PUBCHEM-ZINC06308600 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 1 0 0 0 0 0999 V2000 -0.1310 1.3260 -0.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.1770 -0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 -0.3740 1.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 -1.7870 1.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7740 -2.7300 0.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7180 -3.8940 1.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 -3.6550 2.9490 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2990 -2.3160 2.9100 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2520 -5.2530 1.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4110 -5.9800 0.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9770 -7.3480 0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6930 -7.9510 0.9180 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6220 -7.9550 -1.2300 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8750 -7.9140 -1.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4350 -6.7520 -2.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4370 -6.1100 -3.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7160 -7.0340 -3.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4440 -7.3530 -2.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6500 -7.1380 -2.2320 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7490 -8.7570 -1.0770 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3320 -9.9790 -0.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9880 -11.1120 -1.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3000 -10.7750 -2.3830 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3050 -2.4080 -0.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8350 -3.2490 -1.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2190 -0.9320 -0.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3030 -0.6740 -0.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7260 1.8930 -0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2040 1.5130 -1.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0340 1.7320 0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 -0.0720 1.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5890 0.2480 1.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2930 -5.8460 2.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2890 -5.1660 1.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3790 -5.3860 -0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6170 -6.1130 0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8370 -6.0010 -1.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2850 -7.1340 -2.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 -5.1950 -2.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9550 -5.7940 -4.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4050 -6.5360 -4.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3770 -7.9640 -4.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9440 -9.0000 -1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1740 -10.3010 0.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4930 -9.8140 0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1430 -0.4550 -0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2150 -0.8810 -1.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1860 -0.1350 -0.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4790 -1.7420 -0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2420 -0.5150 -1.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4140 -12.2580 -1.0440 O 0 5 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 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 20 2 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 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 17 42 1 0 0 0 0 18 19 2 0 0 0 0 20 21 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 23 2 0 0 0 0 22 51 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 M CHG 1 51 -1 M END