PUBCHEM-ZINC01568708 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2950 -0.6030 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1540 -2.1260 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 -2.5650 1.2450 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2870 -3.8760 1.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6100 -4.6930 0.6220 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3690 -4.3280 2.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5050 -5.7860 2.7290 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3650 -6.6860 3.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1390 -7.9120 3.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2860 -7.7650 2.3650 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 -6.4950 2.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6700 -5.9240 1.4490 N 0 3 0 0 0 0 0 0 0 0 0 0 2.7770 -4.7170 1.3260 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5190 -6.6620 0.9810 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8320 -0.2940 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8490 -0.2840 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1400 -2.5820 -0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 -2.4290 -0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2570 -1.9120 1.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3560 -3.8720 2.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2430 -4.0250 3.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2800 -6.4570 3.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3020 -8.8500 3.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 22 1 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 28 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M END