IBS-ZINC02139936 MOE2007 3D CORINA 3.40 0006 02.08.2006 68 72 0 0 1 0 0 0 0 0999 V2000 -0.1480 2.4740 -0.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 0.9740 -0.6790 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1940 0.7840 0.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5800 0.7950 -0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6290 1.7560 -1.4430 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6630 1.8920 -1.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8120 1.1750 -2.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 0.4480 -1.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 -0.5830 -2.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0090 -1.4000 -2.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1300 -1.1950 -0.5420 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2620 -1.6270 -0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1800 0.2990 -0.2740 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3500 0.4560 0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3650 0.8760 -1.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6470 0.2700 -0.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6600 -1.2510 -0.6460 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3910 -1.8730 -0.0470 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3570 -2.9330 -0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5760 -1.7370 1.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0740 -2.0580 1.6840 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.4890 -1.4170 2.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7630 -1.7860 0.3080 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.8350 -0.7430 0.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2150 -0.3990 1.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4240 -0.1450 -0.6100 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3500 0.9120 -0.4350 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3450 -3.0150 -0.2340 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.5760 -4.0750 -0.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0910 -5.2530 -0.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4320 -5.3100 -1.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2090 -4.1760 -1.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6260 -3.0350 -0.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2340 -3.4310 2.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8910 -1.6610 -2.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0790 3.0170 -1.0570 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4420 2.8650 -1.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2070 2.6370 -1.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 2.9870 0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 1.5920 1.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0380 -0.1690 0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3160 1.1050 0.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8220 -0.2110 -0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4630 1.9800 -3.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4230 0.4760 -3.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5500 -0.8710 -3.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9380 -1.0940 -2.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8260 -2.4550 -2.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3880 1.9600 -0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2720 0.6200 -2.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7210 0.5180 0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5040 0.6920 -1.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9510 -2.4560 2.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3520 -0.7200 1.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8860 0.4350 1.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8540 -0.9520 2.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2000 -0.4500 -1.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7060 1.2640 -1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5330 -4.0230 -0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4560 -6.1180 -1.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8610 -6.2170 -1.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2570 -4.1840 -1.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2250 -2.1480 -0.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7970 -3.6740 2.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4250 -0.9300 -2.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4490 -2.6420 -2.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9610 -1.7030 -2.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0510 3.6690 -1.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 3 40 1 0 0 0 0 3 41 1 0 0 0 0 4 5 1 0 0 0 0 4 42 1 0 0 0 0 4 43 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 36 1 0 0 0 0 7 8 1 0 0 0 0 7 44 1 0 0 0 0 7 45 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 46 1 0 0 0 0 10 11 1 0 0 0 0 10 47 1 0 0 0 0 10 48 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 18 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 49 1 0 0 0 0 15 50 1 0 0 0 0 16 17 1 0 0 0 0 16 51 1 0 0 0 0 16 52 1 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 53 1 0 0 0 0 20 54 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 34 1 0 0 0 0 23 24 1 0 0 0 0 23 28 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 25 55 1 0 0 0 0 25 56 1 0 0 0 0 26 27 1 0 0 0 0 26 57 1 0 0 0 0 27 58 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 59 1 0 0 0 0 30 31 1 0 0 0 0 30 60 1 0 0 0 0 31 32 2 0 0 0 0 31 61 1 0 0 0 0 32 33 1 0 0 0 0 32 62 1 0 0 0 0 33 63 1 0 0 0 0 34 64 1 0 0 0 0 35 65 1 0 0 0 0 35 66 1 0 0 0 0 35 67 1 0 0 0 0 36 68 1 0 0 0 0 M CHG 1 28 1 M END