%chk=000035553.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000035553

0 1
 O   -4.041500      0.3688000     -0.1132000    
 O    2.698900       1.862000      9.6400000E-02
 O    1.386800      -2.270100     -0.1099000    
 O   -3.541500       2.613200     -4.1000000E-03
 O    1.293300       3.684400      0.1446000    
 O  -0.8117000      -2.948600     -0.1837000    
 N  -0.8584000       1.954500      2.6200000E-02
 N   -1.577500     -0.3320000     -8.6999997E-02
 N   0.7642000      0.1872000     -1.5000000E-02
 C   -6.253700     -0.6235000     -0.2083000    
 C    5.124500       1.896700      0.1491000    
 C    3.352100      -3.679000     -0.1330000    
 C   -5.440700      0.6718000     -0.1330000    
 C    3.838100       2.727000      0.1574000    
 C    1.822200      -3.622300     -0.1610000    
 C   -7.744000     -0.3110000     -0.3249000    
 C   -5.991200      -1.517800       1.005200    
 C    6.344000       2.801900      0.3086000    
 C    5.243000       1.065300      -1.130200    
 C    3.909300      -3.062000       1.151600    
 C    3.834600      -5.120300     -0.2821000    
 C   -3.175200       1.428200     -4.6999998E-02
 C    1.464500       2.456300      9.5700003E-02
 C   3.9299998E-02  -2.074500     -0.1281000    
 C   -1.793100      0.9923000     -3.4699999E-02
 C   0.3970000       1.477800      3.2600001E-02
 C  -0.2832000     -0.6262000     -7.1999997E-02
 H   -5.939200      -1.180700      -1.099900    
 H    5.092200       1.195900      0.9930000    
 H    3.738300      -3.088800     -0.9739000    
 H   -5.652700       1.295800      -1.009400    
 H   -5.699600       1.233900      0.7726000    
 H    3.782100       3.317200       1.079900    
 H    3.817600       3.409400     -0.7011000    
 H    1.453100      -4.080900      -1.086500    
 H    1.406800      -4.171800      0.6929000    
 H   -8.105200      0.2391000      0.5507000    
 H   -7.945600      0.2962000      -1.213800    
 H   -8.329300      -1.232600     -0.4108000    
 H   -4.935900      -1.803200       1.065600    
 H   -6.259000      -1.009500       1.937700    
 H   -6.579300      -2.439600      0.9417000    
 H    6.421800       3.514600     -0.5195000    
 H    6.285900       3.371500       1.242000    
 H    7.266000       2.211500      0.3350000    
 H    4.408100      0.3630000      -1.224200    
 H    5.250800       1.704600      -2.019500    
 H    6.167900      0.4788000      -1.126800    
 H    3.626700      -2.007600       1.238900    
 H    3.537800      -3.587500       2.037800    
 H    5.003400      -3.111700       1.162400    
 H    3.479300      -5.746600      0.5433000    
 H    3.472700      -5.556600      -1.219100    
 H    4.928800      -5.164900     -0.2944000    


%chk=000035553-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000035553

0 1
O -4.017008 0.455363 0.008230
O 2.691891 2.186823 0.114456
O 1.268640 -2.719386 0.006504
O -3.401053 2.340745 1.247799
O 1.334356 3.074934 -1.570505
O -0.277410 -2.926867 1.747852
N -0.783817 1.766668 0.008714
N -1.419705 -0.494001 0.634011
N 0.899066 0.018959 0.126504
C -6.281104 -0.330963 -0.469421
C 5.042069 2.685231 0.548991
C 3.018470 -4.303842 -0.614169
C -5.468555 0.800011 0.171809
C 3.827241 3.073375 -0.302457
C 1.780874 -4.103215 0.269445
C -7.778514 0.061817 -0.462116
C -6.040931 -1.676090 0.252582
C 6.199977 3.667658 0.248350
C 5.458984 1.217903 0.299383
C 4.133086 -3.294992 -0.255617
C 3.501975 -5.767578 -0.474236
C -3.115818 1.306109 0.607953
C 1.529678 2.290068 -0.618247
C 0.264291 -2.266987 0.835372
C -1.696498 0.822115 0.387810
C 0.494778 1.303895 -0.113783
C -0.103069 -0.834446 0.495504
H -5.945729 -0.428648 -1.521370
H 4.752883 2.794075 1.613431
H 2.711159 -4.130822 -1.664955
H -5.640812 1.776309 -0.318092
H -5.677608 0.902891 1.253406
H 3.515178 4.121968 -0.142204
H 4.007839 2.917428 -1.382937
H 0.970237 -4.816454 0.030611
H 2.019655 -4.185093 1.346790
H -8.148803 0.195556 0.572516
H -7.961220 1.001651 -1.016015
H -8.384534 -0.732594 -0.932870
H -4.968076 -1.933877 0.266339
H -6.396817 -1.627236 1.299935
H -6.588923 -2.492169 -0.252487
H 6.507613 3.606361 -0.813253
H 5.917661 4.715248 0.463402
H 7.081700 3.421188 0.866231
H 4.619954 0.528627 0.497960
H 5.782708 1.075701 -0.750125
H 6.303600 0.936852 0.954332
H 3.766001 -2.256851 -0.334488
H 4.492122 -3.458356 0.779285
H 4.996877 -3.412215 -0.934909
H 3.798027 -5.989584 0.568997
H 2.717886 -6.490025 -0.769003
H 4.383128 -5.943637 -1.116447


