IBS-ZINC02219682 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 1 0 0 0 0 0999 V2000 -0.1480 1.4990 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 -0.0060 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 -0.6560 1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2140 -2.1540 1.2680 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0700 -2.4260 1.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3760 -2.7270 -0.0690 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 -3.9940 -0.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0360 -5.1380 0.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3460 -6.2780 -0.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3470 -6.2900 -1.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0390 -5.1650 -2.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 -4.0010 -1.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3850 -2.7620 -2.2670 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 -2.0030 -1.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1780 -0.6620 -1.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0470 -2.6910 1.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9810 -3.4060 3.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1350 -3.9000 3.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3620 -3.6780 3.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4260 -2.9600 1.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2690 -2.4640 1.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4990 -4.1630 3.6070 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2410 0.1040 2.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3410 0.3600 2.8060 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8680 0.5470 2.9830 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6750 1.3100 4.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8570 1.9210 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7060 1.8400 -0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6570 1.8230 0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0390 -5.1400 1.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5960 -7.1840 0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 -7.2050 -2.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0420 -5.1830 -3.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4980 -0.2060 -1.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0250 -3.5790 3.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0830 -4.4590 4.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3800 -2.7860 1.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3190 -1.9010 0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9200 -3.5540 4.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0920 2.2020 3.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6440 1.6030 4.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1420 0.7070 4.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 15 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 16 1 0 0 0 0 6 7 1 0 0 0 0 6 14 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 34 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 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 26 40 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 M END