PUBCHEM-ZINC04825227 MOE2007 3D CORINA 3.40 0006 02.08.2006 78 82 0 0 1 0 0 0 0 0999 V2000 0.1440 0.3530 -0.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -1.0360 -0.3940 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2140 -1.8100 -1.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4110 -1.2470 0.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5980 -1.3230 1.4000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4170 -1.3260 -0.7490 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8220 -1.5210 -0.3610 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8260 -2.4300 0.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3740 -0.3010 0.4160 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5800 0.3670 0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1830 0.4890 -0.4940 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0100 -0.0950 -1.8040 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.1120 0.3940 -2.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7070 -1.6050 -1.6210 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.1080 -1.9190 -2.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7900 -2.3110 -1.3210 O 0 5 0 0 0 0 0 0 0 0 0 0 -6.0960 0.2790 -2.6810 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4240 0.3870 -2.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1430 0.7820 -3.4050 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2350 0.9080 -4.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9550 0.6010 -4.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8230 0.6230 -4.7250 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0740 0.9870 -5.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2590 1.3110 -6.5600 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3760 1.2800 -5.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5910 1.6120 -6.3490 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2510 -0.6980 1.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6880 0.4820 2.2860 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0560 1.0530 1.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8790 -1.2270 0.7490 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2310 -1.4780 0.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8850 -1.5380 -0.3580 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8430 -1.7650 2.0580 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3980 -1.0810 2.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5490 -3.2320 2.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7510 -3.5430 3.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7590 -3.2170 4.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9500 -3.4880 6.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1320 -4.0860 6.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1240 -4.4150 5.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9350 -4.1450 4.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2700 -1.4900 1.9730 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0040 -0.9410 2.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5710 -0.5780 4.0660 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2990 -0.8520 2.5890 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1710 -0.2870 3.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5530 -0.2090 2.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0620 1.0100 2.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3380 1.0730 1.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1140 -0.0810 1.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6150 -1.2990 2.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3400 -1.3640 2.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 0.5290 -1.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 0.4880 -1.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0990 1.1300 -0.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1940 -1.2720 -1.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8000 0.1590 -1.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2110 1.0260 -6.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4180 1.5900 -5.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6210 1.8670 -7.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1510 -1.2360 1.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6970 -1.3150 2.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4150 -1.1790 1.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5130 -3.4940 2.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1700 -3.9030 1.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 -2.7500 4.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 -3.2290 6.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2820 -4.2930 7.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0480 -4.8770 6.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7200 -4.4020 3.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7610 -1.7030 1.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8210 0.7130 3.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1890 -0.9200 4.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4670 1.9170 2.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7260 2.0220 1.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1060 -0.0300 1.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2180 -2.1990 2.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9590 -2.3220 3.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 53 1 0 0 0 0 1 54 1 0 0 0 0 1 55 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 30 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 56 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 14 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 27 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 17 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 18 19 2 0 0 0 0 18 57 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 58 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 59 1 0 0 0 0 26 60 1 0 0 0 0 27 28 1 0 0 0 0 27 61 1 0 0 0 0 27 62 1 0 0 0 0 28 29 1 0 0 0 0 30 31 1 0 0 0 0 30 63 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 33 42 1 0 0 0 0 35 36 1 0 0 0 0 35 64 1 0 0 0 0 35 65 1 0 0 0 0 36 37 1 0 0 0 0 36 41 2 0 0 0 0 37 38 2 0 0 0 0 37 66 1 0 0 0 0 38 39 1 0 0 0 0 38 67 1 0 0 0 0 39 40 2 0 0 0 0 39 68 1 0 0 0 0 40 41 1 0 0 0 0 40 69 1 0 0 0 0 41 70 1 0 0 0 0 42 43 1 0 0 0 0 42 71 1 0 0 0 0 43 44 2 0 0 0 0 43 45 1 0 0 0 0 45 46 1 0 0 0 0 46 47 1 0 0 0 0 46 72 1 0 0 0 0 46 73 1 0 0 0 0 47 48 1 0 0 0 0 47 52 2 0 0 0 0 48 49 2 0 0 0 0 48 74 1 0 0 0 0 49 50 1 0 0 0 0 49 75 1 0 0 0 0 50 51 2 0 0 0 0 50 76 1 0 0 0 0 51 52 1 0 0 0 0 51 77 1 0 0 0 0 52 78 1 0 0 0 0 M CHG 1 16 -1 M END