PUBCHEM-ZINC05140692 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 43 0 0 0 0 0 0 0 0999 V2000 -1.2850 0.8520 0.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5930 1.0650 3.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9370 -0.4150 3.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4690 -0.8850 4.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9470 2.9780 1.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6480 3.4330 0.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5490 4.9550 0.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2200 5.3900 -0.7690 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2610 6.7470 -1.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7740 7.6950 -0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8150 9.0360 -0.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3420 9.4350 -1.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8280 8.4940 -2.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7840 7.1510 -2.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2980 6.1440 -3.2760 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.7290 5.0740 -3.3980 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2900 6.3850 -3.9400 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.3860 10.8720 -2.1020 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.9580 11.7020 -1.3190 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8490 11.2250 -3.1710 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.4300 -0.2270 0.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2250 1.0830 1.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6380 1.2040 -0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0930 1.6500 4.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5150 1.2000 3.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0150 -0.5500 3.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4370 -0.9990 2.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 -0.7500 4.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9690 -0.3010 5.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 -2.6420 5.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8980 3.2720 1.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4250 3.4440 2.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1700 2.9670 -0.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6970 3.1390 0.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0270 5.4210 1.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 5.2480 0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6370 4.7370 -1.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3630 7.3840 0.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4360 9.7730 0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2380 8.8090 -3.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0420 1.5170 1.9800 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7990 -2.3070 5.0310 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7850 -2.4680 4.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 2 41 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 5 41 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 30 42 1 0 0 0 0 42 43 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M CHG 1 18 1 M CHG 1 20 -1 M END