PUBCHEM-ZINC04687458 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 0 0 0 0 0 0999 V2000 0.4090 1.1600 -0.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3000 -0.1910 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9380 -0.0910 1.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1510 -0.5700 0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0020 0.2940 0.0830 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5040 -1.8680 0.1320 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9200 -2.2650 0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1420 -3.1970 1.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1850 -4.3100 1.2880 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8010 -3.8310 1.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 -2.9250 0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4620 -5.2680 2.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6690 -6.4040 2.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9420 -7.3500 3.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0090 -7.1650 4.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8020 -6.0300 4.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5260 -5.0820 3.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2860 -8.1250 5.1930 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5600 -8.3580 5.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4740 -7.8030 4.9890 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8450 -9.2860 6.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7820 -9.9240 7.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0190 -10.7810 8.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3390 -11.0410 8.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6080 -11.9240 9.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8960 -12.1560 10.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9570 -11.5300 9.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7360 -10.6690 8.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4180 -10.4040 8.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1550 -9.5170 7.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4590 1.4340 -0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0450 1.0880 -1.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 1.9200 -0.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8190 -0.9510 -0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 -1.0250 1.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0070 0.0950 1.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4790 0.7290 1.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5470 -1.3800 0.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1710 -2.7880 -0.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9900 -2.6430 2.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1580 -3.5890 1.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6820 -3.2670 2.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1200 -4.6820 1.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5050 -3.5100 -0.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5010 -2.4760 0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8390 -6.5480 1.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3260 -8.2330 3.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6320 -5.8870 4.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1390 -4.1960 3.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5620 -8.6220 5.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7660 -9.7300 7.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1920 -11.2640 8.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7960 -12.4170 10.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0990 -12.8350 11.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9700 -11.7320 9.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5680 -10.1910 8.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9680 -9.0210 6.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 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 11 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 11 44 1 0 0 0 0 11 45 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 46 1 0 0 0 0 14 15 1 0 0 0 0 14 47 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 48 1 0 0 0 0 17 49 1 0 0 0 0 18 19 1 0 0 0 0 18 50 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 30 2 0 0 0 0 22 23 2 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 53 1 0 0 0 0 26 27 1 0 0 0 0 26 54 1 0 0 0 0 27 28 2 0 0 0 0 27 55 1 0 0 0 0 28 29 1 0 0 0 0 28 56 1 0 0 0 0 29 30 1 0 0 0 0 30 57 1 0 0 0 0 M END