IBS-ZINC02139900 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 44 0 0 1 0 0 0 0 0999 V2000 -0.0420 1.3850 -0.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 0.0540 0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3420 -0.5420 0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4900 0.1910 -0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3550 1.5260 -0.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0940 2.1200 -0.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8490 -0.4580 -0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2120 -1.1070 -1.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8540 -1.8860 -1.3410 P 0 0 0 0 0 0 0 0 0 0 0 0 5.7920 -3.0690 -0.4040 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9950 -2.5490 -3.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2910 -3.3340 -3.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5810 -3.7330 -4.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9140 -4.4760 -4.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3310 -4.7600 -6.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6540 -5.5060 -6.2120 C 0 0 3 0 0 0 0 0 0 0 0 0 10.6340 -6.4480 -5.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0840 -5.7880 -7.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2790 -5.3460 -7.8240 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8970 -0.8010 -1.2050 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.0230 1.8470 -0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 -0.5210 0.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4270 -1.5820 0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2340 2.1070 -0.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 3.1560 -0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6070 0.2870 0.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8750 -1.2060 0.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4760 -1.8740 -1.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2140 -0.3640 -2.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1320 -3.1900 -3.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9680 -1.7060 -3.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1190 -2.7250 -2.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2460 -4.2260 -2.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7760 -4.3680 -5.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6220 -2.8350 -5.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6830 -3.8750 -4.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8360 -5.4190 -4.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5470 -5.3540 -6.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3970 -3.8190 -6.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2780 -6.3560 -8.4390 O 0 5 0 0 0 0 0 0 0 0 0 0 11.7670 -4.6750 -5.6040 N 0 3 0 0 0 0 0 0 0 0 0 0 12.1980 -5.0830 -4.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5490 -3.6810 -5.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4650 -4.7340 -6.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 21 1 0 0 0 0 2 3 2 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 9 20 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 41 1 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 41 42 1 0 0 0 0 41 43 1 0 0 0 0 41 44 1 0 0 0 0 M CHG 1 20 -1 M CHG 1 40 -1 M CHG 1 41 1 M END