PUBCHEM-ZINC06492709 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 0 0 0 0 0 0999 V2000 1.0600 0.8650 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -0.2490 0.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3730 -0.4810 1.3650 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1650 -1.6100 1.6120 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7170 -1.7940 2.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4040 -2.7740 3.0410 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5060 -0.8920 3.8060 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1520 -1.0340 5.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3110 -2.2950 5.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9480 -2.4320 6.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4280 -1.3160 7.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2720 -0.0590 6.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6310 0.0850 5.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3890 -1.0760 -0.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7020 -1.5510 -0.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1270 -2.3230 -2.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 -2.6280 -3.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -2.1610 -3.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4840 -1.3820 -2.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9730 -2.4920 -4.1680 N 0 3 0 0 0 0 0 0 0 0 0 0 0.5880 -3.1750 -5.1000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1190 -2.0820 -4.1460 O 0 5 0 0 0 0 0 0 0 0 0 0 2.0740 0.4790 0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9250 1.2640 -1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8940 1.6560 0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3160 -2.2600 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9080 -0.1440 3.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9370 -3.1670 5.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0720 -3.4120 7.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9270 -1.4260 8.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 0.8100 7.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5050 1.0670 5.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3840 -1.3150 -0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1420 -2.6910 -2.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5920 -3.2330 -3.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4990 -1.0140 -1.9920 H 0 0 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 14 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 27 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 28 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 11 12 2 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END