PUBCHEM-ZINC00038644 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 1 0 0 0 0 0999 V2000 -1.8660 0.6610 1.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7050 -0.1190 0.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4470 -0.3890 1.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5280 -1.0660 0.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4850 -1.5070 -0.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3510 -1.2870 -1.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7280 -0.6070 -0.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8980 -0.4360 -1.6670 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.9630 -0.9280 -1.2730 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7330 0.1600 -2.7420 O 0 5 0 0 0 0 0 0 0 0 0 0 0.4910 0.0220 2.6510 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5590 -0.0420 3.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6410 -0.5840 3.3160 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3000 0.7040 4.8660 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9060 1.6970 4.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6440 0.9230 5.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4780 1.6290 6.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5340 0.8510 7.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1800 0.6440 7.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 -0.0250 5.7810 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6130 -1.0670 5.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 -0.0570 5.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3230 0.5500 4.1380 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5110 1.5210 1.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5000 1.0950 0.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4840 0.0140 1.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4330 -1.2880 1.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3380 -2.0340 -1.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3150 -1.6470 -2.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3890 0.4040 3.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1430 -0.0410 5.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3150 1.5120 4.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4540 1.7320 7.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0900 2.6420 6.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9750 -0.1230 8.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4010 1.3900 8.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4450 0.0400 7.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3220 1.6160 7.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9880 -0.7080 5.9290 O 0 5 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 20 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 M CHG 1 8 1 M CHG 1 10 -1 M CHG 1 39 -1 M END