OTAVA-ZINC05031009 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 0 0 0 0 0 0999 V2000 1.2230 1.7200 -0.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2230 0.8070 0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8970 0.1420 1.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8760 0.7480 2.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4920 0.1410 3.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 -1.0800 3.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1530 -1.6860 2.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5300 -1.0760 1.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7600 -1.6980 4.6310 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0340 -2.1560 4.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6560 -2.7690 5.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9420 -2.9010 6.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4600 -3.4350 7.7650 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6170 -2.4050 6.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0690 -1.8300 5.8390 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8410 -2.5360 8.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0430 -3.2770 5.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0640 -2.7050 6.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3540 -3.1820 6.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6350 -4.2250 5.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6260 -4.7950 4.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3320 -4.3310 4.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7040 -2.0130 3.3020 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5070 -0.9490 3.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7170 -0.1690 4.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1440 -0.7290 1.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8480 0.6300 1.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1670 -1.8350 1.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 1.1290 -0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7360 2.2020 -1.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5780 2.4820 0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6210 1.3980 0.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1320 0.0460 -0.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3770 1.6970 2.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4760 0.6150 4.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6510 -2.6350 2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5410 -1.5490 0.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0140 -1.6570 8.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7780 -2.6200 7.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1710 -3.4280 8.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8460 -1.8910 6.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1460 -2.7410 6.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6460 -4.5940 5.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8520 -5.6080 3.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5440 -4.7810 4.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5970 -2.6780 2.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3760 -0.7490 0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6720 0.6210 2.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2340 0.8270 0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1370 1.4100 2.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6660 -2.8030 1.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6280 -1.6760 0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9350 -1.8150 2.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 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 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 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 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 10 11 2 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 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 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 2 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 47 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 M END