PUBCHEM-ZINC04574627 MOE2007 3D CORINA 3.40 0006 02.08.2006 67 67 0 0 1 0 0 0 0 0999 V2000 0.2910 -2.4510 -2.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 -1.7360 -3.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 -0.2240 -3.7130 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2900 0.0090 -2.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1830 0.4820 -4.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2670 0.2550 -4.1300 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0240 -0.3150 -3.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4130 1.7190 -3.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2950 2.5510 -4.6750 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6750 2.1020 -2.5360 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 3.5150 -2.2350 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4200 3.9850 -3.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8140 3.6240 -0.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1900 3.0290 -1.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0680 3.1360 -0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6370 3.6370 0.9280 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3280 2.6750 -0.1210 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1160 2.8120 1.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4920 2.2430 0.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7420 0.9100 1.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0050 0.3880 0.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0180 1.2000 0.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7690 2.5340 0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5070 3.0570 0.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3890 4.2100 -1.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3690 3.5620 -1.6720 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 5.5510 -2.0740 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4400 0.0590 -5.5710 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8510 -1.1350 -6.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0780 -2.0470 -5.2750 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0100 -1.3150 -7.3680 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4560 -2.6260 -7.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8180 -2.9370 -7.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5780 -2.6400 -9.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4400 -3.6830 -7.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 -2.2350 -1.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7300 -2.1020 -3.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3370 -3.5260 -3.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2530 -2.0590 -3.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9430 -1.9810 -4.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0180 0.2490 -5.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1100 1.5590 -4.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1750 0.1400 -4.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 1.4430 -1.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3580 3.0770 -0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9250 4.6720 -0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6460 3.5750 -2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0780 1.9800 -1.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6300 2.2710 1.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1970 3.8660 1.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9510 0.2750 1.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2000 -0.6540 1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0040 0.7920 0.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5600 3.1680 -0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3130 4.1000 0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3110 6.0690 -2.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 5.9980 -1.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 0.7870 -6.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5410 -2.1840 -7.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1520 -3.9210 -7.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7300 -2.9270 -6.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6080 -2.4190 -9.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9120 -3.6240 -9.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3010 -1.8880 -9.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3530 -3.6730 -6.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7740 -4.6670 -7.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5300 -3.4620 -7.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 39 1 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 28 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 25 1 0 0 0 0 13 14 1 0 0 0 0 13 45 1 0 0 0 0 13 46 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 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 49 1 0 0 0 0 18 50 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 51 1 0 0 0 0 21 22 1 0 0 0 0 21 52 1 0 0 0 0 22 23 2 0 0 0 0 22 53 1 0 0 0 0 23 24 1 0 0 0 0 23 54 1 0 0 0 0 24 55 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 28 29 1 0 0 0 0 28 58 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32 35 1 0 0 0 0 33 59 1 0 0 0 0 33 60 1 0 0 0 0 33 61 1 0 0 0 0 34 62 1 0 0 0 0 34 63 1 0 0 0 0 34 64 1 0 0 0 0 35 65 1 0 0 0 0 35 66 1 0 0 0 0 35 67 1 0 0 0 0 M END