PUBCHEM-ZINC04426250 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 0.0150 1.5970 -0.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 0.3240 -0.0310 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1660 -0.5700 -0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3820 0.1720 0.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5770 0.4250 1.8050 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3330 -0.2780 -0.2910 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7020 -0.5190 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4650 -0.9780 -1.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8280 -1.2420 -0.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4600 -1.0520 0.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6890 -0.5920 1.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3240 -0.3270 1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9320 -1.3370 0.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5570 -1.7550 -0.5970 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9750 0.4290 1.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2380 -0.0440 0.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0320 -0.1200 1.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3490 -0.5820 1.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9080 -0.9750 0.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1020 -0.8840 -0.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7810 -0.4220 -0.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2930 -1.4650 0.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2100 -0.8960 -0.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5250 -1.3610 -0.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9460 -2.4050 0.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0540 -2.9830 1.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7390 -2.5160 1.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 1.7750 -1.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7210 1.5520 -1.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2150 2.4720 -0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0260 -0.4590 -1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0180 -1.1400 -2.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4060 -1.5990 -1.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1580 -0.4360 2.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7820 0.0280 2.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6200 0.1820 2.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9410 -0.6220 2.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4970 -1.1840 -1.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2170 -0.3640 -1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9060 -0.0710 -0.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2200 -0.9060 -1.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9690 -2.7670 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3780 -3.7990 1.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0560 -2.9900 2.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4340 -1.1390 1.5780 O 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 2 4 1 0 0 0 0 2 15 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 45 2 0 0 0 0 15 16 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 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 26 2 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 27 44 1 0 0 0 0 M CHG 1 14 -1 M END