69
Impureté_L_ampac_C4_water.log	Energy: -1657504.9657074
C          4.06342        1.00739        0.64150
C          3.04069        1.36162        1.51660
C          1.71279        1.06434        1.21984
C          1.39401        0.38598        0.02828
C          2.42050        0.05969       -0.88110
C          3.76229        0.37296       -0.58708
C         -0.00502       -0.02889       -0.19003
C         -0.99614        0.93697       -0.17235
C         -0.67074        2.32409       -0.14176
C         -1.50018        3.37971       -0.14075
H         -1.11667        4.39140       -0.11185
C         -2.92698        3.11391       -0.17968
C         -3.32990        1.72009       -0.18415
C         -2.42825        0.70125       -0.18862
H          3.29122        1.87289        2.44037
H         -4.38017        1.46611       -0.17494
H         -2.79855       -0.31609       -0.19179
O          4.71140        0.03448       -1.47782
H          5.56725        0.45286       -1.17041
S          5.77867        1.26307        1.15090
O          5.79652        2.52006        1.93493
O          6.15399        0.05070        1.92308
O          6.52222        1.37044       -0.15905
Na         2.76541       -2.99579        0.33817
N         -3.81904        4.10958       -0.20805
C         -5.27477        3.84179       -0.18567
H         -5.76706        4.68263       -0.66934
H         -5.47691        2.97419       -0.81419
C         -5.82141        3.64490        1.23103
H         -5.65402        4.53336        1.84763
H         -6.89961        3.46308        1.17762
H         -5.35204        2.79001        1.72769
S          2.02047       -0.64838       -2.49655
O          4.49321       -4.20717       -0.14677
O          2.48923        0.39909       -3.52774
O          0.92398       -2.24014       -0.64482
C         -0.22511       -1.57113       -0.30288
C         -0.65588       -2.06675        1.06314
C         -1.23224       -1.96611       -1.35688
C         -1.70698       -2.88452        1.27742
H          0.00340       -1.81055        1.88830
C         -2.26334       -2.81259       -1.14868
H         -1.01773       -1.61748       -2.36261
C         -2.57488       -3.29990        0.18490
H         -1.88019       -3.26618        2.27407
H         -2.86664       -3.12210       -1.99077
N         -3.60058       -4.11501        0.39956
C         -3.97071       -4.57254        1.76674
H         -4.58931       -5.46047        1.63659
H         -3.06416       -4.89675        2.28109
C         -4.72678       -3.51925        2.58085
H         -4.95927       -3.93780        3.56519
H         -4.13271       -2.61253        2.72689
H         -5.66743       -3.24202        2.09738
C         -4.47332       -4.59290       -0.70557
H         -3.84887       -4.79955       -1.57514
H         -4.88134       -5.55122       -0.38217
C         -5.60425       -3.62162       -1.05104
H         -6.27391       -3.46803       -0.20037
H         -5.21686       -2.64872       -1.36824
H         -6.19070       -4.04240       -1.87391
C         -3.33718        5.52184       -0.14623
H         -2.58827        5.64304       -0.93352
H         -2.83286        5.65881        0.81671
C         -4.40080        6.59948       -0.32115
H         -3.89245        7.56587       -0.24656
H         -4.88094        6.55532       -1.30297
H         -5.16808        6.57081        0.45726
H          0.92885        1.30974        1.92737
