%chk=000041933.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000041933

0 1
 O    4.410400     -9.7599998E-02 -0.4352000    
 O  -0.7709000      -2.403200      0.3197000    
 O   -2.030100       2.762500     -0.2143000    
 N    1.747900      -1.878400      0.6519000    
 C   1.1300000E-02 -0.1646000      0.2829000    
 C  -0.3286000       1.182600      0.1425000    
 C    1.344900     -0.5291000      0.5029000    
 C    2.332200      0.4535000      0.5818000    
 C   -2.430600     -0.8132000     -3.2499999E-02
 C   -2.770300      0.5338000     -0.1734000    
 C   -1.027500      -1.211600      0.2011000    
 C   -1.731700       1.581100     -9.0499997E-02
 C   0.6654000       2.165300      0.2223000    
 C    1.993200       1.797800      0.4419000    
 C    3.766600      0.1014000      0.8159000    
 C   -3.424500      -1.796100     -0.1128000    
 C   -4.103900      0.8982000     -0.3947000    
 C   -4.752200      -1.428700     -0.3336000    
 C   -5.091100     -8.4399998E-02 -0.4743000    
 C    5.780900     -0.4356000     -0.2691000    
 C    6.408500     -0.6339000      -1.632300    
 H   0.4268000       3.220200      0.1158000    
 H    2.753100       2.573100      0.4984000    
 H    4.260800      0.9307000       1.340300    
 H    3.887900     -0.7688000       1.470500    
 H   -3.188800      -2.851600     -6.8999999E-03
 H   -4.394000       1.939400     -0.5076000    
 H    2.721600      -2.143300      0.6203000    
 H    1.059200      -2.616800      0.6137000    
 H   -5.522700      -2.191600     -0.3959000    
 H   -6.125500      0.1989000     -0.6461000    
 H    6.299900      0.3699000      0.2624000    
 H    5.866400      -1.359700      0.3136000    
 H    7.466300     -0.8964000      -1.541500    
 H    5.893200      -1.428500      -2.182100    
 H    6.320900      0.2772000      -2.233400    


%chk=000041933-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000041933

0 1
O 4.399846 -0.338831 -0.354824
O -0.546022 -2.368519 -0.214945
O -2.299380 2.846162 0.338540
N 1.951505 -1.579063 0.060030
C 0.031335 -0.044043 0.143732
C -0.433156 1.307534 0.284649
C 1.452904 -0.310863 0.211703
C 2.365288 0.783021 0.460923
C -2.377740 -0.811653 -0.164683
C -2.847215 0.525338 -0.021383
C -0.921151 -1.138974 -0.082170
C -1.890160 1.646260 0.209876
C 0.476678 2.361293 0.485139
C 1.863206 2.087851 0.573202
C 3.831995 0.515239 0.714540
C -3.307574 -1.858316 -0.384397
C -4.235625 0.798796 -0.099715
C -4.686588 -1.579324 -0.462115
C -5.153092 -0.246940 -0.319312
C 5.848816 -0.559528 -0.177283
C 6.328412 -1.444542 -1.326308
H 0.084623 3.377802 0.577305
H 2.564458 2.912495 0.749378
H 4.389954 1.472743 0.761690
H 3.963337 -0.012406 1.688501
H -2.920086 -2.876192 -0.489555
H -4.563476 1.836958 0.014122
H 2.958582 -1.672683 -0.110492
H 1.262685 -2.329745 -0.102105
H -5.400209 -2.392693 -0.632912
H -6.225572 -0.032942 -0.380016
H 6.368224 0.423210 -0.186525
H 6.035256 -1.039713 0.809062
H 7.416592 -1.620151 -1.246189
H 5.817077 -2.422742 -1.309039
H 6.121271 -0.962338 -2.296725


