%chk=000137376.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000137376

0 1
 O   -4.908200      -1.020700      -1.086900    
 O    4.856900      0.2315000      -2.017700    
 N    2.887100     -0.6387000       2.626400    
 C  -0.6744000      0.7652000      0.4544000    
 C   0.1884000     -0.4353000     -8.4799998E-02
 C   -2.027100      0.7358000     -0.2607000    
 C   -2.797000     -0.5680000      3.4600001E-02
 C    1.621300     -0.4517000      0.5604000    
 C  -0.5781000      -1.782600      7.3000002E-03
 C   -2.006800      -1.725000     -0.5676000    
 C   4.7600001E-02   2.111700      0.2653000    
 C   -3.048200       1.838900     -5.5999998E-03
 C    2.223500      0.9294000      0.2705000    
 C    1.464800       2.101400      0.8424000    
 C   -4.104200     -0.2086000     -0.6487000    
 C    2.542600      -1.568100     -8.8999998E-03
 C   -4.310600       1.296300     -0.6920000    
 C    1.561300     -0.7087000       2.087800    
 C   -3.134300     -0.8334000       1.513500    
 C    3.086700      -1.260100      -1.391800    
 C    3.266000       1.147700     -0.5483000    
 C    3.842800      4.3000001E-02  -1.349800    
 H  -0.8421000      0.6409000       1.529400    
 H   0.3256000     -0.2537000      -1.162600    
 H   -1.812300      0.7801000      -1.342700    
 H  -0.6294000      -2.119900       1.047000    
 H  -3.8199998E-02  -2.558800     -0.5450000    
 H   -1.952500      -1.618700      -1.659000    
 H   -2.515800      -2.679300     -0.3847000    
 H  -0.5237000       2.914000      0.7468000    
 H   9.4400004E-02   2.356700     -0.8043000    
 H   -2.748300       2.798600     -0.4380000    
 H   -3.217500       1.994200       1.065400    
 H    1.438500       2.054100       1.935700    
 H    1.951800       3.052800      0.5951000    
 H    2.028900      -2.534700     -2.3300000E-02
 H    3.433600      -1.736000      0.6051000    
 H   -4.358900       1.616100      -1.736800    
 H   -5.216300       1.583900     -0.1538000    
 H    1.136800      -1.694100       2.309100    
 H   0.9282000      1.6500000E-02   2.605800    
 H   -3.715600      -1.758700       1.608700    
 H   -2.245000     -0.9435000       2.139500    
 H   -3.747800     -3.8800001E-02   1.951600    
 H    2.291900      -1.189100      -2.140600    
 H    3.775700      -2.054800      -1.699000    
 H    3.652100       2.143400     -0.7380000    
 H    3.345400      -1.547400       2.570800    
 H    2.837600     -0.4400000       3.625800    


%chk=000137376-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000137376

0 1
O -4.935462 -1.042355 -1.247738
O 4.810014 0.270929 -2.235171
N 2.810964 -0.333175 2.803453
C -0.655695 0.747393 0.500766
C 0.182319 -0.470393 -0.038165
C -2.004455 0.747878 -0.246521
C -2.817166 -0.562286 -0.014009
C 1.647308 -0.508735 0.576852
C -0.604197 -1.808962 0.104440
C -2.012858 -1.762137 -0.553021
C 0.094644 2.091555 0.347995
C -3.042043 1.881490 -0.025397
C 2.251827 0.878643 0.316586
C 1.524457 2.033996 0.962535
C -4.135903 -0.223094 -0.736073
C 2.540014 -1.618505 -0.064073
C -4.315510 1.313545 -0.718265
C 1.589191 -0.795420 2.118209
C -3.230165 -0.796014 1.475325
C 3.069550 -1.278992 -1.471563
C 3.273606 1.092306 -0.575760
C 3.822747 0.052535 -1.466763
H -0.854514 0.597468 1.582623
H 0.314098 -0.288266 -1.129195
H -1.758525 0.766389 -1.335092
H -0.703807 -2.074285 1.175022
H -0.033653 -2.631308 -0.365721
H -1.904666 -1.664262 -1.651954
H -2.550609 -2.711122 -0.369698
H -0.484347 2.900840 0.832813
H 0.176730 2.349158 -0.728328
H -2.722309 2.840567 -0.467191
H -3.219053 2.057980 1.052130
H 1.465895 1.885595 2.056305
H 2.056445 2.984581 0.778350
H 1.990373 -2.576505 -0.083620
H 3.416384 -1.786390 0.595114
H -4.396163 1.657164 -1.767890
H -5.267454 1.585074 -0.227409
H 1.392727 -1.887616 2.242275
H 0.732274 -0.264227 2.571526
H -3.867874 -1.696043 1.537086
H -2.350749 -0.955231 2.122257
H -3.802195 0.051413 1.893483
H 2.231198 -1.189923 -2.192807
H 3.740202 -2.067629 -1.855376
H 3.685491 2.101010 -0.710431
H 3.687620 -0.576416 2.333260
H 2.840493 -0.534417 3.806629


