%chk=000175809.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000175809

0 1
 O   0.6726000     -0.5592000     -2.8800000E-02
 O  -9.3599997E-02   1.499400      0.7581000    
 O    4.527500      0.2981000       1.098900    
 O    4.021000      -1.838000     -0.7815000    
 O    2.565400       2.467900      0.7484000    
 O  -4.2500000E-02  -2.732100      -1.552900    
 O   -2.647500       2.241500      -1.599300    
 N   -1.320000       1.295400      7.5300001E-02
 C    3.411200      0.2734000      0.2081000    
 C    3.013900      -1.186400     -1.1800000E-02
 C    2.259000       1.075300      0.8135000    
 C    1.675100      -1.280000     -0.7474000    
 C   0.9549000      0.8359000      5.2700002E-02
 C    1.200600      -2.724100     -0.8751000    
 C   -2.171700      0.1852000      0.3608000    
 C   -1.641100       2.243300     -0.8886000    
 C   -2.957300     -0.3269000     -0.6501000    
 C   -2.178600     -0.3365000       1.637100    
 C  -0.6344000       3.359300      -1.072300    
 C   -3.788900      -1.411500     -0.3716000    
 C   -3.010200      -1.421300       1.915400    
 C   -3.815400      -1.958700      0.9111000    
 H    3.751600      0.7337000     -0.7277000    
 H    2.958400      -1.698700      0.9565000    
 H    2.139000      0.8260000       1.874500    
 H    1.750100     -0.8578000      -1.758900    
 H    1.031800       1.244500     -0.9609000    
 H    1.048500      -3.184500      0.1068000    
 H    1.907600      -3.333800      -1.444900    
 H    5.235900     -0.2299000      0.6925000    
 H    4.072400      -1.394800      -1.645500    
 H    2.668500       2.710700     -0.1875000    
 H  -0.6652000      -2.199400      -1.029600    
 H   -2.922600      1.1900000E-02  -1.678500    
 H   -1.560000      7.4400000E-02   2.429300    
 H   0.1471000       3.050700      -1.769500    
 H   -1.148600       4.225600      -1.502300    
 H  -0.1977000       3.686900     -0.1262000    
 H   -4.403500      -1.841500      -1.157200    
 H   -3.030700      -1.847700       2.914100    
 H   -4.459800      -2.805900       1.126900    


%chk=000175809-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000175809

0 1
O 0.808973 -0.767447 0.325777
O -0.144982 1.341768 0.658421
O 4.621412 0.875800 0.128004
O 4.285836 -1.955298 -0.586119
O 2.350222 2.554656 -0.301341
O 0.101725 -3.453916 -0.280821
O -2.837137 2.884905 -1.172564
N -1.404509 1.412093 -0.088215
C 3.354114 0.314147 -0.341510
C 3.205453 -1.169683 0.044003
C 2.253364 1.209805 0.260606
C 1.792830 -1.659529 -0.335412
C 0.876191 0.634455 -0.105919
C 1.432345 -3.061552 0.169221
C -2.267402 0.263581 0.022377
C -1.741740 2.703679 -0.568392
C -3.277468 0.030434 -0.948684
C -2.099094 -0.641617 1.103161
C -0.735899 3.807335 -0.301705
C -4.104360 -1.107951 -0.828438
C -2.926487 -1.780696 1.198208
C -3.934791 -2.022334 0.234903
H 3.293501 0.393993 -1.453963
H 3.377770 -1.300658 1.126402
H 2.361907 1.221555 1.364720
H 1.646635 -1.613369 -1.440603
H 0.668286 0.725631 -1.192877
H 1.512260 -3.072906 1.277218
H 2.128702 -3.807383 -0.246934
H 5.345133 0.237837 -0.104876
H 4.117595 -2.017281 -1.563151
H 3.281132 2.868284 -0.159969
H -0.552324 -2.773530 0.033170
H -3.421535 0.740188 -1.763820
H -1.321225 -0.453452 1.846114
H 0.284551 3.550320 -0.632864
H -1.093252 4.711688 -0.816520
H -0.665764 4.004984 0.783318
H -4.882519 -1.278909 -1.580472
H -2.791593 -2.472045 2.037578
H -4.575056 -2.907179 0.313866


