PUBCHEM-ZINC00489548 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 44 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 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 -1.2010 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3770 0.1060 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6030 -0.5220 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6730 -1.9120 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4870 -2.6620 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2530 -2.0190 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9060 -4.0770 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2840 -4.0710 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7310 -2.8010 0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6660 -2.5460 0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0600 -5.2140 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8540 -5.0740 -0.0160 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6580 -6.5980 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6100 -7.5690 -0.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9800 -8.8750 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3330 -9.2100 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7210 -10.5180 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7540 -11.5310 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1420 -12.9430 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1570 -13.8780 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8060 -13.4740 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -14.3240 -0.0710 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4580 -12.1780 -0.0550 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3870 -11.1990 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0100 -9.8640 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3280 1.1850 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 0.0640 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3400 -2.5970 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9110 -4.9510 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2640 -6.7320 0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2820 -6.7240 -0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0780 -8.4290 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7710 -10.7720 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1820 -13.2330 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4080 -14.9290 -0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -9.5970 -0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 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 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 27 2 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 26 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 41 1 0 0 0 0 M END