PUBCHEM-ZINC06778016 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 59 0 0 1 0 0 0 0 0999 V2000 0.1020 1.2200 0.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -0.2790 0.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3520 -0.8340 0.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4310 -2.3430 0.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7910 -2.9030 0.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8850 -4.4070 0.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9970 -5.0490 1.0700 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1660 -5.0610 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0860 -6.5870 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3770 -7.2670 -0.4260 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.1970 -6.9700 0.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8040 -6.9260 -1.8590 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.2890 -5.9470 -1.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7820 -8.0380 -2.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1550 -9.2910 -1.5950 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.5200 -9.7740 -2.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2690 -8.8170 -0.4130 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2350 -9.1000 -0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5990 -9.3920 0.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3860 -10.8950 1.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5070 -11.6130 0.0690 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0900 -11.4550 2.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1410 -12.9800 2.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8910 -13.5370 3.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9850 -15.0580 3.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7960 -15.7210 5.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4180 -14.9780 6.1720 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1660 -10.2150 -1.2360 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6920 -11.0150 -0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7090 -6.9140 -2.7640 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2370 -7.7620 -2.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0900 1.5930 0.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 1.4600 -0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6480 1.7550 1.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8030 -0.7800 0.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2050 -0.4860 1.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1380 -0.3300 1.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5390 -0.6180 -0.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6390 -2.8470 0.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2450 -2.5590 1.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5870 -2.4330 0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9710 -2.6950 -0.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9910 -4.7080 0.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3350 -4.7160 -1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2340 -6.9210 -0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8690 -6.9100 1.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7620 -7.8460 -1.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9280 -8.1560 -3.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9500 -8.9220 1.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6370 -9.1820 1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0980 -11.1030 2.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8350 -11.0520 3.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1200 -13.3170 2.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3930 -13.3820 1.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9010 -13.2230 4.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6260 -13.1210 4.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9660 -15.3640 3.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2270 -15.4750 3.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0440 -16.9620 5.2330 O 0 5 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 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 5 42 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 43 1 0 0 0 0 8 44 1 0 0 0 0 9 10 1 0 0 0 0 9 45 1 0 0 0 0 9 46 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 30 1 0 0 0 0 14 15 1 0 0 0 0 14 47 1 0 0 0 0 14 48 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 28 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 23 24 1 0 0 0 0 23 53 1 0 0 0 0 23 54 1 0 0 0 0 24 25 1 0 0 0 0 24 55 1 0 0 0 0 24 56 1 0 0 0 0 25 26 1 0 0 0 0 25 57 1 0 0 0 0 25 58 1 0 0 0 0 26 27 2 0 0 0 0 26 59 1 0 0 0 0 28 29 1 0 0 0 0 30 31 1 0 0 0 0 M CHG 1 59 -1 M END