PUBCHEM-ZINC03871354 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -0.6750 1.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1300 -0.0670 1.9120 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 -2.1820 0.9950 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0640 -2.5500 0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8050 -2.7400 1.1710 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4400 -2.0110 1.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6130 -3.9930 2.0550 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9420 -4.8880 1.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9100 -4.0430 2.3090 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3940 -4.6980 1.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3610 -2.6810 2.1330 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 -4.5020 3.6730 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4050 -3.7110 4.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6170 -4.4500 5.8120 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5460 -5.7570 5.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 -5.8070 4.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1340 -6.9900 3.5000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2680 -8.1030 4.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5310 -8.1070 5.4840 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6850 -6.9720 6.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9580 -6.9860 7.5150 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1000 -8.2620 8.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 -8.0020 9.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3530 -7.8820 10.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6190 -7.6430 11.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9330 -7.5240 12.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9760 -7.6450 11.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7030 -7.8890 10.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2060 -7.2820 13.6960 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3240 -3.8500 3.2870 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3620 -3.0990 -0.0950 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 -0.4910 -0.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4050 -2.6310 4.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1580 -9.0480 3.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0570 -6.1510 7.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 -8.8300 8.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9190 -8.8320 7.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3320 -7.9740 10.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8060 -7.5490 12.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9990 -7.5530 11.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5130 -7.9880 9.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4770 -7.1970 14.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1240 -7.1990 13.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2800 -3.7550 3.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4480 -2.3580 -0.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 37 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 13 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 33 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 32 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 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 38 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 28 29 2 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 29 45 1 0 0 0 0 30 46 1 0 0 0 0 31 47 1 0 0 0 0 31 48 1 0 0 0 0 32 49 1 0 0 0 0 33 50 1 0 0 0 0 M END