IBS-ZINC05429011 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 0 0 1 0 0 0 0 0999 V2000 0.1580 1.5350 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1610 0.0160 0.1160 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8490 -0.4220 -0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6460 -0.3260 1.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2490 -0.8450 2.2920 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1740 -0.5390 -0.1370 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7690 -0.6280 -1.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2520 -0.2570 -2.4190 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1490 -1.2530 -1.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8400 -1.2860 -2.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2300 -1.9150 -2.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9330 -1.9280 -3.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8130 -0.9690 -4.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2310 -1.3360 -5.5930 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.8750 -0.8110 -6.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6470 -2.5250 -5.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8250 -2.9220 -4.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0970 -4.1240 -5.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2190 -4.8790 -6.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0500 -4.4560 -7.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7810 -3.2690 -7.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 1.9520 0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1640 1.8470 -1.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5250 1.9930 0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6230 -0.8830 0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0430 -2.2700 -0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7510 -0.6760 -0.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9180 -0.2660 -3.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2250 -1.8480 -3.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1500 -2.9400 -2.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8360 -1.3610 -1.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1710 -0.0550 -3.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4450 -4.4630 -4.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6560 -5.8040 -6.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1300 -5.0570 -8.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4260 -2.9410 -7.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8550 -0.0650 1.8050 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 37 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 10 29 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 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 16 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 18 19 1 0 0 0 0 18 33 1 0 0 0 0 19 20 2 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 36 1 0 0 0 0 M CHG 1 37 -1 M END