120
jk1030 in I41/a
U       6.573000    0.097300   -0.026900
U      -6.568200    0.091900   -0.019800
N       8.671200   -1.452600   -0.625700
N       8.655900   -2.804100   -0.459200
N       5.762900   -2.025800   -1.326400
N       6.265400   -3.276000   -1.121400
N       6.603300   -1.847600    1.684900
N       6.893100   -3.135500    1.342900
C       9.930000   -1.129400   -0.953700
C      10.742900   -2.270600   -1.006800
H      11.794500   -2.328900   -1.245600
C       9.886900   -3.313700   -0.684800
C       4.793600   -2.150400   -2.243600
C       4.666700   -3.484600   -2.654600
H       3.974800   -3.895400   -3.374800
C       5.617900   -4.164500   -1.908600
C       6.198800   -1.874400    2.965300
C       6.226900   -3.179600    3.469200
H       5.960200   -3.518100    4.459200
C       6.672500   -3.945300    2.399700
B       7.368100   -3.561000   -0.080000
H       7.594400   -4.742000   -0.059000
H       5.876600   -5.213200   -1.874500
H       6.847500   -5.008300    2.316700
H       5.902800   -0.957400    3.459300
H      10.189900   -0.096100   -1.133800
H      10.062100   -4.377000   -0.603300
H       4.214900   -1.282600   -2.527800
N      -6.095400    2.652400    0.399900
N      -7.058300    3.615200    0.319700
N      -8.537000    1.154400    1.376500
N      -9.114500    2.338500    1.026900
N      -7.904800    1.468400   -1.773800
N      -8.561900    2.621300   -1.459700
C      -4.958100    3.282600    0.728800
C      -5.176300    4.661000    0.869800
H      -4.456100    5.424200    1.125500
C      -6.525300    4.826500    0.596800
C      -9.303500    0.629700    2.343400
C     -10.382700    1.473400    2.638200
H     -11.163800    1.325700    3.369200
C     -10.221200    2.546800    1.773700
C      -8.139300    1.237500   -3.075000
C      -8.950200    2.240200   -3.620700
H      -9.305900    2.330800   -4.636200
C      -9.191900    3.097600   -2.555700
B      -8.511000    3.278100   -0.047500
H      -9.165100    4.286800   -0.084500
H     -10.810000    3.442700    1.638500
H      -7.143400    5.712900    0.575500
H      -4.049500    2.705600    0.826300
H      -7.723300    0.358900   -3.551500
H      -9.763700    4.012700   -2.500400
H      -9.044300   -0.328500    2.772700
N      -5.751900   -2.115300   -1.170100
N      -6.282200   -3.344000   -0.912100
N      -8.669500   -1.459000   -0.602200
N      -8.683100   -2.798100   -0.355000
N      -6.680000   -1.752800    1.796700
N      -6.982500   -3.053300    1.519000
B      -7.420800   -3.551900    0.107900
H      -7.668500   -4.726100    0.189000
C      -4.760100   -2.305900   -2.051300
C      -4.645800   -3.662700   -2.385100
H      -3.941800   -4.123600   -3.061900
C      -5.629400   -4.285000   -1.630900
C      -9.911700   -1.136400   -0.988700
C     -10.742400   -2.265900   -0.999800
H     -11.787000   -2.322000   -1.268300
C      -9.915200   -3.301000   -0.589100
C      -6.318000   -1.712900    3.089500
C      -6.386400   -2.986300    3.665400
H      -6.158200   -3.271800    4.681400
C      -6.811300   -3.804600    2.626800
H     -10.147800   -0.111700   -1.237800
H     -10.111400   -4.354600   -0.450000
H      -5.907900   -5.325800   -1.547500
H      -7.003300   -4.867500    2.598600
H      -4.158800   -1.464200   -2.365400
H      -6.022500   -0.773900    3.540700
N       8.508500    1.069800    1.471700
N       9.111300    2.259600    1.190700
N       6.118500    2.643900    0.483000
N       7.095900    3.595300    0.473100
N       7.974800    1.530500   -1.683900
N       8.642100    2.655600   -1.298500
B       8.554900    3.252500    0.138400
H       9.223800    4.251700    0.165300
C       9.237000    0.494400    2.439300
C      10.316400    1.310100    2.803300
H      11.071800    1.121300    3.551700
C      10.195900    2.421000    1.980400
C       4.979200    3.276300    0.800900
C       5.210500    4.644700    1.004500
H       4.492400    5.407100    1.268300
C       6.569800    4.801900    0.782100
C       8.248700    1.351000   -2.985300
C       9.095500    2.360200   -3.460100
H       9.486600    2.487300   -4.458600
C       9.317000    3.166100   -2.351500
H       4.061200    2.708000    0.847700
H       8.952200   -0.477400    2.819000
H      10.800000    3.313500    1.901800
H       9.903200    4.066600   -2.237800
H       7.199700    5.679500    0.817200
H       7.833300    0.501700   -3.512900
C       4.091000    0.300400   -0.075600
C       2.854400    0.307100   -0.075100
C       1.428100    0.304300   -0.074700
C       0.701300   -0.789700    0.445400
H       1.249200   -1.637100    0.847100
C       0.693200    1.393100   -0.593800
H       1.233500    2.242800   -1.001600
C      -0.686900   -0.793600    0.448200
H      -1.228400   -1.644100    0.852200
C      -0.695100    1.389100   -0.591200
H      -1.241900    2.235600   -0.997000
C      -1.421800    0.296200   -0.069100
C      -2.848200    0.291100   -0.064400
C      -4.084800    0.278800   -0.060200
