IBS-ZINC04811379 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 33 0 0 1 0 0 0 0 0999 V2000 0.7990 -0.3780 -1.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0050 0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 1.5170 0.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4310 -0.5250 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4190 -2.0550 0.0030 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7630 -2.4080 -0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8170 -2.5660 -0.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3500 -3.2700 0.5910 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9310 -2.5480 1.2940 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3610 -3.7660 1.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2510 -4.4560 0.3830 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 -4.2630 2.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 -5.5270 2.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 -5.9460 4.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 -5.1100 5.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4510 -3.9240 4.9890 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -3.4790 3.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8200 -0.0080 -1.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8150 -1.4630 -1.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3310 0.0690 -1.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 -0.4530 1.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 1.8780 0.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4080 1.9700 -0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6610 1.7870 1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0260 -0.1710 0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8640 -0.1590 -0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 -1.9970 2.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 -6.1590 1.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6340 -6.9140 4.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 -5.4340 6.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4340 -2.5000 3.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4690 -2.2400 -1.3600 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3640 -2.5920 -1.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 21 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 28 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 15 16 2 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 17 31 1 0 0 0 0 32 33 1 0 0 0 0 M END