%chk=000148973.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000148973

0 1
 O   -4.737500      -1.419300      -1.578800    
 O   -1.910100       2.198700      -1.349700    
 O    4.262600     -0.3262000      0.3446000    
 N   -1.973600      0.7579000      0.4793000    
 N   -3.258200      0.3445000      -1.453400    
 C   -3.806600     -0.8699000      0.5888000    
 C   -2.365000     -0.5592000      0.9668000    
 C  -0.9965000       1.500100       1.259700    
 C   -3.978700     -0.7183000     -0.9124000    
 C   -4.210900      -2.261500       1.061900    
 C   -2.338800       1.179600     -0.8040000    
 C   0.4031000       1.014300       1.016400    
 C    1.162100       1.585200      2.0000001E-03
 C   0.9251000     -1.8000000E-03   1.808100    
 C    2.994100      0.1143000      0.5659000    
 C    2.462300       1.133600     -0.2242000    
 C    2.225300     -0.4534000       1.582100    
 C    4.546300     -0.8683000     -0.9443000    
 C    5.623600     -2.9200001E-02  -1.614500    
 C    4.971100      -2.321200     -0.7941000    
 H   -4.472500     -0.1317000       1.055400    
 H   -2.255000     -0.5898000       2.056500    
 H   -1.676200      -1.289700      0.5251000    
 H   -1.260200       1.435400       2.322300    
 H   -1.063700       2.563800      0.9985000    
 H   -4.082500      -2.358700       2.144900    
 H   -5.261900      -2.464200      0.8293000    
 H   -3.609800      -3.037100      0.5745000    
 H   -3.439800      0.5558000      -2.430800    
 H   0.7637000       2.383900     -0.6169000    
 H   0.3370000     -0.4506000       2.603600    
 H    3.049700       1.594600      -1.012800    
 H    2.634200      -1.247900       2.200400    
 H    3.654300     -0.8560000      -1.585500    
 H    5.870600     -0.4183000      -2.606900    
 H    5.299300       1.010900      -1.720500    
 H    6.536500     -1.2000000E-02  -1.008900    
 H    5.198900      -2.773200      -1.764300    
 H    4.177000      -2.904100     -0.3152000    
 H    5.854400      -2.405700     -0.1514000    


%chk=000148973-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000148973

0 1
O -5.313699 -0.955609 -1.361882
O -2.116772 2.415764 -1.286578
O 4.083161 -1.125205 0.254700
N -2.094810 0.879202 0.496021
N -3.612881 0.622934 -1.306634
C -3.977118 -0.748961 0.714530
C -2.473374 -0.479874 0.937837
C -0.947725 1.557022 1.155378
C -4.371822 -0.406678 -0.729885
C -4.365548 -2.195875 1.072900
C -2.556463 1.377034 -0.709216
C 0.389665 0.871902 0.897492
C 1.005222 0.954320 -0.376183
C 1.045546 0.131864 1.914569
C 2.876024 -0.426433 0.389754
C 2.236168 0.315840 -0.638953
C 2.274362 -0.510451 1.671073
C 4.831110 -1.064382 -1.035057
C 5.587242 0.271221 -1.147829
C 5.763374 -2.279523 -1.006632
H -4.552005 -0.048429 1.357147
H -2.238112 -0.567475 2.013390
H -1.868405 -1.244845 0.406613
H -1.157731 1.593428 2.240996
H -0.939515 2.589425 0.766081
H -4.218816 -2.384373 2.151448
H -5.421842 -2.379374 0.818666
H -3.754620 -2.920541 0.504797
H -3.894456 0.949160 -2.236639
H 0.515685 1.532285 -1.169276
H 0.594863 0.062908 2.913099
H 2.681614 0.408600 -1.633681
H 2.786299 -1.082191 2.451126
H 4.104237 -1.173728 -1.866557
H 6.129414 0.322572 -2.109887
H 4.904935 1.136472 -1.090524
H 6.322761 0.357678 -0.328755
H 6.358086 -2.326973 -1.936601
H 5.183542 -3.212992 -0.909705
H 6.456104 -2.210419 -0.149642


