IBS-ZINC04956518 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 1 0 0 0 0 0999 V2000 -2.0340 3.1880 -0.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4970 1.7800 -0.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9430 1.2360 0.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 -0.0550 0.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5120 -0.8030 -0.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0670 -0.2600 -1.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5630 1.0300 -1.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 -2.4490 -0.5730 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4270 -2.7420 -1.9290 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0700 -2.5280 0.4770 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1290 -3.4550 -0.1510 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3010 -3.5760 -1.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1110 -4.8100 -0.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3350 -4.9350 -1.5280 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.9090 -4.0090 -1.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8850 -5.1970 -2.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0130 -6.2360 -3.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6010 -6.4760 -4.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0610 -5.6780 -5.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9340 -4.6400 -5.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3500 -4.4020 -3.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1970 -6.0770 -1.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5450 -5.8750 -0.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3370 -6.9210 -0.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7790 -8.1740 -0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4260 -8.3740 -0.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6390 -7.3270 -0.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5560 -9.2040 0.2400 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9600 -8.9580 0.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7220 -10.2760 0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2710 -8.3470 1.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2400 3.8830 -0.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8530 3.2740 -1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3960 3.4260 0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8950 1.8210 1.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -0.4800 1.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1140 -0.8440 -2.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0000 1.4530 -2.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0820 -3.9650 0.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9220 -2.6850 -0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9760 -3.6760 -2.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4900 -5.7000 -0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4360 -4.7090 0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6530 -6.8590 -2.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9190 -7.2870 -4.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7380 -5.8650 -6.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2940 -4.0160 -6.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0350 -3.5940 -3.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9790 -4.8990 -0.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3900 -6.7620 -0.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9890 -9.3490 -0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5870 -7.4840 -1.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2660 -8.2660 -0.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4150 -10.9670 0.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7920 -10.0880 0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5000 -10.7110 -0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9640 -9.0380 2.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7280 -7.4080 1.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3420 -8.1590 1.7900 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 22 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 53 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 31 59 1 0 0 0 0 M END