PUBCHEM-ZINC04259356 MOE2007 3D CORINA 3.40 0006 02.08.2006 73 77 0 0 1 0 0 0 0 0999 V2000 2.4630 0.2360 2.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5570 -0.1910 1.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 -0.8600 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5540 -1.2580 -1.1540 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1500 -1.8730 -2.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3860 -2.2850 -3.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9870 -2.9090 -4.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3650 -3.1260 -4.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1300 -2.7100 -3.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5230 -2.0810 -2.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0150 -3.7960 -5.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7700 -3.5240 -6.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5810 -4.3690 -7.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2790 -5.1130 -6.7550 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9240 -4.7450 -5.4530 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2180 -6.0960 -7.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8760 -6.7990 -6.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8020 -7.7690 -6.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0730 -8.0390 -7.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4190 -7.3410 -8.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4880 -6.3750 -8.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8320 -2.5330 -7.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1970 -1.7240 -6.6970 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3050 -0.7820 -7.2270 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6450 0.0580 -6.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 -0.0020 -5.2060 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3130 1.0720 -6.9750 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0550 0.5630 -7.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4580 2.0780 -7.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9700 1.7590 -5.9080 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1870 2.3000 -6.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9290 2.8800 -5.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1640 3.4300 -5.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6670 3.4030 -6.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9190 2.8190 -7.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6820 2.2750 -7.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9950 3.9930 -7.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4990 3.9660 -8.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7360 4.5170 -8.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4740 5.0950 -7.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9790 5.1250 -6.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7460 4.5720 -6.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9600 -0.6410 2.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2110 0.9400 1.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8620 0.7130 2.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8090 -0.8950 1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 0.6860 0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1480 -0.1560 -0.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8980 -1.7370 0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3190 -2.1170 -3.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3920 -3.2300 -5.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1970 -2.8760 -3.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1150 -1.7550 -1.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6500 -4.4310 -8.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6650 -6.5880 -5.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3140 -8.3160 -5.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7970 -8.7980 -8.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6340 -7.5540 -9.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9740 -5.8330 -9.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6740 -2.4800 -8.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 -0.7340 -8.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9590 1.5540 -8.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 2.8110 -8.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 2.5860 -7.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5390 2.9010 -4.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7410 3.8820 -4.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3060 2.7960 -8.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1010 1.8260 -8.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9230 3.5150 -9.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1270 4.4970 -9.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4410 5.5250 -7.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5600 5.5780 -5.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3630 4.5910 -4.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 1 45 1 0 0 0 0 2 3 1 0 0 0 0 2 46 1 0 0 0 0 2 47 1 0 0 0 0 3 4 1 0 0 0 0 3 48 1 0 0 0 0 3 49 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 50 1 0 0 0 0 7 8 1 0 0 0 0 7 51 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 52 1 0 0 0 0 10 53 1 0 0 0 0 11 12 1 0 0 0 0 11 15 2 0 0 0 0 12 13 2 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 13 54 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 55 1 0 0 0 0 18 19 1 0 0 0 0 18 56 1 0 0 0 0 19 20 2 0 0 0 0 19 57 1 0 0 0 0 20 21 1 0 0 0 0 20 58 1 0 0 0 0 21 59 1 0 0 0 0 22 23 2 0 0 0 0 22 60 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 61 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 29 1 0 0 0 0 27 30 1 0 0 0 0 29 62 1 0 0 0 0 29 63 1 0 0 0 0 29 64 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 36 2 0 0 0 0 32 33 2 0 0 0 0 32 65 1 0 0 0 0 33 34 1 0 0 0 0 33 66 1 0 0 0 0 34 35 2 0 0 0 0 34 37 1 0 0 0 0 35 36 1 0 0 0 0 35 67 1 0 0 0 0 36 68 1 0 0 0 0 37 38 1 0 0 0 0 37 42 2 0 0 0 0 38 39 2 0 0 0 0 38 69 1 0 0 0 0 39 40 1 0 0 0 0 39 70 1 0 0 0 0 40 41 2 0 0 0 0 40 71 1 0 0 0 0 41 42 1 0 0 0 0 41 72 1 0 0 0 0 42 73 1 0 0 0 0 M END