PUBCHEM-ZINC05453267 MOE2007 3D CORINA 3.40 0006 02.08.2006 76 79 0 0 1 0 0 0 0 0999 V2000 0.1100 1.5850 0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 0.0560 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 -0.4500 -1.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7470 -0.5080 1.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 -0.1050 2.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6500 -0.6690 3.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 -0.2660 5.0010 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5590 -0.8240 4.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5030 -2.2350 4.6930 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5540 -0.8300 6.2440 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6590 -1.9120 6.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9420 -0.1690 6.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9280 0.4810 7.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8600 -0.3310 8.5850 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2510 -1.3100 8.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 -0.4740 7.4970 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2250 -1.5160 7.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8940 -0.9450 9.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8690 -0.5880 10.3240 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3860 -1.5060 10.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2370 0.3450 9.7930 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1940 1.3050 9.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2980 0.5220 10.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6410 1.0320 12.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6090 0.8130 12.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5700 0.0430 11.5150 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2680 -1.0390 12.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9560 -0.3910 13.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9070 0.2620 14.4510 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1670 -0.4830 14.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1600 1.3710 13.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5440 0.7890 15.6160 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6520 0.9880 10.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9500 0.8660 7.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1900 1.1600 5.0910 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 1.9120 0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3820 1.9870 -0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4000 1.9450 0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9840 -0.2700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8100 -0.1230 -1.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 -1.5390 -1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2780 -0.0480 -2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 -1.5950 1.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7590 -0.1100 1.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 0.9820 2.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0540 -0.5020 2.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 -1.7560 3.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6630 -0.2710 3.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0900 -0.6200 5.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0830 -0.3490 4.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3710 -2.6570 4.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7260 -0.9230 6.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0990 0.5950 5.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8990 0.3720 8.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6420 1.5310 7.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9770 -1.7090 7.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6980 -2.4380 8.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4530 -0.0480 8.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5860 -1.6850 9.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7740 -0.4370 11.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0480 1.2380 10.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2340 1.6070 12.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0120 -1.5450 11.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5310 -1.7620 12.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6570 0.3670 13.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4950 -1.1530 14.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3440 1.7680 14.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8780 2.1620 13.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9370 1.2190 16.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3660 0.4240 10.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1690 1.4530 11.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1900 1.7610 10.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6960 0.7690 6.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4400 1.1590 8.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2210 1.6260 7.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 1.5820 5.1520 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 45 1 0 0 0 0 5 46 1 0 0 0 0 6 7 1 0 0 0 0 6 47 1 0 0 0 0 6 48 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 49 1 0 0 0 0 8 50 1 0 0 0 0 9 51 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 52 1 0 0 0 0 12 53 1 0 0 0 0 13 14 1 0 0 0 0 13 54 1 0 0 0 0 13 55 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 21 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 56 1 0 0 0 0 17 57 1 0 0 0 0 18 19 1 0 0 0 0 18 58 1 0 0 0 0 18 59 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 26 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 60 1 0 0 0 0 23 61 1 0 0 0 0 24 25 2 0 0 0 0 24 62 1 0 0 0 0 25 26 1 0 0 0 0 25 31 1 0 0 0 0 26 27 1 0 0 0 0 26 33 1 0 0 0 0 27 28 1 0 0 0 0 27 63 1 0 0 0 0 27 64 1 0 0 0 0 28 29 1 0 0 0 0 28 65 1 0 0 0 0 28 66 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 31 67 1 0 0 0 0 31 68 1 0 0 0 0 32 69 1 0 0 0 0 33 70 1 0 0 0 0 33 71 1 0 0 0 0 33 72 1 0 0 0 0 34 73 1 0 0 0 0 34 74 1 0 0 0 0 34 75 1 0 0 0 0 35 76 1 0 0 0 0 M END