IBS-ZINC04869619 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 34 0 0 0 0 0 0 0 0999 V2000 1.1630 -1.1360 2.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4560 -1.0460 1.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8350 -1.7040 1.1170 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5910 -1.7150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1810 -1.1880 -1.0160 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9090 -2.3620 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0050 -3.7400 -0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8890 -4.4930 -0.1300 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9880 -5.8890 -0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2340 -6.4990 -0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3290 -7.8780 -0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1840 -8.6540 -0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9380 -8.0560 -0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8330 -6.6720 -0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4260 -6.0640 -0.1900 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0810 -1.5790 0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1640 -2.1190 0.2440 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9850 -0.0750 0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1330 -0.6420 2.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5550 -0.6460 3.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3060 -2.1830 2.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3140 0.0010 0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 -1.5360 0.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9750 -4.2080 -0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0170 -4.0690 -0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1300 -5.8960 -0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3000 -8.3510 -0.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2640 -9.7310 -0.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0470 -8.6650 -0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4980 -5.0970 -0.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 -6.6100 -0.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1490 0.3100 -0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7410 0.3310 0.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9940 0.2220 0.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 16 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 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 12 13 2 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 M END