PUBCHEM-ZINC00466140 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 0 0 0 0 0 0999 V2000 0.9840 1.4680 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8500 -0.0330 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9010 -0.8040 1.0080 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7690 -2.0460 0.8300 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 -2.4650 -0.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5880 -1.0510 -1.4480 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4270 -3.7860 -0.7880 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4450 -4.7730 0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -4.5070 1.3060 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2710 -6.1790 -0.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -6.4870 -1.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 -7.8000 -2.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 -8.8140 -1.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 -8.5180 0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2950 -7.2020 0.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1410 -9.5470 1.1980 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3440 -9.3320 2.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8830 -8.2750 2.7030 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2210 -10.3800 3.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7230 -10.1600 4.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6060 -11.1420 5.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -12.3440 5.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5080 -12.5680 4.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3920 -11.5960 3.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0330 1.7390 -0.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4070 1.8850 -0.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6090 1.8650 0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3000 -3.9990 -1.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -5.6980 -2.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2150 -8.0360 -3.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 -9.8400 -1.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4400 -6.9700 1.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5020 -10.4170 0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2020 -9.2220 4.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9930 -10.9730 6.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 -13.1100 6.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 -13.5080 3.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7780 -11.7750 2.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 28 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 29 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 14 2 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 16 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 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 34 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 22 23 2 0 0 0 0 22 36 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 24 38 1 0 0 0 0 M END