PUBCHEM-ZINC06379640 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 0.1570 1.2950 -0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 -0.1190 -0.2730 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2030 -0.5460 0.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0120 0.1740 0.8800 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3050 -2.0650 0.2010 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7750 -2.3830 -0.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6820 -2.6760 1.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6170 -4.1720 1.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3520 -5.0370 2.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9910 -6.3190 1.9030 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3610 -7.1530 2.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0430 -6.3160 0.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2220 -4.9810 0.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 -4.7020 -0.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8330 -5.7600 -1.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5400 -7.0810 -0.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 -7.3850 0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7070 -2.4330 0.0330 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3430 -2.3750 -1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8140 -2.0010 -2.2270 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7250 -2.8000 -1.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6310 -2.8180 -2.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8110 -3.2970 -1.6740 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5570 -3.5390 -0.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3280 -3.2700 0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.6610 -4.1270 0.4500 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.3300 -4.1740 1.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9320 -3.2660 0.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0860 -3.9330 1.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3410 -5.3450 0.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9350 -5.5520 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 1.5280 -0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6720 1.8210 -0.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2720 1.6210 0.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3360 -2.2880 1.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2450 -2.3560 2.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0890 -4.8480 2.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4280 -3.6780 -0.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5730 -5.5460 -1.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0530 -7.8890 -1.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3790 -8.4150 0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2590 -2.7380 0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6010 -2.5500 -3.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7360 -2.2770 0.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2380 -3.0960 -0.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8550 -3.9590 2.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9950 -3.3320 1.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0890 -5.8600 1.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6560 -5.3590 -0.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2120 -5.5970 -1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0760 -6.2110 0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0780 -6.1370 0.7410 N 0 3 0 0 0 0 0 0 0 0 0 0 -8.8140 -6.2480 1.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2520 -7.0910 0.3970 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 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 18 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 31 1 0 0 0 0 28 29 1 0 0 0 0 28 44 1 0 0 0 0 28 45 1 0 0 0 0 29 30 1 0 0 0 0 29 46 1 0 0 0 0 29 47 1 0 0 0 0 30 48 1 0 0 0 0 30 49 1 0 0 0 0 30 52 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 52 53 1 0 0 0 0 52 54 1 0 0 0 0 M CHG 1 52 1 M END