PUBCHEM-ZINC02972628 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 -1.7320 1.6430 -0.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9980 0.3060 -0.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3720 0.4110 0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8370 -0.7870 0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5440 -1.3420 1.2200 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9610 -1.1460 -0.5500 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9550 -2.1090 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4080 -3.5360 0.2510 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6650 -3.7510 -0.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4720 -4.6100 0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7620 -4.4490 0.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6870 -5.4860 0.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2960 -6.6620 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0670 -6.8610 -0.5150 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1910 -5.8380 -0.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5410 -4.6050 1.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6110 -4.3620 2.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4000 -4.1920 4.0750 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4660 -3.1850 4.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4110 -3.4620 2.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1410 -4.9240 5.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1770 -5.2190 5.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4560 -5.9430 6.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5820 -6.4000 7.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8980 -6.1350 7.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1630 -5.4090 6.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4520 -5.2190 5.7280 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.1340 2.4400 -0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6890 1.6000 -0.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 1.9250 0.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8510 0.0320 -1.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8990 -0.5480 0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9930 1.1600 -0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2850 0.6960 1.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1300 -0.6990 -1.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4510 -1.6600 0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6980 -2.1730 -0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0670 -3.5250 1.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6900 -5.3790 1.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9810 -7.5000 -0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2170 -6.0510 -0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9670 -4.5800 0.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0620 -5.5650 1.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -5.2120 2.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 -3.4620 2.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0420 -3.1240 4.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0030 -2.1980 3.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9180 -4.4250 2.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1440 -2.6570 2.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0170 -4.8560 5.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4880 -6.1430 7.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3660 -6.9620 8.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7210 -6.4930 7.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6080 -3.5210 1.5610 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.0720 -2.6130 1.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 54 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 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 16 54 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 20 54 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 23 51 1 0 0 0 0 24 25 2 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 26 27 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END