NCID-ZINC01733837 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 40 0 0 0 0 0 0 0 0999 V2000 -1.0570 -2.6460 0.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9740 -1.6900 -0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0010 0.7010 -0.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9420 0.6850 -2.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2190 0.1880 1.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3930 1.3090 2.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9820 1.7830 3.3630 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1340 2.5430 3.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7500 2.8010 2.3080 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6980 3.0260 4.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9860 2.9960 5.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5870 3.4450 7.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9010 3.9320 6.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6180 3.9850 5.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0090 3.5400 4.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7540 3.6310 3.4710 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5260 4.3950 8.2300 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.8590 4.3150 9.2710 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6820 4.8330 8.1640 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.2950 -3.6780 0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -2.4650 0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1600 -2.5580 1.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8470 -1.8330 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0280 -1.8410 0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0770 1.7100 -0.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9860 0.3990 -1.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 0.9750 -1.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8430 -0.3010 -2.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2080 1.3970 -2.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2320 -0.6780 2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2580 0.4730 1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3870 0.9480 2.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2910 2.1680 1.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5230 1.5390 4.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 2.6480 5.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0140 3.4100 7.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6350 4.3680 5.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1670 3.3680 2.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6120 -0.2490 0.1470 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.5880 -0.2100 0.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 23 1 0 0 0 0 2 24 1 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 3 39 1 0 0 0 0 4 27 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 30 1 0 0 0 0 5 31 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 39 40 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M CHG 1 39 1 M END