IBS-ZINC04337866 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 0 0 0 0 0 0999 V2000 -0.0230 1.3920 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -0.0010 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 -0.7020 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 0.0470 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 1.4480 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 2.1300 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7540 1.8340 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5460 0.7210 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7180 -0.3680 -0.0400 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0230 -1.3320 -0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9730 0.7630 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6820 -0.2360 -0.0690 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4520 2.0750 0.0370 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5770 3.1580 0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2790 3.1270 0.0460 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8970 2.3070 0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4810 2.4010 -1.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4550 2.3190 -2.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9810 2.4670 -2.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8990 4.0970 -0.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3730 3.9090 -0.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9780 1.9130 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9320 -0.5550 -0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 -1.7870 -0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 3.2150 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0850 4.1360 0.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0800 3.2350 0.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3810 1.4890 0.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2200 1.4690 -1.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9850 3.2080 -1.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9770 3.0020 -3.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1980 1.2960 -3.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5060 1.7310 -2.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3220 2.3820 -3.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1840 5.1250 -0.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4240 3.4070 -0.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0720 4.0570 0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8880 4.6930 -1.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9500 2.5730 -1.3960 N 0 0 0 0 0 0 0 0 0 0 0 0 12.3910 3.8260 -2.3820 N 0 3 0 0 0 0 0 0 0 0 0 0 13.4160 3.9110 -2.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0210 4.5420 -3.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 2 0 0 0 0 7 15 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 2 0 0 0 0 14 26 1 0 0 0 0 16 17 1 0 0 0 0 16 27 1 0 0 0 0 16 28 1 0 0 0 0 17 29 1 0 0 0 0 17 30 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 31 1 0 0 0 0 18 32 1 0 0 0 0 18 39 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 20 40 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 40 41 1 0 0 0 0 40 42 1 0 0 0 0 M CHG 1 40 1 M END