PUBCHEM-ZINC03766479 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 -3.6410 -1.5370 3.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5400 -1.6630 2.9780 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3170 -1.9250 3.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3140 -2.2300 2.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9840 -2.5100 3.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2840 -2.4630 4.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2880 -2.1740 5.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0130 -1.9020 4.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6670 -2.7340 4.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3070 -1.7760 5.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 -0.2910 5.6120 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1300 0.0050 5.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0500 0.1650 6.6490 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6640 -0.8810 7.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4470 -0.8450 8.2340 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1740 -2.1280 6.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5730 -3.3660 7.0760 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2650 1.5620 6.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4580 1.9840 8.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8760 4.0050 9.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7570 5.5000 9.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5690 5.6330 7.9260 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3730 6.5760 7.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4440 0.2750 4.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4370 0.9370 3.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6940 1.4540 2.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9590 1.3160 1.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9670 0.6600 2.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7140 0.1420 3.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2640 -3.6950 4.3510 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5360 -0.6460 4.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5460 -1.4160 3.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7640 -2.4380 4.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5490 -2.2560 1.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7550 -2.7480 2.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5000 -2.1750 6.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7690 -1.6790 5.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3330 1.6930 7.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0190 2.1880 6.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3860 1.8230 8.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7730 1.4410 9.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3890 3.7710 10.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8870 3.5370 9.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9090 5.9400 9.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6770 6.0260 9.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4370 1.0500 3.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9060 1.9580 1.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1590 1.7130 0.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9520 0.5440 1.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5170 -0.3730 4.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2230 -3.2270 7.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6600 3.4350 8.4770 N 0 3 0 0 0 0 0 0 0 0 0 0 4.6570 3.6580 8.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3350 4.0160 7.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 30 2 0 0 0 0 10 11 1 0 0 0 0 10 16 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 24 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 17 51 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 19 52 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 20 52 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 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 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 29 50 1 0 0 0 0 52 53 1 0 0 0 0 52 54 1 0 0 0 0 M CHG 1 52 1 M END