2_nitropropane
    13
  -0.5140000  -0.3860000   0.8880000   1.0240000   0.8720000   2.4400000
   0.4300000  -0.4780000   2.0740000   1.5280000  -1.3830000   1.7190000
   1.6800000  -2.4140000   2.4030000   2.2370000  -1.0800000   0.7400000
  -0.0070000   0.0380000   0.0150000  -0.9040000  -1.3710000   0.6130000
  -1.3720000   0.2510000   1.1270000   1.5490000   1.3060000   1.5820000
   1.7370000   0.7760000   3.2640000   0.2450000   1.5810000   2.7390000
  -0.0920000  -0.9030000   2.9370000