%chk=000146408.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000146408

0 1
 O    2.603000      -2.390100       1.632000    
 O    1.061000       2.515400       1.883300    
 O   0.1752000       3.700600     -0.4698000    
 N    2.673100      -2.108100     -0.6715000    
 C   -2.893600      -1.445000      0.2536000    
 C   -4.137800      -1.044400     -0.5452000    
 C   -2.001500      -2.395000     -0.5508000    
 C   -5.037500     -3.1800002E-02  0.1873000    
 C  -0.7395000      -2.765400      0.2315000    
 C   0.2006000      -3.697200     -0.5378000    
 C   -6.268300      0.3568000     -0.6331000    
 C   -4.231500       1.222600      0.5340000    
 C    1.494300      -4.009200      0.2123000    
 C    2.312100      -2.761400      0.4980000    
 C    3.449800     -0.8909000     -0.6694000    
 C    2.579300      0.3310000     -0.6126000    
 C    2.219600      0.8623000      0.6203000    
 C    2.140800      0.9179000      -1.793800    
 C    1.410100       1.997000      0.6729000    
 C    1.331200       2.052500      -1.741300    
 C   0.9659000       2.592000     -0.5079000    
 C  -0.1395000       2.024500       2.476700    
 C   0.8330000       4.966200     -0.4687000    
 H   -2.296200     -0.5637000      0.5080000    
 H   -3.195500      -1.920100       1.194400    
 H   -4.724100      -1.943900     -0.7716000    
 H   -3.828500     -0.6226000      -1.510400    
 H   -1.716400      -1.920100      -1.497400    
 H   -2.559900      -3.305400     -0.7995000    
 H   -5.387400     -0.4852000       1.123300    
 H   -1.023900      -3.243600       1.177000    
 H  -0.2108000      -1.840700      0.4923000    
 H   0.4176000      -3.260900      -1.519400    
 H  -0.3214000      -4.642200     -0.7337000    
 H   -6.863300     -0.5294000     -0.8775000    
 H   -6.909200       1.047400     -7.5000003E-02
 H   -5.981500      0.8415000      -1.572400    
 H   -3.714800       1.625000     -0.3439000    
 H   -3.491400       1.027100       1.315600    
 H   -4.889500       2.008300      0.9223000    
 H    1.269600      -4.499700       1.166300    
 H    2.111000      -4.699600     -0.3745000    
 H    2.413500      -2.498400      -1.572100    
 H    4.058400     -0.8876000      -1.581000    
 H    4.148500     -0.9027000      0.1758000    
 H    2.565900      0.4060000       1.543800    
 H    2.417200      0.5046000      -2.759900    
 H   0.9875000       2.510000      -2.665000    
 H  -6.8000004E-02  0.9464000       2.652600    
 H   -1.001600       2.244100       1.838800    
 H  -0.2779000       2.527800       3.437300    
 H    1.480400       5.063400      0.4085000    
 H    1.418600       5.094600      -1.384600    
 H   7.0100002E-02   5.748600     -0.4286000    


%chk=000146408-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000146408

0 1
O 2.939201 -3.033893 1.547981
O 0.128516 2.301200 0.855152
O 1.186700 4.171962 -1.128894
N 2.697288 -2.146825 -0.588699
C -2.943734 -1.501947 0.550736
C -4.249362 -1.021411 -0.123688
C -2.066166 -2.362159 -0.387434
C -5.228997 -0.259258 0.809106
C -0.749033 -2.833200 0.268098
C 0.108840 -3.714437 -0.667177
C -6.573105 -0.001389 0.086775
C -4.630956 1.072029 1.325088
C 1.434131 -4.195379 -0.019950
C 2.408331 -3.083180 0.395452
C 3.623845 -1.021013 -0.368481
C 2.967788 0.339576 -0.571987
C 1.845039 0.716812 0.206727
C 3.462481 1.247104 -1.540023
C 1.231909 1.972194 0.031694
C 2.867878 2.518347 -1.706109
C 1.763560 2.897705 -0.916151
C -1.143274 2.515280 0.126343
C 1.252938 5.082581 0.039664
H -2.350596 -0.632899 0.900866
H -3.195484 -2.091359 1.457282
H -4.776452 -1.905231 -0.541489
H -4.000793 -0.371442 -0.990689
H -1.832156 -1.780731 -1.304513
H -2.648430 -3.246683 -0.721904
H -5.429362 -0.908207 1.689031
H -0.976637 -3.401504 1.193172
H -0.160103 -1.948899 0.586071
H 0.307915 -3.163745 -1.611728
H -0.475763 -4.608621 -0.963308
H -7.035410 -0.947021 -0.253362
H -7.294224 0.511334 0.750437
H -6.420067 0.639557 -0.803508
H -4.392280 1.742515 0.475409
H -3.704983 0.911750 1.906320
H -5.350424 1.600302 1.978208
H 1.217062 -4.768653 0.897796
H 1.962365 -4.879161 -0.714894
H 2.212660 -2.203248 -1.486095
H 4.498583 -1.117311 -1.040858
H 3.983215 -1.141977 0.670650
H 1.431141 0.037555 0.960318
H 4.324162 0.967646 -2.158093
H 3.250692 3.237282 -2.437590
H -1.471866 1.570084 -0.347779
H -1.033365 3.302644 -0.641137
H -1.873227 2.818330 0.892052
H 0.758448 4.633734 0.919605
H 2.308117 5.313679 0.279256
H 0.730245 5.998882 -0.274249


