IBS-ZINC02108714 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 32 0 0 1 0 0 0 0 0999 V2000 -0.0250 1.5710 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0250 0.0420 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4500 -0.5150 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4480 -2.0460 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8490 -2.6400 0.0770 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4580 -2.2390 0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8480 -4.1910 0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5510 -4.6320 -0.8200 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3980 2.1300 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 3.6580 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8150 4.2190 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9130 5.7470 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8260 6.3820 -0.1210 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 1.9100 -0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5920 1.9650 0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 -0.3510 -0.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4810 -0.2970 0.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0150 -0.1290 0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9530 -0.1590 -0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8870 -2.4370 -0.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9050 -2.3780 0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9050 1.7960 0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9660 1.7320 -0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8850 3.9910 -0.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 4.0560 0.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3220 3.8870 0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3820 3.8190 -0.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2200 -4.7480 1.0830 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.5830 -2.3000 -1.2060 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.8890 -3.2920 -1.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9890 -1.9700 -1.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4240 -1.7340 -1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0990 6.1880 -0.0140 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 9 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 3 1 0 0 0 0 2 16 1 0 0 0 0 2 17 1 0 0 0 0 3 4 1 0 0 0 0 3 18 1 0 0 0 0 3 19 1 0 0 0 0 4 5 1 0 0 0 0 4 20 1 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 29 1 0 0 0 0 7 8 2 0 0 0 0 7 28 1 0 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 9 23 1 0 0 0 0 10 11 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 12 13 2 0 0 0 0 12 33 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 M CHG 1 28 -1 M CHG 1 29 1 M CHG 1 33 -1 M END