IBS-ZINC02129803 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 47 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -0.5030 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1590 -1.2130 2.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0190 -0.1610 1.4260 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7270 -0.6470 2.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1630 -0.1170 2.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9030 -0.6240 3.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3380 -0.0940 3.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0780 -0.6010 5.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4920 -0.0800 5.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8690 0.6250 4.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8000 -1.2870 -1.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0590 -1.5690 -1.9300 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1870 -1.7840 -0.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7020 -2.5900 -1.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0070 -3.0290 -1.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8030 -2.6750 -0.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3040 -1.8770 0.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9950 -1.4250 0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4550 -0.6230 1.1150 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0000 -0.3670 1.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1810 -0.2000 1.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7440 0.4970 1.9320 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4760 0.4060 0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2170 -0.2950 3.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7420 -1.7360 2.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6730 -0.4680 1.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1480 0.9730 2.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3920 -0.2720 4.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9170 -1.7140 3.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8480 -0.4460 2.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3230 0.9960 3.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5680 -0.2500 5.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0930 -1.6910 5.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0850 -2.8670 -2.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4110 -3.6540 -2.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8230 -3.0260 -0.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9320 -1.6060 1.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3320 -0.3980 6.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2290 -0.0400 6.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 14 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 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 11 40 1 0 0 0 0 12 13 2 0 0 0 0 12 45 1 0 0 0 0 14 15 1 0 0 0 0 14 25 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 22 2 0 0 0 0 18 19 2 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 2 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 45 46 1 0 0 0 0 M END