-113.0880908119   -112.9958997622      0.0000000000      0.0000000000      0.0000000000     57.85    -1.4492     59.30   nh3_2   nh3_2_ts                        
   -169.6410596475   -169.5731402614      0.0000000000      0.0000000000      0.0000000000     42.62    -4.2799     46.90   nh3_3   nh3_3_ts                        
   -226.1916307092   -226.1205845480      0.0000000000      0.0000000000      0.0000000000     44.58    -3.8179     48.40   nh3_4   nh3_4_ts                        
   -152.8456326459   -152.7756264837      0.0000000000      0.0000000000      0.0000000000     43.93    -4.6705     48.60   h2o_2   h2o_2_ts                        
   -229.2819967323   -229.2433664134      0.0000000000      0.0000000000      0.0000000000     24.24    -5.5591     29.80   h2o_3   h2o_3_ts                        
   -305.7198136662   -305.6892923501      0.0000000000      0.0000000000      0.0000000000     19.15    -7.4476     26.60   h2o_4   h2o_4_ts                        
   -382.1521698630   -382.1194286671      0.0000000000      0.0000000000      0.0000000000     20.55    -9.5546     30.10   h2o_5   h2o_5_ts                        
   -458.5840016985   -458.5462834028      0.0000000000      0.0000000000      0.0000000000     23.67   -11.4314     35.10   h2o_6   h2o_6_ts                        
   -200.8958188260   -200.8370993431      0.0000000000      0.0000000000      0.0000000000     36.85    -5.4530     42.30   hf_2    hf_2_ts                         
   -301.3581700408   -301.3340531528      0.0000000000      0.0000000000      0.0000000000     15.13    -5.5664     20.70   hf_3    hf_3_ts                         
   -401.8235002198   -401.8112029478      0.0000000000      0.0000000000      0.0000000000      7.72    -6.9833     14.70   hf_4    hf_4_ts                         
   -502.2845483971   -502.2747205932      0.0000000000      0.0000000000      0.0000000000      6.17    -8.4330     14.60   hf_5    hf_5_ts                         
   -602.7427182196   -602.7322243626      0.0000000000      0.0000000000      0.0000000000      6.58   -10.0150     16.60   hf_6    hf_6_ts                         
6.51