PUBCHEM-ZINC05511199 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 57 0 0 1 0 0 0 0 0999 V2000 0.1170 1.5070 0.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 0.0980 0.4160 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2090 -0.4220 0.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2290 0.2230 0.6170 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1520 -1.9270 0.1430 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5780 -2.0550 -0.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3940 -2.5790 1.3180 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7540 -2.1790 2.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4970 -4.1010 1.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9320 -4.5850 1.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6370 -4.0450 -0.0070 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6940 -4.3390 0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5870 -2.5010 -0.0470 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1960 -2.1410 0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2760 -1.9960 -1.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7310 -2.6450 -2.6150 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6610 -2.4410 -2.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4470 -2.2240 -3.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8200 -3.0560 -4.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4450 -2.2560 -5.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0300 -2.5210 -7.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5670 -1.4620 -7.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5260 -0.1580 -7.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9500 0.1300 -6.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4180 -0.9380 -5.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7990 -0.9440 -4.1900 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6410 -0.1130 -3.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5730 -4.5260 -4.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5440 -4.8900 -3.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0900 -4.6840 -1.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 -2.2830 1.2270 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1020 -1.3150 1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 1.8100 0.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4240 2.0520 -0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2860 1.7400 1.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 -4.5300 0.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 -4.4810 2.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9520 -5.6810 1.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4820 -4.2640 2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3530 -2.2030 -1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1930 -0.9060 -1.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0690 -3.5320 -7.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0200 -1.6610 -8.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9480 0.6500 -7.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9220 1.1480 -5.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5200 -5.0370 -4.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2150 -4.8810 -5.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5720 -5.9650 -3.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5260 -4.5980 -4.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0350 -4.4600 -1.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2300 -5.7710 -1.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8700 -4.1600 -2.4640 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.8670 -4.3420 -2.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 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 31 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 30 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 52 1 0 0 0 0 18 19 2 0 0 0 0 18 26 1 0 0 0 0 19 20 1 0 0 0 0 19 28 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 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 1 0 0 0 0 26 27 1 0 0 0 0 28 29 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 29 52 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 31 32 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 52 1 M END