0 0 0 M END