PUBCHEM-ZINC04608408 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 1 0 0 0 0 0999 V2000 -0.0100 1.5270 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 -0.0030 0.0040 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0110 -0.3810 0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8620 -0.5160 1.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0010 -1.9750 1.0630 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7120 -2.3560 -0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8910 -1.9180 -1.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 -0.4830 -1.2580 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8480 0.3690 -2.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 1.5600 -2.1160 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3450 -0.1580 -3.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6350 -2.5000 2.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9190 -2.0870 2.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5430 -2.6080 3.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8900 -3.5390 4.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6120 -3.9520 4.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9800 -3.4300 2.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3910 -3.8680 2.6410 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.9640 -4.6840 3.3400 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9460 -3.4120 1.6580 O 0 5 0 0 0 0 0 0 0 0 0 0 3.5630 -4.0960 5.6230 N 0 3 0 0 0 0 0 0 0 0 0 0 4.6890 -3.7330 5.9120 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9890 -4.9160 6.3170 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9910 1.9020 -0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7010 1.8870 -0.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3310 1.8800 0.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8480 -0.0530 1.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3800 -0.2640 2.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6860 -1.8670 -0.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8470 -3.4370 -0.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4650 -2.0940 -2.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -2.4830 -1.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6100 -0.8460 -4.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4960 0.6730 -4.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2900 -0.6810 -3.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4290 -1.3600 1.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5410 -2.2870 3.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 -4.6790 4.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 21 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M CHG 1 21 1 M CHG 1 23 -1 M END