PUBCHEM-ZINC03686985 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 0 0 0 0 0 0999 V2000 -0.0370 1.4510 0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1520 -0.0620 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3300 -0.5960 1.2270 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5110 -1.9600 1.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 -2.8620 0.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 -4.2280 0.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9100 -4.7100 1.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5230 -3.8000 2.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3060 -2.4090 2.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8520 -1.5180 3.2390 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6390 -1.9590 4.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9240 -3.2870 4.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3600 -4.2110 3.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0170 -6.1630 1.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 -7.0200 2.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -8.3490 2.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 -9.6250 2.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 -10.7640 2.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0110 -10.6360 1.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2740 -9.3810 0.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6810 -8.2610 1.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7620 -6.9330 0.9170 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2980 -6.5730 0.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 -11.9380 2.9790 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4480 -13.1280 2.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4700 -6.6290 3.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8920 -6.3110 3.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7320 -5.7360 4.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1230 -5.3590 4.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.7500 0.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4000 1.9120 -0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6150 1.8430 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2050 -0.3330 -0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4460 -0.4280 -0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6980 -2.5310 -0.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3510 -4.9170 -0.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0460 -1.1840 4.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5660 -3.5990 5.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5860 -5.2640 3.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 -9.7320 3.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4760 -11.5000 0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9180 -9.2880 -0.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1040 -13.9630 3.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 -13.3150 1.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5400 -13.0950 2.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 -7.4310 4.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0450 -5.7600 4.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8680 -5.5890 2.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3640 -7.2200 2.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8040 -6.4710 5.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2330 -4.8500 4.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0920 -4.6120 3.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6920 -6.2320 3.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8780 -4.7530 5.1460 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.8300 -4.4970 4.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4240 -3.8980 5.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9660 -5.4050 5.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 14 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 26 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 24 1 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 24 25 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 54 55 1 0 0 0 0 54 56 1 0 0 0 0 54 57 1 0 0 0 0 M CHG 1 54 1 M END