PUBCHEM-ZINC04199481 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 0 0 0 0 0 0999 V2000 0.3900 1.4690 0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3610 -0.0370 0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1560 -0.7320 1.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4550 -2.1640 0.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1260 -3.0630 1.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4090 -4.4040 1.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0190 -4.8610 0.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3470 -3.9780 -0.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0750 -2.6330 -0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9980 -4.4780 -1.6020 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.2440 -5.6650 -1.7230 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2880 -3.7020 -2.4950 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8950 -0.7460 -1.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9800 -1.9620 -1.1040 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3260 0.0050 -2.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8180 -0.6490 -3.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2510 0.1060 -4.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1540 1.5020 -4.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5630 2.2020 -5.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0670 1.5270 -6.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1650 0.1470 -6.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7660 -0.5670 -5.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7050 -0.5640 -7.9610 N 0 3 0 0 0 0 0 0 0 0 0 0 4.0620 0.0660 -8.9410 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7920 -1.7790 -7.9530 O 0 5 0 0 0 0 0 0 0 0 0 0 1.3240 1.8020 0.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3180 1.8630 -0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 1.8320 0.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3510 -0.2360 2.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 -2.7080 2.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1550 -5.1000 2.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2380 -5.9130 0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3370 -1.9450 -1.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 1.0820 -2.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8930 -1.7260 -3.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7610 2.0290 -3.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4890 3.2790 -5.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3850 2.0820 -7.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8480 -1.6440 -5.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 13 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 9 2 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 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 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 M CHG 1 10 1 M CHG 1 12 -1 M CHG 1 23 1 M CHG 1 25 -1 M END