IBS-ZINC04227989 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 0 0 0 0 0 0999 V2000 -0.2100 1.5310 0.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2330 0.0330 0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2900 -0.7420 1.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2770 -2.1400 1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1920 -2.7400 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1200 -2.0080 -1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1340 -0.5980 -1.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 -2.9470 -2.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0500 -4.2260 -1.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1540 -4.0670 -0.3510 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1980 -4.8260 0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -5.5440 -2.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 -6.5590 -1.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8760 -7.7690 -2.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1490 -7.9340 -3.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1890 -9.1320 -4.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 -9.2570 -5.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3080 -8.1900 -6.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3460 -7.0010 -5.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6280 -6.8480 -4.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6900 -5.6820 -3.4730 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -2.6050 -3.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 -2.8230 -4.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5800 -2.5630 -5.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9520 -2.8460 -6.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9150 -2.9830 -5.5790 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8220 1.8850 0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6700 1.9820 -0.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7740 1.8800 1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3440 -0.2580 2.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3240 -2.7320 2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0650 -0.0050 -2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4130 -6.4170 -0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4980 -8.5720 -2.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7920 -9.9700 -4.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 -10.1810 -6.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8750 -8.2760 -6.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -6.1680 -5.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 -3.2020 -4.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2070 -1.5600 -3.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1960 -2.1610 -3.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8310 -3.8480 -4.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8410 -3.1890 -6.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3270 -1.5170 -5.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9480 -2.9000 -7.6460 O 0 5 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 12 21 2 0 0 0 0 13 14 2 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 M CHG 1 45 -1 M END