PUBCHEM-ZINC05361273 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 0 0 0 0 0 0999 V2000 0.2050 1.1040 0.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 -0.0950 1.1160 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2380 -0.7100 0.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1500 -0.1700 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3620 -0.7920 -0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6740 -1.9660 0.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7590 -2.5100 1.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5420 -1.8860 1.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6450 -2.4170 2.4640 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0230 -3.6240 3.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9780 -2.6350 0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0230 -4.0140 0.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2660 -4.6310 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3950 -6.0230 -0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6290 -6.5700 -0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7680 -5.7560 -0.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6720 -4.3990 -0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4180 -3.8060 -0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2680 -2.4150 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0830 -1.8940 0.1560 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.9670 -0.4380 0.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0010 0.1840 -1.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1110 -0.5160 -2.0730 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.9830 -6.3280 -0.6990 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.1050 -5.4500 -0.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7550 -7.9180 -0.4920 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5600 -8.6930 -0.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1900 1.4920 0.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1680 0.8880 -0.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 1.8460 0.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9100 0.7400 -0.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0710 -0.3690 -0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9980 -3.4190 1.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2200 -3.9390 3.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9290 -3.4510 3.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2090 -4.4030 2.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1220 -4.6030 0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5250 -6.6580 -0.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5560 -3.7840 -0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1320 -1.7720 -0.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7970 -0.0560 0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0250 -0.1880 0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0100 -6.0340 -0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2050 -4.8820 0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9570 -4.7630 -1.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8600 -8.4000 -1.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1070 -8.5200 0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8020 -9.7510 -0.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9090 1.5170 -1.2290 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9360 1.8700 -2.1290 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 20 2 0 0 0 0 12 13 2 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 2 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 26 1 0 0 0 0 16 17 2 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 49 1 0 0 0 0 24 25 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 20 1 M END