PUBCHEM-ZINC02729184 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 1 0 0 0 0 0999 V2000 -4.2700 1.9170 0.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0550 0.5380 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2440 0.3120 -1.2010 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5910 -0.5440 0.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9920 -0.2550 2.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5580 -1.2940 2.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7230 -2.6180 2.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3240 -2.9220 1.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7510 -1.8780 0.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4530 -4.2870 0.9970 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0720 -4.8680 -0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7110 -4.2640 -0.9520 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8590 -6.4000 -0.1640 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.7730 -6.5670 -0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3360 -6.9030 -1.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1870 -8.4100 -1.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9410 -9.1390 -0.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4660 -8.6980 0.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5480 -7.1730 0.9890 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.6040 -6.8710 1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9560 -6.9330 2.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9800 -6.1200 2.4350 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8930 2.4950 -0.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8030 1.8650 1.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3110 2.4260 0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8400 0.7650 2.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0910 -1.0760 3.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3850 -3.4180 3.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2100 -2.0820 -0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0490 -4.9710 1.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3900 -6.6330 -1.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7700 -6.4030 -2.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5700 -8.7200 -2.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1250 -8.6820 -1.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0160 -8.9470 -0.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7980 -10.2200 -0.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0690 -9.2200 1.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4300 -9.0350 0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5300 -7.5260 3.3520 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 2 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 30 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 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 M CHG 1 39 -1 M END