PUBCHEM-ZINC03616326 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 51 0 0 1 0 0 0 0 0999 V2000 -0.6990 -0.3030 -4.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3140 -1.6490 -3.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1490 -1.5630 -2.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5720 -3.0130 -1.0950 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1730 -2.2980 -0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0160 -2.7050 -1.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3940 -4.4270 -0.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5840 -5.1870 -1.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1380 -4.7310 0.5900 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1070 -6.0560 1.2090 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1710 -6.5440 0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2700 -6.8700 0.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0210 -7.9240 -0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0740 -8.6740 -0.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3880 -8.3760 -0.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6520 -7.3280 0.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6010 -6.5770 1.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0980 -5.9380 2.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8660 -5.2050 3.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8220 -5.5800 4.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5420 -6.9230 4.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9980 -7.2840 3.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 -0.3820 -5.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4740 0.4520 -4.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0430 0.0470 -3.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9370 -1.9850 -4.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5140 -2.3890 -3.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5370 -1.2750 -1.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9830 -0.8650 -2.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6520 -2.6870 -0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1070 -1.7290 -1.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4260 -3.4640 -2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7570 -4.0460 1.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0030 -8.1680 -0.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8680 -9.4910 -1.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2070 -8.9600 -0.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6780 -7.0970 0.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8360 -5.7620 1.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9940 -5.4080 3.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9540 -5.5570 2.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9280 -4.1210 3.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7930 -5.6350 5.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3440 -4.8260 5.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8930 -7.6980 5.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4060 -6.8240 5.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9460 -7.8290 3.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2460 -7.9260 2.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7220 -2.9070 -2.3520 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.2540 -3.2640 -3.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9630 -3.6060 -2.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 48 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 7 1 0 0 0 0 4 48 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 48 49 1 0 0 0 0 48 50 1 0 0 0 0 M CHG 1 48 1 M END