IBS-ZINC06661156 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 1 0 0 0 0 0999 V2000 -0.8750 1.2520 -0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 -0.1540 -0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2330 -0.9660 1.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2390 -2.1800 0.5910 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4450 -2.9670 1.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3950 -2.1810 -0.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -0.9220 -1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -0.6570 -2.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -1.6620 -3.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9090 -2.9080 -2.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8510 -3.1910 -1.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5650 -1.3400 -4.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 -0.1820 -5.2940 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3670 -2.3940 -5.8040 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4310 -2.2420 -7.2500 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1300 -1.3330 -7.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8710 -2.0350 -7.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2340 -3.4400 -7.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5150 -3.3030 -8.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1690 -4.4030 -9.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5380 -5.6460 -9.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2730 -5.8110 -8.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3750 -4.7090 -7.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3810 -7.0760 -9.7220 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.8900 -8.1790 -8.9010 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7920 -6.7520 -9.5250 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9170 -7.1260 -11.2420 N 0 5 0 0 0 0 0 0 0 0 0 0 -0.9360 -7.3220 -11.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4870 -0.7000 2.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 1.9230 -0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7220 1.3540 -0.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2050 1.5850 0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2200 0.3190 -2.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2920 -3.6800 -3.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1590 -4.1600 -1.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 -3.3130 -5.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9160 -1.9860 -8.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2840 -1.1000 -7.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5350 -2.8400 -7.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0180 -2.3390 -8.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1580 -4.2880 -9.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2040 -6.7870 -8.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3560 -4.8530 -7.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5480 -0.4860 2.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2150 -1.5570 3.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 0.1620 2.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 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 8 9 1 0 0 0 0 8 33 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 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 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 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 26 2 0 0 0 0 24 27 1 0 0 0 0 27 28 1 0 0 0 0 29 44 1 0 0 0 0 29 45 1 0 0 0 0 29 46 1 0 0 0 0 M CHG 1 27 -1 M END