PUBCHEM-ZINC02859621 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 43 0 0 1 0 0 0 0 0999 V2000 -0.7120 -2.5110 0.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 -2.0300 1.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 -0.5010 1.1170 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2440 -0.1060 0.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -0.0100 2.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0520 1.5160 2.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8470 1.9900 3.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2790 1.1870 4.3370 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0800 3.3060 3.7110 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8190 3.7460 4.8160 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0510 5.0620 4.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6200 5.8650 4.1900 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8470 5.5360 6.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9620 7.0380 6.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0230 7.6340 5.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1280 9.0120 5.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1720 9.7940 6.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1110 9.1990 6.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0090 7.8210 6.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2840 11.2700 6.0300 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.2180 11.7940 5.4520 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4420 11.9590 6.5770 O 0 5 0 0 0 0 0 0 0 0 0 0 2.1910 -0.0240 1.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6100 0.6410 2.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1670 -2.0440 0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7250 -3.5940 0.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2740 -2.2370 1.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 -2.4240 2.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3180 -2.3830 0.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9310 -0.4480 2.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6470 -0.3070 3.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 1.9570 2.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5550 1.8180 1.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7340 3.9480 3.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1640 3.1040 5.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8430 5.0950 6.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3440 5.2340 7.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7700 7.0230 5.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9570 9.4770 4.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3640 9.8100 7.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1820 7.3550 7.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9990 -0.3380 0.0870 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9080 -0.0090 0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 23 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 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 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 42 43 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END