PUBCHEM-ZINC02886350 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.3620 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 -0.6880 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4250 0.0220 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4140 1.3880 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1910 2.0790 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 3.5470 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6940 4.2500 1.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6790 5.6360 1.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1800 6.5060 2.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9650 7.7830 1.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3570 7.7220 0.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 6.4380 0.1410 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 8.8430 -0.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3560 8.9370 -1.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9800 10.0200 -2.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2190 11.0320 -1.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 10.9570 -0.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1920 9.8700 0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 9.7700 1.9620 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.1800 12.2000 -2.6120 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1870 12.2760 -3.8740 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 13.1620 -2.0770 O 0 5 0 0 0 0 0 0 0 0 0 0 0.6330 4.2630 -1.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2030 4.8320 -1.9900 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 -2.1680 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1920 -2.7870 -0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.8900 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3650 -0.5100 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3450 1.9360 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1030 3.7100 1.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6280 6.1930 3.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2140 8.6810 2.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9490 8.1540 -2.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2770 10.0910 -3.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7620 11.7500 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4100 -2.8290 -0.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3700 -3.7950 -0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 24 25 3 0 0 0 0 26 27 2 0 0 0 0 26 38 1 0 0 0 0 38 39 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END