IBS-ZINC02502329 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 0 0 0 0 0999 V2000 0.0460 1.5440 -0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 0.0380 -0.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 -0.6160 1.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -1.9960 1.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -2.7280 -0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -2.0670 -1.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -0.6870 -1.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -4.1240 -0.0760 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -4.8930 -1.3230 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6450 -4.3750 -2.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6290 -6.3090 -1.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5250 -7.2160 -1.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5080 -8.4280 -1.4040 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5670 -6.4700 -1.8340 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3460 -5.1460 -1.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1470 -4.2890 -2.1090 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7870 -7.0220 -2.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8600 -7.7580 -3.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0590 -8.3040 -3.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2040 -8.1180 -3.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1260 -7.3790 -1.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9220 -6.8400 -1.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4910 -8.7010 -3.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5570 -9.3440 -4.4850 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0730 1.9100 -0.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4630 1.8800 -1.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4740 1.9330 0.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -0.0470 1.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.5070 2.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -2.6330 -2.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -0.1730 -2.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -4.5840 0.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4860 -6.4960 -1.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9020 -6.4410 -0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9750 -7.9010 -4.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1160 -8.8750 -4.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0080 -7.2330 -1.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8600 -6.2710 -0.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5930 -8.5210 -2.7030 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4130 -8.9220 -3.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 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 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 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 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 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 2 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 38 1 0 0 0 0 23 24 2 0 0 0 0 23 39 1 0 0 0 0 39 40 1 0 0 0 0 M END