PUBCHEM-ZINC05846119 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 55 0 0 1 0 0 0 0 0999 V2000 0.3460 -0.5910 -1.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2990 0.0240 -0.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7020 -0.5340 -0.2470 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4040 -0.2680 -1.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7310 -2.0610 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8450 -2.3970 1.0380 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7230 -3.7640 1.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2290 -4.1750 2.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3770 -5.5400 2.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4290 -6.4370 1.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3550 -5.9280 0.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5240 -4.6090 0.5430 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6050 1.5720 0.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2720 2.0430 2.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8330 4.4450 2.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3820 5.8350 1.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8470 3.6130 3.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8720 4.5380 2.8010 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8660 3.9980 2.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7510 4.9080 1.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7860 4.4200 0.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9090 3.0490 0.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9810 2.2180 1.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9620 2.6590 1.8380 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2820 -0.0720 -2.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5880 -1.6470 -1.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3120 -0.5080 -2.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3660 -0.1220 0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3600 1.1050 -0.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7540 -2.3710 0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4290 -2.5630 -0.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8470 -3.4560 2.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 -5.9030 3.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3360 -7.5070 1.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0050 -6.5910 0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2940 1.6580 0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6880 2.1290 0.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0680 1.3200 2.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5610 1.9930 3.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1140 4.2210 1.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2640 4.4760 2.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9640 6.2360 2.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5550 6.5300 1.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0110 5.8250 0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3490 4.0280 4.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3050 2.6840 3.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6380 5.9720 1.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4950 5.1050 0.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7120 2.6420 -0.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0380 1.1400 0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2280 0.1190 1.0250 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.0610 -0.4050 1.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5310 -0.0240 1.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8580 3.3880 2.1020 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 51 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 13 51 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 14 54 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 15 54 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 17 54 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 23 2 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 51 52 1 0 0 0 0 51 53 1 0 0 0 0 M CHG 1 51 1 M END