PUBCHEM-ZINC03738256 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 63 0 0 1 0 0 0 0 0999 V2000 -0.4130 1.8550 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2070 0.3660 -0.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0610 -0.1270 0.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4550 -0.4260 0.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4030 -1.9070 -0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6620 -2.4860 0.1400 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8650 -3.8130 -0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9010 -4.6600 -0.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1980 -6.0020 -0.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4700 -6.5230 -0.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4350 -5.6690 -0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1440 -4.3220 0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0330 -3.4290 0.6980 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3550 -3.8760 0.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8020 -7.9820 -0.9190 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.8780 -8.1470 -0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4400 -8.4850 -2.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8500 -9.7030 -2.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7100 -9.8000 -3.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1870 -10.7730 -4.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2050 -10.5530 -6.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7390 -9.3700 -6.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2650 -8.3850 -5.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2370 -8.6270 -4.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6810 -7.8460 -3.4680 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1140 -6.9380 -3.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6690 -11.5760 -6.9680 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6590 -11.4190 -8.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4650 -10.6630 -1.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2070 -10.3390 -0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4510 2.4400 -0.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2940 2.2370 -0.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5530 2.0350 1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 0.2530 -1.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3040 -1.1530 0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9200 0.4970 0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9520 -0.0980 1.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6170 -0.3340 1.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3460 0.0180 -0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2270 -2.0050 -1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6060 -2.4070 0.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9030 -4.3080 -0.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4210 -6.6270 -1.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4180 -6.0700 0.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3600 -4.6650 1.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9210 -3.0290 1.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8530 -4.2050 0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7700 -11.6970 -4.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7650 -9.1740 -7.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6790 -7.4690 -6.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0490 -10.5600 -8.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2050 -12.3150 -8.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6770 -11.3380 -8.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6880 -11.6920 -1.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3830 -10.5930 -1.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2700 -10.5980 -0.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7550 -10.8580 0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1350 -8.8610 0.1200 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.1500 -8.5800 0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5550 -8.6630 1.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 43 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 58 1 0 0 0 0 17 18 2 0 0 0 0 17 25 1 0 0 0 0 18 19 1 0 0 0 0 18 29 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 27 1 0 0 0 0 22 23 2 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 27 28 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 30 56 1 0 0 0 0 30 57 1 0 0 0 0 30 58 1 0 0 0 0 58 59 1 0 0 0 0 58 60 1 0 0 0 0 M CHG 1 58 1 M END