IBS-ZINC02206251 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6520 -0.5700 -1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 -2.0970 -1.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3090 -2.7030 -2.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 -4.1640 -2.1690 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2100 -5.0260 -2.7020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1350 -4.9020 -3.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -6.4390 -2.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3020 -7.7610 -2.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 -8.4280 -1.8150 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3700 -9.3910 -1.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1920 -7.5910 -1.3850 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 -6.3570 -1.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2070 -4.9340 -1.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2170 -4.5150 -1.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8940 -8.3620 -3.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8320 -9.0380 -2.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9460 -9.5970 -2.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1360 -9.4890 -4.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2140 -8.8220 -5.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0940 -8.2500 -4.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1900 -7.5890 -5.2180 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1060 -4.6880 -2.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2640 -4.6660 -2.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4720 -4.3570 -2.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5240 -4.0690 -0.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3580 -4.0930 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1540 -4.4070 -0.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0630 -3.6740 -0.0940 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.6000 -3.3880 1.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 -0.2510 -2.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6880 -0.2340 -1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 -2.4160 -0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4230 -2.4330 -1.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 -2.3830 -3.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3450 -2.3670 -2.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6860 -9.1250 -1.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6710 -10.1210 -2.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0110 -9.9300 -4.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3690 -8.7410 -6.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5170 -8.1500 -5.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2240 -4.8900 -3.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3760 -4.3390 -2.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3940 -3.8690 0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2490 -4.4300 -0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4900 -3.1320 2.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1500 -4.2930 2.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8840 -2.5690 1.6920 H 0 0 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 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 15 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 24 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 17 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 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 23 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 29 49 1 0 0 0 0 30 31 1 0 0 0 0 31 50 1 0 0 0 0 31 51 1 0 0 0 0 31 52 1 0 0 0 0 M END