PUBCHEM-ZINC06475114 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 0.2520 1.7950 0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 0.4040 0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2740 -0.3730 0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5400 0.2310 0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6360 1.6460 0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4620 2.4150 0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9010 2.2540 0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0240 1.4850 0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9440 0.0930 0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7170 -0.5420 0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7760 -2.6960 0.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5250 -3.2760 -0.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6460 -4.0200 -0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0240 -4.1880 1.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2810 -3.6110 2.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1580 -2.8660 1.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3640 -2.2480 2.8430 N 0 3 0 0 0 0 0 0 0 0 0 0 4.6660 -2.4460 4.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4080 -1.5430 2.5730 O 0 5 0 0 0 0 0 0 0 0 0 0 8.2260 -4.9860 1.3740 N 0 3 0 0 0 0 0 0 0 0 0 0 8.8820 -5.4950 0.4830 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5600 -5.1350 2.5360 O 0 5 0 0 0 0 0 0 0 0 0 0 6.0830 -0.6480 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0350 4.0110 0.1160 S 0 0 0 0 0 0 0 0 0 0 0 0 4.1510 4.4020 -1.2460 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0130 4.4920 0.9780 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6490 2.3890 0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8150 -0.0640 0.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 -1.4500 0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5190 3.4940 0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9920 1.9620 0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2300 -3.1460 -1.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2280 -4.4720 -1.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5790 -3.7440 3.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5050 -0.7890 0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3590 4.3630 0.7790 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6440 -1.9380 0.1230 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8080 -2.3800 -0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5330 5.3130 0.8290 H 0 0 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 10 2 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 23 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 11 37 1 0 0 0 0 12 13 2 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 23 35 1 0 0 0 0 24 25 2 0 0 0 0 24 26 2 0 0 0 0 24 36 1 0 0 0 0 36 39 1 0 0 0 0 37 38 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M CHG 1 20 1 M CHG 1 22 -1 M END