PUBCHEM-ZINC02876416 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 0 0 0 0 0 0999 V2000 -1.3400 -1.1640 -0.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1420 -0.2410 -0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 -0.6910 1.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6320 -1.6110 0.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3200 -2.0250 2.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9820 -1.5150 3.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9510 -0.5910 3.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2710 -0.1770 2.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6750 -1.9320 4.4980 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9580 -2.5920 5.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8420 -4.0660 5.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3120 -4.5200 4.2780 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 -4.8790 6.1730 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 -6.2600 5.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 -6.7560 4.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 -8.1200 4.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 -8.9910 5.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 -8.5010 6.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1800 -7.1380 7.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 -6.6050 8.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1320 -9.4380 7.9490 N 0 3 0 0 0 0 0 0 0 0 0 0 1.7380 -10.4920 7.8840 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5090 -9.1540 8.9560 O 0 5 0 0 0 0 0 0 0 0 0 0 4.3080 -1.6800 4.6110 S 0 0 0 0 0 0 0 0 0 0 0 0 4.8180 -2.7190 5.4360 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7700 -1.4400 3.2890 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5430 -0.1780 5.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6590 -0.2010 6.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8440 0.9770 7.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9130 2.1790 6.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7990 2.2030 5.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6180 1.0240 4.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1140 3.4640 7.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0020 -1.1240 0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8810 -0.8390 -1.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9890 -2.1860 -0.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 -0.2810 -0.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4920 0.7810 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8950 -2.0070 0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1210 -2.7450 2.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6850 -0.1920 4.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 0.5460 2.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5050 -2.4480 6.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9610 -2.1610 5.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7810 -4.5060 6.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 -6.0760 3.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1610 -8.5060 3.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1290 -10.0570 5.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1700 -6.5460 8.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7740 -7.2710 9.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6390 -5.6110 8.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6040 -1.1400 7.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9330 0.9590 8.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8530 3.1420 4.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5320 1.0410 3.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1800 3.6660 7.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6360 4.2830 7.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6690 3.3720 8.6500 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 2 38 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 43 1 0 0 0 0 10 44 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 45 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 46 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 17 18 2 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 24 25 2 0 0 0 0 24 26 2 0 0 0 0 24 27 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 29 53 1 0 0 0 0 30 31 2 0 0 0 0 30 33 1 0 0 0 0 31 32 1 0 0 0 0 31 54 1 0 0 0 0 32 55 1 0 0 0 0 33 56 1 0 0 0 0 33 57 1 0 0 0 0 33 58 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END