PUBCHEM-ZINC05784706 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 31 0 0 0 0 0 0 0 0999 V2000 -0.5200 1.1240 -0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2900 -0.2160 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0220 -0.7120 -0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0880 0.1790 -0.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8450 1.5180 -0.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5420 2.0030 -0.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3010 3.3670 -0.4340 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 3.8630 -0.3240 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3770 4.2610 -0.6510 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4710 -0.3350 -0.4530 N 0 3 0 0 0 0 0 0 0 0 0 0 4.3940 0.4380 -0.6400 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6870 -1.5300 -0.3620 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2550 -2.0340 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7940 -2.7090 1.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9200 -4.1680 1.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 -4.8570 2.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1880 -4.1450 3.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6470 -4.8170 4.2630 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3150 -2.6840 3.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1610 -1.9970 2.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5270 1.5060 -0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1130 -0.8950 0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6630 2.2030 -0.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0880 4.8240 -0.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1120 5.1890 -0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3900 -4.6920 0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 -5.9320 2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0700 -4.3460 4.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7850 -2.1590 4.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -0.9210 2.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 6 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 3 4 2 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 5 6 2 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 24 1 0 0 0 0 9 25 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 2 0 0 0 0 15 26 1 0 0 0 0 16 17 1 0 0 0 0 16 27 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 18 28 1 0 0 0 0 19 20 2 0 0 0 0 19 29 1 0 0 0 0 20 30 1 0 0 0 0 M CHG 1 10 1 M CHG 1 12 -1 M END