%chk=000149831.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000149831

0 1
 O   -3.661800       2.009200     -0.1083000    
 O    3.668700       2.030500     -1.6700000E-02
 N   -9.202800      -1.047800       1.136400    
 N    8.605200      -2.044200     -0.8089000    
 N   -8.561500      -2.067800     -0.7820000    
 N    9.158300      -1.063500       1.156800    
 C   2.7999999E-03   1.448100     -0.7202000    
 C   -1.267500       2.034900     -0.1074000    
 C    1.257300       2.025900     -5.8600001E-02
 C   -2.520400       1.434800     -0.7295000    
 C    2.538400       1.479100     -0.6767000    
 C   -10.28350      -1.967600      0.9451000    
 C    9.840100      -2.706800     -0.5144000    
 C   -8.287600      -1.164600      0.1291000    
 C    8.298200      -1.141700      0.1695000    
 C   -7.088900     -0.3432000      6.8300001E-02
 C    7.098500     -0.3210000      0.1216000    
 C   -9.853700      -2.671300     -0.3449000    
 C    10.21750      -2.058400      0.8203000    
 C   -4.790300       1.233100     -4.9300000E-02
 C    4.798200       1.254600      2.9700000E-02
 C   -6.186700     -0.5031000     -0.9834000    
 C    6.832800      0.5860000       1.147600    
 C   -6.841800      0.6049000       1.061200    
 C    6.213900     -0.4400000     -0.9504000    
 C   -5.037500      0.2851000      -1.042300    
 C    5.682800       1.373900       1.101600    
 C   -5.692500       1.393100       1.002400    
 C    5.063800      0.3477000     -0.9963000    
 H   2.3399999E-02   1.660300      -1.796000    
 H  -3.0000001E-04  0.3574000     -0.6049000    
 H   -1.282800       3.124500     -0.2347000    
 H   -1.281600       1.859300      0.9757000    
 H    1.251600       1.806000       1.016400    
 H    1.257700       3.120100     -0.1398000    
 H   -2.481800      0.3480000     -0.5790000    
 H   -2.548100       1.652600      -1.803400    
 H    2.508600      0.3858000     -0.5799000    
 H    2.581400       1.744900      -1.739400    
 H   -11.23560      -1.443900      0.8192000    
 H   -10.36440      -2.670300       1.779500    
 H    10.59210      -2.509500      -1.283900    
 H    9.701200      -3.786900     -0.4125000    
 H   -9.716700      -3.745200     -0.1791000    
 H   -10.60350      -2.540200      -1.132300    
 H    10.27980      -2.807600       1.616600    
 H    11.18610      -1.552200      0.7509000    
 H   -9.172100     -0.4133000       1.923800    
 H    8.073600      -2.248600      -1.645100    
 H   -6.356000      -1.229000      -1.774300    
 H    7.503100      0.7011000       1.995100    
 H   -7.514700      0.7645000       1.897300    
 H    6.383000      -1.126700      -1.773300    
 H   -4.375400      0.1486000      -1.892200    
 H    5.480700       2.079100       1.903300    
 H   -5.504500       2.130400       1.778100    
 H    4.416100      0.2449000      -1.862000    


%chk=000149831-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000149831

0 1
O -3.689397 0.975892 0.867403
O 3.697205 0.994104 0.804487
N -10.148817 0.352355 -0.085086
N 9.443542 -1.372030 -1.411690
N -9.419416 -1.709518 -0.818865
N 10.119163 0.139023 0.196925
C 0.001999 0.162680 0.371074
C -1.277352 0.889505 0.844544
C 1.285385 0.896764 0.821830
C -2.549359 0.180117 0.375154
C 2.552986 0.193463 0.331829
C -11.393292 -0.234808 -0.637744
C 10.914962 -1.358275 -1.598976
C -9.077554 -0.529894 -0.323444
C 9.097006 -0.417380 -0.434458
C -7.684436 -0.146673 -0.008152
C 7.682929 -0.103391 -0.137890
C -10.913163 -1.699880 -0.961232
C 11.363269 -0.474679 -0.374679
C -4.982800 0.542600 0.544170
C 4.986642 0.567354 0.458158
C -6.619050 -0.946111 -0.493097
C 7.376054 1.045942 0.643886
C -7.372334 1.001279 0.771652
C 6.616345 -0.912302 -0.601670
C -5.276921 -0.613533 -0.225938
C 6.047112 1.380635 0.938472
C -6.037178 1.345657 1.045777
C 5.272416 -0.587750 -0.311345
H -0.007690 0.080011 -0.736104
H 0.008360 -0.875176 0.764859
H -1.286125 1.927016 0.459578
H -1.289679 0.956123 1.948985
H 1.316427 0.964727 1.925813
H 1.282353 1.933864 0.435729
H -2.609391 -0.849513 0.786129
H -2.586075 0.122390 -0.733099
H 2.624192 -0.835789 0.742524
H 2.571529 0.135061 -0.777049
H -11.722653 0.303994 -1.549730
H -12.216552 -0.213320 0.098041
H 11.193494 -0.894447 -2.567505
H 11.340764 -2.376509 -1.563038
H -11.342699 -2.427961 -0.246871
H -11.197668 -2.023395 -1.978048
H 11.845556 -1.091425 0.407608
H 12.077597 0.316667 -0.662351
H -10.024620 1.360226 -0.001905
H 8.813990 -1.627756 -2.171325
H -6.870927 -1.834182 -1.081371
H 8.207159 1.656683 1.009547
H -8.172350 1.616925 1.198594
H 6.822776 -1.828245 -1.167641
H -4.478934 -1.251694 -0.616434
H 5.800052 2.263260 1.536093
H -5.786305 2.223125 1.649268
H 4.472372 -1.237803 -0.676989


