methyl_p_nitrobenzoate
    20
   1.8850000  -1.0360000  -0.1120000   2.8780000  -1.6520000   2.0020000
   0.8070000  -0.4630000   0.5610000   1.8000000  -1.0790000   2.6760000
   2.9210000  -1.6310000   0.6080000   0.7640000  -0.4840000   1.9550000
   4.0450000  -2.2300000  -0.0940000   6.1140000  -3.3790000   0.2040000
  -0.3360000   0.0980000   2.6400000  -1.2580000   0.6260000   1.9720000
   4.1660000  -2.2590000  -1.3260000  -0.3550000   0.0680000   3.8940000
   4.9580000  -2.7600000   0.7770000   1.9080000  -1.0150000  -1.1990000
   3.6790000  -2.1140000   2.5740000   0.0050000  -0.0040000  -0.0130000
   1.7780000  -1.1030000   3.7630000   6.7580000  -3.7590000   1.0020000
   6.6580000  -2.6490000  -0.4010000   5.7950000  -4.2100000  -0.4300000