IBS-ZINC04085564 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 50 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7960 1.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -2.1310 0.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -2.0740 -0.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -0.7840 -1.0920 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -3.2580 -1.6540 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0500 -4.1780 -1.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2810 -3.1960 -2.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0070 -2.2560 -3.6350 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 -2.4780 -4.6150 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1980 -3.2550 -5.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2670 -1.1740 -5.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2190 -0.7270 -6.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0800 0.5730 -6.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 1.3860 -6.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9260 0.9550 -5.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7940 -0.3470 -4.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6010 -1.0880 -3.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6490 -0.7020 -3.4360 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2810 -2.9080 -3.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2130 -3.2330 -2.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5640 -3.5720 -2.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0980 -4.0080 -0.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4520 -4.2380 -0.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2590 -4.0510 -1.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7560 -3.6200 -3.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3850 -3.3790 -3.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5760 -2.9940 -4.2430 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8800 -2.7740 -5.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -0.4750 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -3.0250 1.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1330 -2.8470 -1.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4930 -4.1840 -2.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0360 -1.3580 -6.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8080 0.9560 -7.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 2.3860 -6.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7400 1.5940 -5.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4770 -4.1560 -0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9010 -4.5760 0.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3170 -4.2480 -1.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3960 -3.4780 -4.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 22 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 19 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 21 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 21 22 2 0 0 0 0 21 29 1 0 0 0 0 22 23 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 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 26 27 2 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 M END