IBS-ZINC05178009 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 0 0 0 0 0 0999 V2000 0.7960 1.5680 0.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3420 0.6560 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4720 0.7140 -1.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7970 0.2340 -2.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7450 1.3220 -2.2750 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7320 1.2750 -1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1150 0.8900 0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3760 1.4010 -3.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2310 2.5340 -4.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8840 2.5680 -5.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6210 1.5240 -5.9020 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7370 0.4620 -5.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1340 0.3970 -3.9410 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5120 -0.6040 -5.5390 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1920 -0.5490 -6.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9760 -1.8450 -7.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0650 -2.9410 -7.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7680 3.6760 -6.3560 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4020 3.6740 -3.8520 N 0 3 0 0 0 0 0 0 0 0 0 0 1.9030 4.5720 -3.2000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2170 3.7140 -4.1340 O 0 5 0 0 0 0 0 0 0 0 0 0 0.7650 2.5200 -0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 1.7390 1.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1340 -0.3720 0.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2820 0.9720 0.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3110 0.0890 -1.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6780 1.7440 -1.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2270 -0.6150 -1.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5460 -0.0600 -3.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5030 0.5470 -1.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1980 2.2560 -1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8120 1.1640 0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9660 -0.1890 0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6060 -1.3880 -4.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4530 -0.4320 -7.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8780 0.2980 -6.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5520 -1.7680 -7.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6520 -2.0070 -6.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4930 -3.7970 -7.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2290 4.4330 -6.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2260 3.6930 -7.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 7 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 24 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 19 1 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 39 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END