IBS-ZINC01184522 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 51 0 0 0 0 0 0 0 0999 V2000 -2.3810 -2.0640 -1.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4400 -1.6300 -0.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6620 -2.1220 0.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8080 -1.7920 1.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3020 -0.9700 1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5310 -0.4620 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3280 -0.7920 -1.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 -0.1450 -2.7010 S 0 0 0 0 0 0 0 0 0 0 0 0 1.3510 0.5310 -2.6150 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1450 -1.1880 -3.6810 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1180 1.0240 -2.9530 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2610 2.1380 -2.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0250 3.2730 -2.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1820 4.4660 -1.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3730 5.5930 -1.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5030 6.6920 -1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4360 6.6740 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2410 5.5360 0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1210 4.4480 -0.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1460 5.5800 1.1640 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5080 4.3220 1.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6250 7.7010 0.8320 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8410 8.8720 0.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 -0.6170 2.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7480 -1.5380 3.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6860 -1.1790 4.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7270 0.0340 4.6640 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.7270 -1.2130 -2.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8990 -2.8000 -2.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2800 -2.5340 -1.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5080 -2.7760 0.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0150 -2.1860 2.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3950 0.1790 -0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 0.7050 -3.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8100 1.7890 -1.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2760 2.4910 -1.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5110 3.5680 -3.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0190 2.9280 -3.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6320 5.6260 -2.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 7.5420 -1.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7580 3.5750 -0.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0000 4.5140 2.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2280 3.8050 1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6310 3.6960 1.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7750 8.6570 0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0380 9.3420 -0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1300 9.5850 1.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4300 0.4380 2.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5600 -2.5990 3.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2980 -2.1750 4.8000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 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 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 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 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 2 0 0 0 0 M CHG 1 27 -1 M END