IBS-ZINC04812991 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 0 0 0 0 0 0999 V2000 -2.1180 0.3330 -0.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.5480 -0.1810 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0450 -1.1610 1.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9470 -1.0020 1.8940 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1130 -2.0330 1.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 -2.6450 2.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 -2.5770 3.6170 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4700 -3.1790 4.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5640 -2.3910 5.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 -1.8760 8.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4960 -2.3640 9.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0670 -3.6720 9.5560 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2930 -4.6260 8.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2310 -4.2610 7.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 -2.2380 0.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1610 -2.9560 0.5740 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0150 -1.5450 -0.7870 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -0.7110 -1.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 -0.1600 -2.2320 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7150 1.3260 -0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5970 -0.0540 -1.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8660 0.4220 0.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0840 -3.2800 2.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4930 -2.0240 3.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4340 -3.1740 5.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1690 -4.2260 4.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5700 -2.4700 5.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2800 -1.3330 5.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9600 -0.9010 7.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4540 -1.8320 7.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1200 -1.6910 10.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4950 -2.3740 9.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7710 -5.6030 8.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2890 -4.6920 9.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2310 -4.2370 6.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5870 -4.9600 6.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7380 -1.6590 -1.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6440 -2.8610 7.1780 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.3100 -2.8730 7.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 18 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 15 1 0 0 0 0 6 7 1 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 38 39 1 0 0 0 0 M CHG 1 38 1 M END