PUBCHEM-ZINC03741186 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 0 0 0 0 0 0999 V2000 0.1660 1.2870 0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 -0.0440 -0.2460 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2610 -0.5940 -0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4080 0.1180 0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 -0.5220 0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7590 -1.8800 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6110 -2.6010 -0.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3630 -1.9680 -0.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1970 -2.5990 -0.8050 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 -4.0200 -0.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0650 -2.5310 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1840 -2.3230 -0.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1890 -3.2530 -0.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5100 -3.5350 -0.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2540 -4.5360 -0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6790 -5.2570 0.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3680 -5.0010 1.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6520 -3.9970 0.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3710 -3.5440 0.8420 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7420 -3.9050 1.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5200 -4.6980 -0.6650 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.3570 -5.6600 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5500 -5.3670 1.2610 F 0 0 0 0 0 0 0 0 0 0 0 0 -12.5600 -5.6500 -0.6590 F 0 0 0 0 0 0 0 0 0 0 0 0 -10.8380 -6.9010 -0.1560 F 0 0 0 0 0 0 0 0 0 0 0 0 -6.3100 -1.3250 -1.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5510 -1.7600 -3.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5760 -0.6740 -4.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7770 -1.1000 -5.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 1.5310 0.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3820 1.9980 -0.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1240 1.3810 1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3750 1.1760 0.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5280 0.0520 0.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7150 -3.6490 -0.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7750 -4.4470 -1.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -4.3490 -0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 -4.3870 0.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9590 -2.9740 -1.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2210 -6.0390 1.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9280 -5.5670 2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3670 -1.1700 -2.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9370 -0.3520 -1.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5080 -1.9930 -2.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9910 -2.6850 -3.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6140 -0.4630 -4.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1590 0.2560 -3.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7230 -1.2770 -5.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2020 -1.9890 -5.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8150 -0.0140 -6.5110 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.3220 -0.2870 -7.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3730 0.8480 -6.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7820 0.2180 -6.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 2 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 21 1 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 50 51 1 0 0 0 0 50 52 1 0 0 0 0 50 53 1 0 0 0 0 M CHG 1 50 1 M END