PUBCHEM-ZINC04685171 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -0.6180 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 0.1390 2.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8420 -0.4840 3.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8990 -1.8640 3.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3190 -2.6260 2.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 -2.0020 1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3760 -3.9830 2.2150 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0490 -4.5570 3.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0120 -6.0600 3.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4640 -6.5870 2.2860 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5860 -6.8140 4.1790 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5230 -8.0230 4.0370 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0600 -8.8100 4.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9850 -10.2790 4.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3380 -10.8210 3.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2710 -12.1900 3.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8440 -13.0250 4.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4860 -12.4930 5.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5640 -11.1250 5.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0940 -13.3930 6.5390 N 0 3 0 0 0 0 0 0 0 0 0 0 4.0290 -14.6010 6.3940 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6600 -12.9260 7.5110 O 0 5 0 0 0 0 0 0 0 0 0 0 3.7020 -8.2750 6.0260 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 1.2180 2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2940 0.1070 3.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 -2.3500 3.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 -2.5940 0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0850 -4.2200 3.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5530 -4.2460 4.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8910 -10.1710 2.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7710 -12.6120 2.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7880 -14.0960 4.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0700 -10.7110 6.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7520 -7.3130 6.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1030 -8.8620 6.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 25 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 38 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END