PUBCHEM-ZINC02183387 MOE2007 3D CORINA 3.40 0006 02.08.2006 69 73 0 0 0 0 0 0 0 0999 V2000 -2.1190 0.9120 -7.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7190 -0.1430 -6.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9870 -0.6490 -6.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6130 -1.6130 -5.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9870 -2.0800 -4.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7370 -1.5800 -4.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0900 -0.6070 -5.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7620 -0.1430 -4.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4300 -0.8490 -4.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4910 -0.0380 -4.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8420 -0.3590 -3.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7100 0.6100 -3.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2630 1.9060 -3.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9320 2.2480 -3.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0620 1.2630 -3.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6030 1.4600 -4.1730 S 0 0 0 0 0 0 0 0 0 0 0 0 4.1830 2.7930 -2.5520 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2800 4.3060 -3.1560 S 0 0 0 0 0 0 0 0 0 0 0 0 5.7810 4.8290 -2.5860 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8080 4.9430 -1.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5680 4.3070 -2.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3930 4.2360 -4.5970 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2880 5.1340 -2.5040 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5880 -2.2550 -5.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1020 -3.0820 -4.2700 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 -2.6970 -6.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5210 -3.9310 -6.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9910 -4.3530 -7.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8050 -3.5620 -8.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1400 -2.3390 -8.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3300 -1.9090 -7.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3190 -4.0900 -10.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9950 -3.4180 -11.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -4.2800 -12.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4070 -5.8640 -12.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8500 -6.1980 -12.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7960 -5.0540 -12.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3370 -3.7500 -12.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8940 -3.4250 -12.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3750 1.9080 -6.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0320 0.8190 -7.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5000 0.8210 -8.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 -0.2890 -7.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5920 -1.9930 -6.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4750 -2.8250 -4.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2700 -1.9520 -3.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2140 -1.3670 -3.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7420 0.3420 -3.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5530 3.2450 -3.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6740 -4.5590 -5.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5030 -5.3090 -7.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -1.6900 -9.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8540 -0.9580 -7.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4590 -2.4260 -11.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0920 -3.3180 -11.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3850 -3.8070 -13.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0010 -5.2460 -12.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7390 -6.6560 -12.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2680 -5.7180 -13.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1570 -7.1030 -13.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9240 -6.4230 -11.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8400 -4.9290 -13.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8100 -5.2970 -12.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9890 -2.9310 -12.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4380 -3.8260 -11.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7660 -3.2600 -13.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5610 -2.5380 -12.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0020 -4.5800 -12.1900 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.1100 -4.7320 -11.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 43 1 0 0 0 0 4 5 1 0 0 0 0 4 44 1 0 0 0 0 5 6 2 0 0 0 0 5 45 1 0 0 0 0 6 7 1 0 0 0 0 6 46 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 47 1 0 0 0 0 12 13 1 0 0 0 0 12 48 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 49 1 0 0 0 0 15 16 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 22 2 0 0 0 0 18 23 2 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 29 30 2 0 0 0 0 29 32 1 0 0 0 0 30 31 1 0 0 0 0 30 52 1 0 0 0 0 31 53 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 33 54 1 0 0 0 0 33 55 1 0 0 0 0 34 56 1 0 0 0 0 34 57 1 0 0 0 0 34 68 1 0 0 0 0 35 36 1 0 0 0 0 35 58 1 0 0 0 0 35 59 1 0 0 0 0 35 68 1 0 0 0 0 36 37 1 0 0 0 0 36 60 1 0 0 0 0 36 61 1 0 0 0 0 37 38 1 0 0 0 0 37 62 1 0 0 0 0 37 63 1 0 0 0 0 38 39 1 0 0 0 0 38 64 1 0 0 0 0 38 65 1 0 0 0 0 39 66 1 0 0 0 0 39 67 1 0 0 0 0 39 68 1 0 0 0 0 68 69 1 0 0 0 0 M CHG 1 68 1 M END