%chk=000149952.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000149952

0 1
 O  -0.9999000      0.3771000       1.858600    
 O   0.1744000       2.125400      -1.519500    
 O    7.099500     -0.6473000      -1.243000    
 O   -2.953500     -0.1235000      -1.152400    
 O   -5.907200      0.3968000       1.026800    
 N    1.075900       1.606000      0.5635000    
 N  -0.9446000      -1.271300      0.2234000    
 N   -4.550200      -1.558600     -0.2619000    
 N   -7.412800      0.6622000     -0.6905000    
 C   0.9771000      0.1711000      0.4716000    
 C    2.048300     -0.5380000       1.308100    
 C    3.395200     -0.5677000      0.6279000    
 C  -0.4157000     -0.2170000      0.9550000    
 C    4.304300      0.4694000      0.8366000    
 C    3.731000      -1.631500     -0.2095000    
 C   -2.270100      -1.803700      0.4435000    
 C   0.6640000       2.463400     -0.4450000    
 C    5.549200      0.4427000      0.2081000    
 C    4.975900      -1.658300     -0.8381000    
 C    5.885000     -0.6211000     -0.6292000    
 C   -3.263800      -1.066500     -0.4287000    
 C   0.8560000       3.911200     -8.0300003E-02
 C   -5.703800      -1.007000     -0.9356000    
 C   -6.314100      8.6300001E-02 -8.9400001E-02
 H    1.072600     -0.1045000     -0.5866000    
 H    1.742800      -1.573400       1.511600    
 H    2.144500     -7.0299998E-02   2.297400    
 H    1.397200       2.005700       1.440900    
 H  -0.3889000      -1.693600     -0.5145000    
 H    4.054800       1.303800       1.486800    
 H    3.030000      -2.443900     -0.3820000    
 H   -2.257900      -2.864100      0.1748000    
 H   -2.548400      -1.689100       1.495800    
 H    6.248400       1.256800      0.3788000    
 H    5.231400      -2.489300      -1.489900    
 H    1.844700       4.065700      0.3613000    
 H   0.7744000       4.530400     -0.9778000    
 H   8.6099997E-02   4.210100      0.6363000    
 H   -4.704700      -2.329100      0.3821000    
 H   -5.407900     -0.5988000      -1.907100    
 H   -6.430700      -1.812100      -1.077400    
 H    7.599200      0.1470000     -0.9867000    
 H   -7.932200       1.401800     -0.2294000    
 H   -7.739800      0.3786000      -1.608500    


%chk=000149952-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000149952

0 1
O -0.550549 1.307211 2.102631
O 2.023988 2.585315 -1.698278
O 7.144647 -1.279348 -1.155112
O -3.197521 -1.008023 -1.328290
O -7.428660 -0.990669 1.148328
N 1.641606 2.049247 0.534925
N -1.435789 0.208519 0.258915
N -4.969226 -0.799694 0.154168
N -8.314702 -2.071304 -0.709716
C 0.974057 0.775126 0.250083
C 1.763594 -0.458588 0.784582
C 3.193632 -0.613187 0.276758
C -0.406435 0.797803 0.942845
C 4.157484 -1.228172 1.113971
C 3.595685 -0.224547 -1.029199
C -2.779598 0.108785 0.820851
C 2.091672 2.894086 -0.465807
C 5.477123 -1.466409 0.671440
C 4.909162 -0.452770 -1.485856
C 5.849568 -1.078464 -0.637257
C -3.664022 -0.614381 -0.209223
C 2.696621 4.210270 0.008921
C -5.923196 -1.463394 -0.728289
C -7.285210 -1.484932 -0.010518
H 0.866706 0.719462 -0.848584
H 1.175565 -1.362104 0.517693
H 1.767767 -0.409400 1.890933
H 1.600551 2.366965 1.507111
H -1.335090 -0.170716 -0.692199
H 3.875641 -1.529108 2.130775
H 2.895419 0.291917 -1.694666
H -2.763372 -0.443638 1.780868
H -3.186383 1.114753 1.045144
H 6.204955 -1.944703 1.340468
H 5.220744 -0.145034 -2.488301
H 2.571649 4.385226 1.091319
H 3.774937 4.215564 -0.229012
H 2.232838 5.041026 -0.548920
H -5.358360 -0.485656 1.053980
H -6.000334 -0.928801 -1.695517
H -5.591395 -2.494313 -0.962014
H 7.724368 -1.718377 -0.484377
H -9.237760 -2.111482 -0.277757
H -8.186680 -2.462260 -1.641918


