IFLAB-ZINC05250780 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 0 0 0 0 0 0999 V2000 -0.0130 1.3830 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 0.0010 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -0.6710 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 0.0400 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 1.4220 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 2.0940 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7200 -0.6920 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1470 -0.9420 -1.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4850 -1.6850 -1.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8940 -1.9250 -2.8860 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0490 -2.5690 -3.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7500 -2.9500 -2.2320 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4660 -2.8130 -4.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7640 -2.4320 -5.4740 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6200 -3.4570 -4.8200 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9640 -3.7720 -6.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6260 -2.9060 -7.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9670 -3.2190 -8.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6440 -4.3940 -8.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9820 -5.2580 -7.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6490 -4.9470 -6.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0070 -4.7260 -10.1420 N 0 3 0 0 0 0 0 0 0 0 0 0 9.7100 -3.9670 -11.0460 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6030 -5.7600 -10.3860 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9580 1.9070 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9170 -0.5550 0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2350 -1.7510 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3060 1.9770 -0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 3.1730 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4770 -0.0900 0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6120 -1.6460 0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3910 -1.5450 -1.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2550 0.0110 -2.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2410 -1.0830 -0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3770 -2.6390 -0.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3330 -1.6200 -3.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2130 -3.7030 -4.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0970 -1.9890 -6.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7050 -2.5470 -9.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5100 -6.1740 -7.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9170 -5.6200 -5.6160 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 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 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 37 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 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 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 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END