PUBCHEM-ZINC04742830 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4480 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 -1.1860 -0.6300 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2080 0.0140 0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 -2.1360 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6430 -2.5700 0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9400 -3.8840 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0500 -4.7080 -0.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3800 -4.3310 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4360 -5.7950 0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4580 -6.6560 1.2020 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5520 -6.5060 1.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5190 -8.0750 0.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5600 -9.2990 1.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6130 -10.4600 0.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6240 -10.3930 -0.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5820 -9.1710 -1.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5300 -7.9960 -0.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4830 -6.5720 -1.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4850 -6.1590 -2.2270 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6740 -6.3520 2.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8290 -5.8210 1.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7020 -5.6900 2.6520 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.6010 -5.3310 2.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1150 -6.1450 3.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8210 -6.5840 3.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9870 -7.1080 4.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4330 -7.1950 5.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7100 -6.7660 6.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5470 -6.2390 5.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8250 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8090 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7990 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7530 -2.5140 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7360 -2.5230 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3550 -1.9120 0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8700 -3.9530 0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8880 -3.9440 -0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5510 -9.3540 2.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6460 -11.4200 1.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6640 -11.3020 -1.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5910 -9.1230 -2.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0380 -5.5390 0.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9920 -7.4450 4.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7870 -7.6010 6.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0480 -6.8410 7.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5400 -5.9090 5.4000 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 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 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 2 0 0 0 0 7 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 1 0 0 0 0 10 19 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 21 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 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 28 29 2 0 0 0 0 28 45 1 0 0 0 0 29 30 1 0 0 0 0 29 46 1 0 0 0 0 30 47 1 0 0 0 0 M END