PUBCHEM-ZINC01284372 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 0 0 0 0 0 0999 V2000 2.5900 -6.0880 -5.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9980 -5.8420 -4.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1130 -6.8020 -3.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5710 -6.5770 -2.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9110 -5.3920 -2.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7930 -4.4290 -3.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3420 -4.6500 -4.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 -3.7020 -5.2680 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 -2.4980 -4.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5220 -1.5720 -6.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0440 -1.9100 -7.1520 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0790 -0.3690 -6.0170 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 0.5300 -7.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 0.0580 -8.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 0.9480 -9.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1080 2.3060 -9.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1270 2.7790 -7.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 1.8950 -6.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1870 3.4380 -10.5530 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8000 4.6180 -10.0510 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6970 2.7080 -11.6600 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1510 4.5510 -10.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4580 4.8920 -10.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2250 5.5870 -9.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6580 5.9180 -8.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3540 5.5470 -7.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6450 4.8850 -8.8530 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6960 -7.6070 -1.2740 N 0 3 0 0 0 0 0 0 0 0 0 0 2.2760 -8.6520 -1.5090 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -7.4100 -0.1710 O 0 5 0 0 0 0 0 0 0 0 0 0 1.8480 -6.5700 -6.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8870 -5.1380 -6.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4620 -6.7340 -5.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6280 -7.7290 -3.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4870 -5.2190 -1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2770 -3.5030 -2.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4790 -2.7360 -4.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0570 -2.0120 -4.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 -0.1260 -5.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 -1.0030 -8.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 0.5820 -10.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1900 3.8410 -7.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 2.2650 -5.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8680 4.6200 -11.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2430 5.8660 -9.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2300 6.4600 -7.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9090 5.8020 -7.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3700 3.8480 -10.9400 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7370 3.5980 -11.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 48 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 22 48 1 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 28 1 M CHG 1 30 -1 M END