PUBCHEM-ZINC03872462 MOE2007 3D CORINA 3.40 0006 02.08.2006 71 70 0 0 1 0 0 0 0 0999 V2000 -0.2010 -0.1960 1.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6770 0.0830 1.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9630 1.5730 1.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5480 -0.7340 0.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3680 -2.2240 0.8030 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3120 -2.4830 0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1590 -3.0440 -0.2180 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.7350 -2.8930 -1.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0820 -4.5060 0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0860 -5.1030 0.4690 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8990 -5.1490 0.1040 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8240 -6.5690 0.4550 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5380 -6.7840 1.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1590 -7.4160 -0.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6290 -7.2150 -1.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2720 -6.9890 -1.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4320 -6.8980 0.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4670 -6.1000 0.7660 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1850 -8.0780 1.5290 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1390 -8.3500 2.0930 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9020 -7.8830 1.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 -7.7790 3.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0990 -6.2550 3.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -8.3480 4.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3700 -9.8390 2.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4410 -10.6020 1.9770 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6080 -10.3230 2.3580 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8150 -11.7650 2.5130 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1250 -12.3020 1.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2540 -12.1180 2.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4690 -11.8390 0.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5630 -11.4030 -0.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5640 -12.1570 3.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2450 -11.3180 4.7550 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5240 -2.6230 -0.2140 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4190 0.3860 1.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -1.2570 1.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 0.0850 0.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9050 -0.1980 2.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4070 2.1500 2.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6560 1.8730 0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0300 1.7580 1.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5940 -0.4600 0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2500 -0.5280 -0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0960 -4.6710 -0.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9830 -8.4680 -0.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7810 -6.1890 -1.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8990 -7.9040 -1.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2550 -7.4070 -0.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2250 -7.1330 -1.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5110 -7.5930 -2.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4490 -5.9380 -2.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8840 -8.7480 1.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1700 -8.0530 3.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 -5.9810 3.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 -5.8480 4.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9140 -5.8500 2.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2010 -9.4240 4.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -7.8800 5.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8780 -8.1430 3.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3630 -9.7160 2.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9440 -11.5140 2.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4340 -13.1740 2.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9660 -2.7290 0.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3090 -2.0450 2.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6660 -12.0750 0.1070 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6940 -13.4390 4.3240 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8620 -2.5200 2.1550 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8380 -2.2820 2.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5230 -13.6420 5.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7550 -11.8810 -0.8360 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 4 1 0 0 0 0 2 39 1 0 0 0 0 3 40 1 0 0 0 0 3 41 1 0 0 0 0 3 42 1 0 0 0 0 4 5 1 0 0 0 0 4 43 1 0 0 0 0 4 44 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 68 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 35 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 45 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 14 46 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 16 50 1 0 0 0 0 16 51 1 0 0 0 0 16 52 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 53 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 25 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 54 1 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 23 57 1 0 0 0 0 24 58 1 0 0 0 0 24 59 1 0 0 0 0 24 60 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 61 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 33 1 0 0 0 0 30 31 1 0 0 0 0 30 62 1 0 0 0 0 30 63 1 0 0 0 0 31 32 2 0 0 0 0 31 66 1 0 0 0 0 33 34 2 0 0 0 0 33 67 1 0 0 0 0 35 64 1 0 0 0 0 65 68 1 0 0 0 0 66 71 1 0 0 0 0 67 70 1 0 0 0 0 68 69 1 0 0 0 0 M END