IBS-ZINC04834855 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 35 0 0 1 0 0 0 0 0999 V2000 1.7820 0.3700 -0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2650 0.3100 -0.2660 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1290 1.2860 -0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3060 -0.0650 1.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8620 -1.2090 1.1650 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 -0.6760 -1.2720 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 -0.5410 -2.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4880 0.4300 -3.1810 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5100 -1.6360 -3.2950 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5010 -1.7440 -4.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8640 -2.1700 -5.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7990 -2.5980 -6.6760 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -1.7130 -7.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 -0.4940 -7.5990 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7190 -2.3650 -8.9310 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6840 -1.7240 -10.2530 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4780 -0.9700 -10.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6680 -1.0730 -10.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9250 -2.7760 -11.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9370 -3.9760 -10.9530 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1920 -0.5990 0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2480 0.6380 -1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0930 1.1130 0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5880 -1.4910 -0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9000 -2.3890 -2.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2650 -2.4840 -5.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 -0.7840 -5.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5840 -1.3480 -5.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2560 -3.0170 -4.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7830 -3.5850 -6.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 -3.3800 -9.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6920 -0.5860 -11.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4760 -1.8140 -10.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8970 -0.3130 -9.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1620 0.7940 2.0490 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0870 -2.3240 -12.5440 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 10 11 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 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 19 20 2 0 0 0 0 19 36 1 0 0 0 0 M CHG 1 35 -1 M CHG 1 36 -1 M END