IBS-ZINC05324151 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 0.1690 1.5120 0.1230 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 0.6900 -0.4780 -1.2070 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 -0.2500 -2.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1590 1.0590 -2.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9140 1.3510 -3.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6040 0.3440 -4.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5310 -0.9520 -4.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7710 -1.2540 -3.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7120 -2.6920 -2.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 -2.7670 -1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1020 -1.8760 -1.0620 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5920 -2.0140 -0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0700 -2.2440 -2.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1660 -2.3080 -0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1250 -1.6530 -0.4620 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9640 -2.6640 1.1590 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6870 -4.0760 1.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3970 -4.4960 0.5050 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2350 -4.1940 -0.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3800 -5.0270 -1.6670 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9410 -4.8980 1.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2770 -4.2920 2.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4190 0.6570 -5.7840 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.4830 1.8010 -6.1960 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0260 -0.2310 -6.3560 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2290 1.7570 0.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2620 1.9960 -0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 1.8640 1.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4330 -0.4880 0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0580 -0.2490 -0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3780 1.8480 -2.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9670 2.3660 -4.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0720 -1.7370 -4.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7170 -3.1140 -2.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0790 -3.2610 -3.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9480 -1.6000 -2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3760 -3.2840 -2.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5750 -2.1100 -3.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2300 -4.7450 0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7320 -5.9550 1.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7530 -4.5800 1.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0870 -3.9730 3.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 -5.3490 3.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6170 -3.7080 3.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 12 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 11 20 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 M CHG 1 24 1 M CHG 1 26 -1 M END