PUBCHEM-ZINC06778468 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -2.0410 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4650 -2.5220 2.4100 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5720 -3.8520 2.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0960 -4.5900 1.7240 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2880 -4.4250 3.7500 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3200 -4.0750 3.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5860 -3.9700 5.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3700 -4.4400 6.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1560 -5.5620 6.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0670 -5.6560 7.9490 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1120 -6.3810 8.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9110 -4.5690 7.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5160 -3.7620 6.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2040 -2.5800 6.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2630 -2.2130 7.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6600 -3.0070 8.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9890 -4.1740 8.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 -5.8880 3.6760 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2100 -6.5390 2.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0740 -5.9120 2.3820 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1900 -8.0110 2.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0710 -8.7980 2.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6900 -10.0700 2.4090 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6000 -10.0660 3.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2930 -8.8390 3.4880 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8520 -11.2900 3.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7610 -11.6340 2.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 -2.4180 1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -2.3920 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5210 -2.8820 5.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5820 -4.3940 5.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3790 -6.2840 6.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9020 -1.9570 5.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7960 -1.2980 7.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4980 -2.7040 9.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3060 -4.7860 9.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5790 -6.3880 4.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9150 -8.4630 1.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5440 -12.1270 3.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 -11.0930 4.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -10.7960 2.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 -11.8310 1.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3460 -12.6930 4.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -12.8270 3.0840 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6950 -13.0750 2.4290 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 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 21 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 42 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 20 2 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 54 1 0 0 0 0 53 54 1 0 0 0 0 54 55 1 0 0 0 0 M END