IBS-ZINC03985264 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 50 0 0 1 0 0 0 0 0999 V2000 -0.2250 1.6890 0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 0.1940 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 -0.4100 0.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4410 -0.5040 0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4470 -2.0070 -0.2540 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9020 -2.5250 0.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8630 -2.6280 -0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3360 -3.2760 -1.1500 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5250 -2.4440 0.9750 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8900 -2.8990 1.2750 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.0140 -3.9200 0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0130 -1.9730 0.7520 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.9700 -0.9980 1.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9910 -1.7390 -0.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3000 -2.5470 1.0510 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2180 -2.8650 2.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1280 -2.9120 2.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1120 -2.5990 3.5110 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8250 -2.3440 -1.5500 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 -3.3820 -1.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4710 -4.0030 -0.5550 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 -3.7350 -2.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6700 -4.7540 -2.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2230 -5.0670 -4.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8260 -4.3650 -5.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8750 -3.3480 -5.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3240 -3.0380 -3.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6280 -2.0310 -3.8740 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -1.5200 -4.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2280 -1.6610 -2.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0660 -0.7600 -2.7260 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 2.2090 0.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9370 2.1490 -0.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 1.8610 1.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3010 0.0980 -1.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6300 -0.3810 1.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1900 -1.4510 0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9160 0.1420 0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7950 -0.3870 1.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1810 0.0340 -0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0770 -2.0120 1.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0260 -2.6880 -1.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8750 -1.1700 -1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1060 -1.1770 -1.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9850 -5.3050 -2.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9620 -5.8600 -4.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2580 -4.6120 -6.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5760 -2.8110 -6.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3190 -3.1870 3.1700 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 19 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 41 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 17 18 2 0 0 0 0 17 49 1 0 0 0 0 19 20 1 0 0 0 0 19 30 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 30 31 2 0 0 0 0 M CHG 1 49 -1 M END