IBS-ZINC02207604 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 51 0 0 1 0 0 0 0 0999 V2000 1.7120 1.8700 0.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7040 0.7630 0.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6190 -0.2850 1.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6830 1.3990 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 0.1460 -1.1240 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1610 -0.5220 -1.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0420 -0.6670 -0.5050 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2410 -1.0190 -2.6400 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4230 -1.7550 -3.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0210 -1.1270 -4.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9700 -1.0010 -5.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7400 -0.2370 -4.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 -0.8640 -3.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5510 -0.3030 -6.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5620 0.3930 -6.6200 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8310 -0.5270 -7.8170 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1650 0.0080 -9.1470 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5650 1.0210 -9.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1640 -0.8840 -9.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5550 -0.8930 -9.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7300 -1.8040 -10.3350 S 0 0 0 0 0 0 0 0 0 0 0 0 8.1980 -1.6460 -9.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9010 0.0600 -10.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9500 -0.6850 -9.6660 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7080 1.4690 0.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8220 2.5580 -0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4000 2.4450 1.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2370 0.1520 2.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 -1.1110 0.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5960 -0.7250 1.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6710 2.1290 -0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4260 0.6410 -0.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0230 1.9040 0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1770 -1.7890 -2.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1120 -2.7880 -3.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4200 -0.1360 -4.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8680 -1.7290 -4.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6630 -2.0120 -5.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0150 0.8080 -4.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9540 -0.2160 -5.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7940 -1.8650 -3.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3570 -0.2600 -3.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9720 -1.0770 -7.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7760 -1.9110 -9.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2450 -0.5300 -10.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9220 0.1300 -9.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5320 -1.3920 -8.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0410 -2.1450 -9.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4540 -0.5920 -9.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0280 -2.1170 -8.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9720 0.8300 -11.0580 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 23 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 23 24 2 0 0 0 0 23 51 1 0 0 0 0 M CHG 1 51 -1 M END