PUBCHEM-ZINC05553986 MOE2007 3D CORINA 3.40 0006 02.08.2006 67 68 0 0 1 0 0 0 0 0999 V2000 -2.7200 -6.7070 -3.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4450 -6.2510 -1.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9540 -6.3200 -1.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6830 -5.8600 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8070 -5.8680 0.3560 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3430 -5.2270 -0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4520 -7.2590 0.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5210 -7.2480 1.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5160 -5.8310 2.0220 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1880 -5.1970 1.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0840 -5.3540 1.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9280 -5.7550 3.4980 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2290 -6.3350 4.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3490 -6.1920 3.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7860 -7.2660 4.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9520 -8.3180 5.0930 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8860 -8.1790 4.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1320 -8.3980 6.6420 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1480 -8.6000 7.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9470 -9.6700 6.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5050 -10.0780 7.8040 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9370 -10.4540 5.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4340 -11.7120 5.4220 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3490 -9.6960 4.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8000 -11.9400 6.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1180 -10.0800 3.3360 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7570 -7.1720 7.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5890 -7.1870 8.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1670 -5.9210 9.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0280 -5.9540 11.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5930 -4.6860 11.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4780 -4.7390 13.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0180 -3.5140 13.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3950 -2.5390 13.2040 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8220 -4.4080 3.9570 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3980 -7.7420 -3.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7910 -6.6490 -3.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1930 -6.0750 -3.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8080 -5.2240 -1.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0110 -6.8820 -1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5990 -7.3480 -1.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3930 -5.6880 -2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0730 -4.8430 0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2340 -6.5010 0.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7210 -8.0480 0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8920 -7.4760 -0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2630 -7.9920 2.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5060 -7.5140 1.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9950 -4.2640 1.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3890 -5.7960 2.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1080 -5.5510 3.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8660 -7.4090 4.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4720 -10.9880 3.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8260 -7.1100 7.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2770 -6.2630 6.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5240 -7.2670 9.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0870 -8.0630 9.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2260 -5.8240 9.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6490 -5.0400 9.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9710 -6.0620 11.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5540 -6.8320 11.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6450 -4.5640 11.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0550 -3.8100 11.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4250 -4.8560 13.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0160 -5.6190 13.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3450 -3.8470 3.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0130 -3.6330 15.1700 O 0 5 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 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 11 1 0 0 0 0 7 8 1 0 0 0 0 7 45 1 0 0 0 0 7 46 1 0 0 0 0 8 9 1 0 0 0 0 8 47 1 0 0 0 0 8 48 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 11 49 1 0 0 0 0 11 50 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 35 1 0 0 0 0 14 15 2 0 0 0 0 14 51 1 0 0 0 0 15 16 1 0 0 0 0 15 52 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 24 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 27 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 24 2 0 0 0 0 23 25 1 0 0 0 0 24 26 1 0 0 0 0 26 53 1 0 0 0 0 27 28 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 28 29 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 29 30 1 0 0 0 0 29 58 1 0 0 0 0 29 59 1 0 0 0 0 30 31 1 0 0 0 0 30 60 1 0 0 0 0 30 61 1 0 0 0 0 31 32 1 0 0 0 0 31 62 1 0 0 0 0 31 63 1 0 0 0 0 32 33 1 0 0 0 0 32 64 1 0 0 0 0 32 65 1 0 0 0 0 33 34 2 0 0 0 0 33 67 1 0 0 0 0 35 66 1 0 0 0 0 M CHG 1 67 -1 M END