%chk=000118741.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000118741

0 1
 O    1.609800       2.357300      -1.870600    
 N    1.700300       2.703200      0.4079000    
 N    3.192300      -3.181500     -0.1337000    
 N   -6.110100     -0.4833000      0.4565000    
 N  -0.2926000       2.137700     -0.5916000    
 C    3.942700       1.732700      0.7102000    
 C  -0.6934000      0.9204000     -0.3591000    
 C   0.3344000     -0.1667000     -0.2993000    
 C   -2.114800      0.5518000     -0.1464000    
 C    3.106600       2.987600      0.4826000    
 C    5.439100       2.034600      0.8177000    
 C    2.222000      -2.159300     -0.1899000    
 C   -4.759100     -0.1336000      0.2516000    
 C   0.9136000     -0.4539000      0.9131000    
 C   -3.076400       1.541100     -0.1968000    
 C   0.6548000     -0.8290000      -1.459500    
 C   -2.433300     -0.7692000      9.6699998E-02
 C    1.872200      -1.465700      0.9685000    
 C   -4.412500       1.194700      4.4000000E-03
 C    1.613200      -1.841000      -1.404000    
 C   -3.769500      -1.115500      0.2978000    
 C    6.240700      0.7744000       1.104200    
 C    1.044500       2.404600     -0.7793000    
 C    4.269000      -3.118800      0.8345000    
 C    3.133100      -4.300700      -1.052600    
 C   -6.457200      -1.602900       1.308800    
 C   -7.169300      0.2812000     -0.1715000    
 H    3.604100       1.236000       1.628200    
 H    3.772400       1.023700     -0.1096000    
 H    3.421000       3.488300     -0.4399000    
 H    3.247200       3.690600       1.310500    
 H    5.614000       2.761100       1.619700    
 H    5.794300       2.487600     -0.1150000    
 H   0.6416000      8.0799997E-02   1.817900    
 H   -2.829000       2.581400     -0.3849000    
 H   0.1855000     -0.5816000      -2.406700    
 H   -1.705000      -1.571000      0.1406000    
 H    2.319200      -1.696000       1.931500    
 H   -5.156600       1.985500     -2.5599999E-02
 H    1.871700      -2.352900      -2.326600    
 H   -4.007400      -2.160300      0.4764000    
 H    1.159200       2.706300       1.267300    
 H    6.116000      4.0800001E-02  0.3013000    
 H    7.305900       1.012700       1.183900    
 H    5.924000      0.3122000       2.044700    
 H    4.671900      -2.103700      0.9213000    
 H    5.103600      -3.764800      0.5400000    
 H    3.925000      -3.452900       1.818900    
 H    3.540500      -4.022200      -2.030200    
 H    2.106200      -4.661200      -1.180800    
 H    3.719800      -5.148200     -0.6805000    
 H   -6.329100      -2.550900      0.7757000    
 H   -7.503100      -1.545500       1.630800    
 H   -5.847900      -1.617800       2.219600    
 H   -7.363100       1.204900      0.3838000    
 H   -8.104700     -0.2889000     -0.1990000    
 H   -6.923100      0.5308000      -1.209900    


%chk=000118741-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000118741

0 1
O 1.701613 1.818960 -2.151249
N 1.723671 2.847636 -0.052780
N 2.999464 -4.197707 0.075143
N -6.196465 -0.166369 0.675511
N -0.136911 1.580923 -0.654152
C 4.177459 2.749671 0.514847
C -0.539103 0.355537 -0.358640
C 0.360692 -0.836599 -0.276331
C -1.989054 0.189623 -0.054083
C 3.036657 3.477105 -0.236256
C 5.548606 3.428405 0.296071
C 2.137525 -3.103678 -0.039044
C -4.825320 -0.051309 0.435845
C 0.255703 -1.752577 0.809275
C -2.783147 1.322185 0.281414
C 1.376055 -1.084015 -1.244707
C -2.652212 -1.065337 -0.149791
C 1.121974 -2.850306 0.939557
C -4.157729 1.215771 0.527223
C 2.233392 -2.190575 -1.138549
C -4.031791 -1.190555 0.084204
C 6.695163 2.713350 1.043242
C 1.152559 2.023975 -1.017421
C 2.875445 -5.118896 1.211106
C 4.046374 -4.416122 -0.931093
C -6.854433 -1.474805 0.570585
C -6.992948 1.026459 0.992597
H 3.949390 2.717624 1.600619
H 4.215413 1.699444 0.165679
H 3.240851 3.466721 -1.321908
H 2.984122 4.535454 0.090317
H 5.493725 4.486069 0.627613
H 5.772378 3.453423 -0.789707
H -0.503257 -1.584165 1.581835
H -2.286057 2.296387 0.331171
H 1.483914 -0.399310 -2.091936
H -2.083566 -1.953756 -0.443534
H 1.011483 -3.507235 1.807041
H -4.719204 2.116978 0.789288
H 2.982250 -2.342303 -1.920991
H -4.495523 -2.175166 -0.022231
H 1.202507 2.996994 0.811850
H 6.787452 1.662564 0.710016
H 7.666664 3.211328 0.867603
H 6.511872 2.703362 2.134487
H 3.045348 -4.606450 2.180593
H 3.624724 -5.920555 1.116218
H 1.873432 -5.592911 1.248521
H 4.742245 -3.555097 -0.993678
H 3.619430 -4.582054 -1.941121
H 4.634145 -5.307756 -0.661451
H -6.782585 -1.894195 -0.454114
H -7.922075 -1.369823 0.819844
H -6.412660 -2.211417 1.271602
H -6.645852 1.516428 1.924750
H -8.045743 0.736310 1.135247
H -6.953866 1.777357 0.177455


