PUBCHEM-ZINC00293224 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 44 0 0 0 0 0 0 0 0999 V2000 -0.0370 1.2840 0.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1320 -0.0980 0.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0890 -0.4350 -0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9300 0.6310 -0.1270 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2330 1.6930 0.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8600 2.9840 0.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0680 3.1950 0.0570 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5320 4.4700 0.2100 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8070 4.7780 -0.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5950 4.0170 -0.7970 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2190 6.2240 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1290 7.7680 -0.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5740 7.9140 -0.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0820 6.8120 -1.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9870 5.7780 -1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3400 4.8670 -0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8870 5.5860 1.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3930 5.8800 1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 -1.6760 -0.5620 N 0 3 0 0 0 0 0 0 0 0 0 0 0.8180 -2.6380 -0.5270 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7630 -1.7020 -0.9740 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.8060 1.9080 1.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9780 -0.7560 0.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2530 3.7930 0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9290 5.1610 0.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7750 6.8380 -0.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8930 6.5800 1.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9060 8.4500 0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4750 8.0250 -1.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6230 8.8650 -1.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2470 8.0610 -0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2600 6.3200 -2.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6880 7.2940 -2.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4000 5.1360 -1.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8470 6.2900 -0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5320 4.2760 -0.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1080 4.1380 0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1340 4.9410 1.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4740 6.4930 1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8790 4.9510 1.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1930 6.6180 2.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7510 6.3790 -0.0540 N 0 3 0 0 0 0 0 0 0 0 0 0 7.0040 5.7140 -0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 42 43 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M CHG 1 42 1 M END