47
Impureté_T_ampac_water.log	Energy: -1526953.8042518
C          3.39411       -0.32471        0.37588
C          2.74710        0.71647       -0.31690
C          1.54930        1.29542        0.09323
C          0.94576        0.79362        1.27198
C          1.54607       -0.21964        1.99708
C          2.76950       -0.78203        1.56104
C         -0.34250        1.34875        1.81325
C         -1.57269        0.68438        1.37618
C         -1.56519       -0.54630        0.70584
C         -2.74497       -1.15110        0.30915
H         -2.69307       -2.11189       -0.22525
C         -4.00472       -0.53843        0.56564
C         -3.99824        0.70330        1.25739
C         -2.80732        1.29478        1.64562
H          3.23151        1.10286       -1.24456
H          1.09297       -0.60354        2.92606
H         -4.94069        1.21029        1.51253
H         -2.81813        2.26174        2.17820
O          3.24534       -1.76301        2.36541
H          4.11944       -2.08555        2.07285
S          4.76117       -0.96215       -0.27993
O          5.29979       -0.18708       -1.27798
O          5.56069       -1.49339        0.71848
O          3.98319       -2.42916       -1.07571
Na         3.58309       -3.05288       -1.40277
O         -0.31303        2.28877        2.61326
N         -5.18498       -1.13763        0.14897
C         -6.42133       -0.38968        0.14403
H         -6.91856       -0.49479        1.15361
H         -6.18136        0.70269       -0.01156
C         -7.41973       -0.78785       -0.93276
H         -7.75988       -1.84413       -0.81539
H         -8.31063       -0.11908       -0.84581
H         -6.98224       -0.66707       -1.95280
C         -5.23780       -2.56290       -0.07569
H         -6.24997       -2.93287        0.26187
H         -4.46813       -3.06680        0.57935
C         -5.01568       -3.00720       -1.51506
H         -5.04897       -4.12270       -1.55359
H         -5.81090       -2.60221       -2.18608
H         -4.02509       -2.66529       -1.89903
S          0.93554        2.53717       -0.84359
O          0.26478        1.69340       -2.10135
O          1.96250        3.25288       -1.41845
O         -0.16784        3.15013       -0.28874
H         -0.60738       -1.04772        0.48832
Na        -1.77353        1.83357       -2.36451
