PUBCHEM-ZINC06753397 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 30 0 0 1 0 0 0 0 0999 V2000 0.0510 1.4750 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -0.0550 0.0640 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5980 -0.3440 0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4370 -0.5480 0.1770 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0420 -0.1260 -0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5020 -2.0710 0.1060 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5510 -2.3870 0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6630 -2.6640 -1.0520 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2030 -2.3380 -1.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 -1.9740 -1.1560 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6350 -0.5570 -1.1230 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8800 -2.5380 -0.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9310 -2.4650 0.9910 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8250 -3.0690 -1.0550 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5200 -2.9320 -2.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2000 -3.3140 -3.3090 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3200 -2.2670 -2.4590 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9900 -3.6800 -0.6130 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5370 -3.9670 -0.8080 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.0360 -2.5880 1.3640 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6990 -3.4720 1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9970 -0.1350 1.4280 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7600 -0.8700 2.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4050 1.8950 -0.2120 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7740 1.2740 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5150 1.8340 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3400 1.9520 0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8830 -2.0210 -3.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3030 -4.1180 -1.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 11 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 22 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 20 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 19 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 28 1 0 0 0 0 18 29 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 24 25 1 0 0 0 0 M CHG 1 19 -1 M END