PUBCHEM-ZINC04831157 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 1 0 0 0 0 0999 V2000 -0.0430 1.2900 -0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 -0.1090 -0.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 -0.7850 -0.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3840 -0.0410 -0.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3500 1.3540 -0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 2.0310 -0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7480 1.9410 -0.0420 C 0 0 3 0 0 0 0 0 0 0 0 0 4.0300 2.8510 -1.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5250 3.1120 -1.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4070 1.8610 -1.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5810 0.5830 -1.2960 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0030 0.4960 -2.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6170 0.6500 -0.1110 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1850 0.5050 0.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7070 -0.4880 -0.2620 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1780 -1.7750 -0.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4920 -2.7880 -0.5540 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7030 -1.8540 -0.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4180 -0.7030 -1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9730 2.7370 1.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6310 2.0100 2.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9480 2.8090 3.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3700 3.9860 3.6860 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0030 1.7990 -0.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 -0.6710 -0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2420 -1.8660 -0.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1010 3.1120 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 2.3930 -2.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5050 3.8100 -1.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6520 3.5570 -2.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8830 3.8670 -0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0920 1.8170 -2.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0380 1.9510 -0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0260 -1.8740 0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0040 -2.8100 -0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6890 -1.0300 -2.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3670 -0.5050 -0.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0240 3.0510 1.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3820 3.6620 1.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5610 1.7740 2.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1780 1.0640 2.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7440 2.1730 4.9240 O 0 5 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 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 15 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 13 1 0 0 0 0 7 20 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 19 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 M CHG 1 42 -1 M END