PUBCHEM-ZINC02051715 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 46 0 0 0 0 0 0 0 0999 V2000 -1.3020 1.4120 -1.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1970 -0.0890 -1.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1890 -0.7710 -1.4540 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.6690 -1.1640 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -2.0180 -0.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 -2.5590 0.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 -3.9300 0.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -4.7630 -0.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -4.2260 -1.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -2.8560 -2.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 -2.2820 -3.4640 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1410 -3.0180 -4.4330 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 -1.0740 -3.6170 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.0590 -4.5180 1.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4410 -4.7260 2.2310 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6560 -5.2480 3.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7200 -5.5220 4.1620 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0640 -5.4930 3.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0300 -6.0630 5.2750 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1810 -6.3650 5.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2470 -6.1660 5.3590 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1500 -6.8890 7.1480 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4280 -7.1910 7.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1840 -8.2080 6.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1930 -7.7740 9.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2540 -5.9080 7.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4650 1.8180 -0.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3800 1.8200 -1.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1400 1.6830 -2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 -1.9080 1.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 -5.8340 -0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 -4.8790 -2.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4680 -5.4720 1.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4190 -3.8330 2.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6110 -4.5500 3.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5610 -6.1890 3.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1800 -6.2220 5.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5960 -9.1220 6.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1430 -8.4340 7.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3520 -7.7920 5.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6540 -7.0490 9.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1520 -8.0000 9.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6040 -8.6880 9.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4210 -5.4920 6.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2130 -6.1340 8.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7150 -5.1830 8.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 14 1 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 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 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 M CHG 1 11 1 M CHG 1 13 -1 M END