PUBCHEM-ZINC06613135 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 0 0 0 0 0 0999 V2000 0.0700 1.6090 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 0.1070 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 -0.5700 1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 -1.9620 1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.7240 0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -2.0890 -1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -0.6980 -1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -0.3470 -2.5140 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 0.6070 -2.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0880 -1.4520 -3.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 -2.5670 -2.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0710 -4.0090 -2.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4610 -4.4580 -3.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4630 -5.9270 -3.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8390 -6.3480 -4.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1500 -1.3360 -4.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7770 -0.2680 -5.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 -0.2290 -6.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1550 -1.2450 -7.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4370 -2.2710 -6.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4470 -2.3430 -5.4740 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1360 -2.7010 2.4390 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 -1.9850 3.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9770 0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 2.0100 -1.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7730 1.9980 0.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 0.0370 2.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -3.8080 0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -4.1820 -3.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 -4.6390 -2.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1840 -4.3060 -2.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8000 -3.8400 -4.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7210 -6.0860 -4.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1630 -6.5520 -2.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6050 -6.2300 -3.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1370 -5.8030 -5.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2710 0.5230 -4.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2590 0.5920 -7.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1320 -1.2340 -8.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9380 -3.0890 -7.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2710 -2.7160 4.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1490 -1.3900 3.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6550 -1.3600 3.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8080 -7.7860 -4.6380 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.7280 -8.1070 -4.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5530 -8.3660 -3.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1290 -7.9830 -5.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 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 27 1 0 0 0 0 4 5 1 0 0 0 0 4 22 1 0 0 0 0 5 6 2 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 22 23 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 44 45 1 0 0 0 0 44 46 1 0 0 0 0 44 47 1 0 0 0 0 M CHG 1 44 1 M END