PUBCHEM-ZINC04522024 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 1 0 0 0 0 0999 V2000 -0.0980 1.5000 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 -0.0050 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 -0.7020 1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 -2.0820 1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -2.7670 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 -2.0710 -1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 -0.6900 -1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2500 0.0550 -2.4640 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.9400 -0.3950 -3.3610 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3250 1.1190 -2.6130 O 0 5 0 0 0 0 0 0 0 0 0 0 0.2830 -2.8410 2.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0480 -3.1450 3.0080 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7910 -4.2640 2.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9410 -4.1380 3.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9020 -2.9730 4.0990 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7680 -2.3760 3.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0750 -5.1310 3.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3860 -5.5200 4.9020 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4790 -5.8850 5.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4340 -6.6020 4.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5890 -6.3220 5.1370 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8970 1.9070 -0.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 1.8420 -0.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4590 1.8410 0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 -0.1660 2.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 -3.8460 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 -2.6060 -2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8240 -3.7710 2.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8320 -2.2350 3.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5090 -5.0900 2.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4580 -1.4230 4.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9590 -4.6830 3.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7890 -6.0200 2.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1780 -3.6280 5.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0860 -7.8770 4.6840 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8860 -4.3440 5.6280 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7270 -3.9860 5.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7930 -8.5370 4.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 11 12 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 2 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 2 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 36 1 0 0 0 0 20 21 2 0 0 0 0 20 35 1 0 0 0 0 34 36 1 0 0 0 0 35 38 1 0 0 0 0 36 37 1 0 0 0 0 M CHG 1 8 1 M CHG 1 10 -1 M END