22
5_anion
S      -0.009500    0.018000   -0.104600
C       0.114200    1.747500   -0.102400
S      -0.012500    5.698200   -0.096100
C      -0.751200    2.857700   -0.101100
H      -1.830600    2.857100   -0.102500
C       0.113000    3.968800   -0.098600
C       1.476500    3.569900   -0.098200
C       1.477200    2.148000   -0.100700
C       2.360000    1.036800   -0.101300
H       3.443600    1.110500   -0.100200
C       1.730300   -0.173700   -0.103300
C       2.358000    4.682000   -0.095700
H       3.441700    4.609500   -0.095100
C       1.727000    5.891800   -0.094400
C       2.339800   -1.530100   -0.104800
H       3.429500   -1.439700   -0.102600
H       2.059400   -2.118800   -0.987700
H       2.056200   -2.122100    0.774900
C       2.335000    7.248900   -0.091400
H       3.424900    7.159600   -0.091000
H       2.052000    7.837200    0.790900
H       2.053000    7.840700   -0.971700
29
6_anion
N       0.019800    0.023900   -0.090400
C       0.327100    1.343600    0.197600
C       1.721000    1.457400    0.418200
C       2.276800    0.157400    0.282400
C       1.181200   -0.720600   -0.023000
C      -0.330800    2.562700    0.316100
H      -1.386600    2.773300    0.217800
C       0.696600    3.508600    0.623700
C       1.980100    2.830500    0.689300
C       3.131600    3.560100    0.978500
H       4.094000    3.057800    1.027900
C       3.052600    4.927100    1.203500
H       3.952900    5.491100    1.428400
C       1.817300    5.584500    1.142300
H       1.770700    6.655200    1.320800
C       0.654000    4.886400    0.856800
H      -0.296100    5.414000    0.812900
C       3.550800   -0.405400    0.376300
H       4.404500    0.224900    0.602400
C       3.724600   -1.773100    0.185700
H       4.720300   -2.199100    0.264200
C       2.646500   -2.605800   -0.098900
H       2.803500   -3.670200   -0.237000
C       1.356100   -2.079100   -0.202800
H       0.512300   -2.728400   -0.414800
C      -1.288300   -0.497100   -0.299400
H      -1.937200    0.306500   -0.652400
H      -1.729800   -0.918700    0.615300
H      -1.272200   -1.281700   -1.062200
29
7_anion
N       0.052400   -0.038500    0.038100
C      -0.258000   -1.194600   -0.629100
C       0.636700   -1.351800   -1.741000
C       1.498400   -0.208100   -1.738400
C       1.099500    0.584300   -0.642500
C       2.578600    0.425100   -2.396900
H       3.113800    0.077500   -3.269900
C       2.829000    1.616200   -1.692900
C       1.893400    1.738500   -0.567200
C       1.956800    2.861600    0.271900
H       1.263100    2.966700    1.102600
C       2.896500    3.844600    0.045700
H       2.940900    4.711900    0.697400
C       3.803700    3.732100   -1.032400
H       4.537100    4.517300   -1.193300
C       3.770100    2.647700   -1.880000
H       4.476400    2.583800   -2.704700
C      -1.250100   -2.129900   -0.362900
H      -1.939100   -1.998000    0.465000
C      -1.350800   -3.246000   -1.185900
H      -2.121400   -3.984200   -0.988000
C      -0.480800   -3.424000   -2.262800
H      -0.579800   -4.302900   -2.891700
C       0.504500   -2.484700   -2.539600
H       1.172400   -2.627100   -3.383400
C      -0.685400    0.530600    1.115200
H      -1.197700   -0.254800    1.674700
H      -1.435400    1.259800    0.775200
H      -0.003600    1.042600    1.798200
36
8_anion
C      -0.006900    0.012400    0.008000
N       0.512600   -0.119900    1.329200
C      -0.062200   -1.262000   -0.569600
C       0.420100   -2.178500    0.411700
C       0.771300   -1.441400    1.571000
C       1.292700   -2.246600    2.588700
H       1.649000   -1.954900    3.565700
C       1.282800   -3.557100    2.048100
C       0.753400   -3.538300    0.690700
C       1.695100   -4.786700    2.588500
H       2.088600   -4.825300    3.601200
C       1.612800   -5.941100    1.837100
H       1.938500   -6.884200    2.267200
C       1.120500   -5.916600    0.521000
H       1.074800   -6.834700   -0.056000
C       0.697700   -4.725500   -0.042500
H       0.336800   -4.716900   -1.065900
C       0.677900    0.956000    2.145300
H       1.100500    0.742800    3.118400
C       0.315800    2.199500    1.736700
H       0.460800    3.038100    2.405800
C      -0.258200    2.377100    0.447800
H      -0.578700    3.361200    0.127300
C      -0.412500    1.297500   -0.383000
H      -0.866400    1.417100   -1.358700
C      -0.592800   -1.562400   -1.886300
C      -1.310300   -2.747700   -2.105800
H      -1.463100   -3.418600   -1.269000
C      -1.835300   -3.053300   -3.348400
H      -2.388900   -3.977700   -3.480200
C      -1.665500   -2.187000   -4.422100
H      -2.075800   -2.428200   -5.396600
C      -0.949900   -1.013000   -4.227300
H      -0.788900   -0.332500   -5.057700
C      -0.417100   -0.709100   -2.985500
H       0.179700    0.186900   -2.864100
62
6_K(diglyme)(Me2O)
19      -0.835476000     -0.041702000      0.896685000
7        1.982512000      2.092902000     -0.439760000
6        0.708018000      1.853035000     -0.919164000
6        0.682831000      0.601859000     -1.575547000
6        2.001155000      0.061552000     -1.505759000
6        2.789268000      1.029536000     -0.807432000
6       -0.546824000      2.464709000     -0.900706000
1       -0.804047000      3.455543000     -0.555088000
6       -1.402448000      1.571484000     -1.619996000
6       -0.646387000      0.405447000     -2.041131000
6       -1.277868000     -0.605035000     -2.770668000
1       -0.709199000     -1.466371000     -3.108606000
6       -2.618909000     -0.488564000     -3.095176000
1       -3.102357000     -1.263687000     -3.679873000
6       -3.353585000      0.635251000     -2.690356000
1       -4.399880000      0.716260000     -2.965587000
6       -2.758963000      1.649919000     -1.960938000
1       -3.340409000      2.523184000     -1.679021000
6        2.617758000     -1.116977000     -1.920788000
1        2.046821000     -1.871528000     -2.450135000
6        3.966509000     -1.321194000     -1.651861000
1        4.443678000     -2.237919000     -1.980048000
6        4.718748000     -0.361764000     -0.979455000
1        5.771882000     -0.535561000     -0.792275000
6        4.135220000      0.830319000     -0.554328000
1        4.729452000      1.581234000     -0.044965000
6        2.434704000      3.319303000      0.137895000
1        1.588933000      3.825876000      0.605140000
1        2.872674000      3.995128000     -0.606485000
1        3.184802000      3.127093000      0.909506000
6        2.301017000      0.362929000      2.759567000
1        1.683718000      1.139676000      3.213390000
1        2.813213000      0.770876000      1.882076000
1        3.052890000      0.037208000      3.489743000
8        1.453118000     -0.702275000      2.402423000
6        2.155518000     -1.728066000      1.726511000
1        3.036156000     -2.028810000      2.311222000
1        2.500994000     -1.375456000      0.747532000
6        1.261629000     -2.924749000      1.574055000
1        1.836956000     -3.734920000      1.103966000
1        0.925069000     -3.270894000      2.562093000
8        0.147465000     -2.589220000      0.783615000
6       -0.779001000     -3.639125000      0.658763000
1       -1.052585000     -4.019912000      1.653212000
1       -0.344896000     -4.468680000      0.082359000
6       -2.008659000     -3.138977000     -0.044479000
1       -1.746143000     -2.699918000     -1.016442000
1       -2.682589000     -3.988997000     -0.224433000
8       -2.643428000     -2.178384000      0.768948000
6       -3.858261000     -1.723346000      0.211858000
1       -4.297110000     -1.024415000      0.924859000
1       -4.556085000     -2.557360000      0.064266000
1       -3.695527000     -1.216694000     -0.746407000
8       -2.312215000      1.726291000      2.407362000
6       -3.322576000      2.362621000      1.659134000
1       -4.045771000      2.855408000      2.320990000
1       -2.895215000      3.102221000      0.973034000
1       -3.832492000      1.600672000      1.070155000
6       -1.551643000      2.645692000      3.147633000
1       -2.181903000      3.213003000      3.844231000
1       -0.815311000      2.082139000      3.722526000
1       -1.032285000      3.351188000      2.485796000