OTAVA-ZINC04649735 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 1 0 0 0 0 0999 V2000 -0.1030 1.3030 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -0.1200 -0.0780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6440 -0.7060 0.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8040 -2.0840 1.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4320 -2.6780 2.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9020 -1.9000 3.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7440 -0.5270 3.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1210 0.0720 2.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5870 -2.5500 4.3100 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4540 -3.6300 4.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9760 -2.0260 5.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5760 -2.4470 5.6980 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1400 -2.8990 6.7410 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1520 -2.3440 4.7270 O 0 5 0 0 0 0 0 0 0 0 0 0 4.0580 -2.2230 4.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0750 -3.1100 4.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2440 -2.4100 4.1170 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1340 -2.7760 4.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9280 -1.0670 4.3610 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7920 0.3900 5.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6240 -0.9550 4.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9390 0.1970 4.6770 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9350 -4.5640 3.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4400 -5.4750 4.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3060 -6.8300 4.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6730 -7.2890 3.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1700 -6.3950 2.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2910 -5.0320 2.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7920 -4.1520 1.7760 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8870 1.7560 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6130 1.6410 -0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6820 1.5960 0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4360 -2.6920 0.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5560 -3.7500 2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1110 0.0780 3.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0020 1.1450 1.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5300 -2.4270 6.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 -0.9370 5.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9350 -5.1210 5.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6960 -7.5350 5.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5720 -8.3510 3.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6770 -6.7600 1.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4190 -3.9030 1.0840 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 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 15 16 2 0 0 0 0 15 21 1 0 0 0 0 16 17 1 0 0 0 0 16 23 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 21 2 0 0 0 0 20 22 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 39 1 0 0 0 0 25 26 1 0 0 0 0 25 40 1 0 0 0 0 26 27 2 0 0 0 0 26 41 1 0 0 0 0 27 28 1 0 0 0 0 27 42 1 0 0 0 0 28 29 1 0 0 0 0 29 43 1 0 0 0 0 M CHG 1 12 1 M CHG 1 14 -1 M END