%chk=000163991.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000163991

0 1
 I   -5.285100       4.459400     -0.2707000    
 O    4.473500       1.093800      0.6958000    
 N    7.658300     -9.0700001E-02 -0.7326000    
 C  -0.9611000     -0.1380000      9.3000002E-02
 C   -1.408500      -1.438800      2.1299999E-02
 C   0.4490000      0.1819000      0.2500000    
 C  -0.5468000      -2.692800      3.4400001E-02
 C   -1.986000      0.9522000      6.8000001E-03
 C   -2.856200      -1.725500     -0.1392000    
 C    1.252300      0.3603000     -0.8763000    
 C   0.9980000      0.3100000       1.525700    
 C  -0.3028000      -3.224100       1.441700    
 C    3.144600      0.7929000      0.5481000    
 C    2.604900      0.6668000     -0.7268000    
 C    2.350400      0.6167000       1.675300    
 C   -2.560900       1.401400       1.170200    
 C   -2.304600       1.452600      -1.231500    
 C   -3.378300      -1.832500      -1.412400    
 C   -3.636100      -1.876200      0.9895000    
 C    6.723800      0.3968000      0.2813000    
 C    5.351100      0.6387000     -0.3257000    
 C   -3.515000       2.415800       1.090200    
 C   -3.258700       2.467100      -1.311600    
 C   -4.738500      -2.101500      -1.563300    
 C   -4.996400      -2.145300      0.8384000    
 C   -3.864000       2.948600     -0.1508000    
 C   -5.547500      -2.258000     -0.4380000    
 C    8.981200     -0.3053000     -0.1475000    
 C    7.159400      -1.326300      -1.335300    
 H   0.4211000      -2.488400     -0.4378000    
 H   -1.003100      -3.481400     -0.5772000    
 H   0.8388000      0.2686000      -1.877900    
 H   0.3861000      0.1747000       2.414400    
 H   0.1741000      -2.476400       2.081700    
 H   0.3546000      -4.098600       1.401600    
 H   -1.238000      -3.533600       1.918700    
 H    3.187400      0.8266000      -1.628900    
 H    2.774300      0.7154000       2.670600    
 H   -2.294900      0.9939000       2.141100    
 H   -1.838200       1.085200      -2.140800    
 H    6.636900     -0.3025000       1.124200    
 H    7.086600       1.341100      0.7076000    
 H   -2.757100      -1.715100      -2.296000    
 H   -3.218800      -1.790200       1.988900    
 H    5.409000       1.396700      -1.116000    
 H    4.961400     -0.2972000     -0.7380000    
 H   -3.974300       2.776300       2.007200    
 H   -3.515900       2.868000      -2.288800    
 H   -5.167700      -2.189400      -2.557100    
 H   -5.626600      -2.266500       1.714600    
 H   -6.606800      -2.467300     -0.5556000    
 H    9.367100      0.6252000      0.2839000    
 H    8.967700      -1.070100      0.6375000    
 H    9.698400     -0.6128000     -0.9168000    
 H    7.937600      -1.788300      -1.955700    
 H    6.853200      -2.067100     -0.5877000    
 H    6.331900      -1.139200      -2.026600    


%chk=000163991-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000163991

0 1
I -3.734802 5.298946 -1.128225
O 4.579918 -0.427738 0.838525
N 7.886828 0.750908 -0.435910
C -1.112830 -0.545787 -0.012500
C -1.846631 -1.722239 -0.005786
C 0.373826 -0.519638 0.184422
C -1.190721 -3.102485 -0.023433
C -1.739676 0.795314 -0.266470
C -3.346245 -1.738329 0.031526
C 1.209120 0.217213 -0.696326
C 0.999189 -1.182866 1.280239
C -1.481476 -3.962297 1.234266
C 3.205424 -0.411390 0.565050
C 2.608752 0.271288 -0.525296
C 2.390257 -1.132756 1.473015
C -1.364334 1.925855 0.509931
C -2.677251 0.994219 -1.316377
C -4.099165 -2.595429 -0.819277
C -4.059776 -0.943396 0.972997
C 6.896939 0.104513 0.456552
C 5.473318 0.299561 -0.082580
C -1.926924 3.200180 0.279133
C -3.243158 2.261966 -1.568904
C -5.509105 -2.635534 -0.753223
C -5.467373 -0.988100 1.047261
C -2.868648 3.357613 -0.760761
C -6.202344 -1.831503 0.180876
C 9.100392 1.201359 0.275526
C 8.216953 -0.063585 -1.624040
H -0.102097 -3.004184 -0.167351
H -1.572100 -3.655483 -0.907030
H 0.755639 0.753676 -1.537393
H 0.379026 -1.726687 2.000836
H -1.086227 -3.481685 2.147841
H -1.009606 -4.957588 1.141218
H -2.566915 -4.108685 1.375501
H 3.214135 0.843153 -1.234696
H 2.866208 -1.636283 2.320110
H -0.625595 1.807846 1.310296
H -2.965161 0.148058 -1.948080
H 7.088602 -0.987189 0.597200
H 6.954447 0.573622 1.454942
H -3.581999 -3.223583 -1.554139
H -3.499036 -0.292837 1.652485
H 5.218274 1.376739 -0.100833
H 5.364333 -0.112150 -1.106235
H -1.631922 4.051054 0.899945
H -3.960364 2.388345 -2.384905
H -6.065748 -3.293996 -1.429973
H -5.991246 -0.367119 1.782763
H -7.296129 -1.864966 0.236500
H 8.821100 1.883301 1.097714
H 9.702782 0.362424 0.707531
H 9.750660 1.759225 -0.422292
H 8.863484 0.519101 -2.304072
H 8.749401 -1.014844 -1.367554
H 7.300395 -0.327525 -2.179438


