%chk=000128034.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000128034

0 1
 O    3.032100      0.1521000       1.206200    
 O   -2.775700     -0.5606000       1.451400    
 O    3.082300      0.3887000      -1.083000    
 O   -3.070500     -0.3640000     -0.8231000    
 O   -1.331000       1.000000      -2.676700    
 N   0.4255000      -3.129700     -0.1204000    
 N  -0.2100000       1.332800      -2.269000    
 C   9.3500003E-02 -0.3583000      4.6399999E-02
 C    1.369100     -0.9052000     -4.5699999E-02
 C   -1.016100      -1.197000      5.5100001E-02
 C  -7.8900002E-02   1.081200      0.1335000    
 C    1.480200      -2.284000     -0.1260000    
 C  -0.7983000      -2.562700     -2.9899999E-02
 C  -0.2238000       1.875800      -1.003900    
 C  -9.7199999E-02   1.666100       1.399700    
 C    2.822200      -2.933800     -0.2271000    
 C   -1.948100      -3.517200     -2.5699999E-02
 C    2.563600     -6.6000000E-02 -5.8400001E-02
 C   -2.374300     -0.6701000      0.1501000    
 C  -0.3871000       3.255200     -0.8748000    
 C  -0.2604000       3.045600       1.528600    
 C  -0.4052000       3.839900      0.3914000    
 C    4.204000      0.9656000       1.325500    
 C   -4.096000     -5.4600000E-02   1.675900    
 H   1.4200000E-02   1.063800       2.298400    
 H    2.724500      -4.023000     -0.2909000    
 H    3.348300      -2.597400      -1.126200    
 H    3.428800      -2.708600      0.6558000    
 H   -2.515100      -3.436200      0.9071000    
 H   -1.597000      -4.551600     -0.1091000    
 H   -2.613000      -3.325900     -0.8741000    
 H  -0.5014000       3.892400      -1.749200    
 H  -0.2746000       3.500900       2.514500    
 H  -0.5321000       4.913800      0.4921000    
 H    4.008400       1.967400      0.9316000    
 H    4.455400       1.046800       2.386200    
 H    5.041900      0.4994000      0.7988000    
 H   -4.182500      0.9609000       1.277900    
 H   -4.270900     -2.6600000E-02   2.754500    
 H   -4.836300     -0.7153000       1.215100    


%chk=000128034-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000128034

0 1
O 2.738579 0.802722 0.690046
O -3.025274 -0.997566 1.526175
O 3.656976 -0.589679 -0.927989
O -2.840794 0.242100 -0.436167
O 0.769100 2.178213 -3.021078
N 0.321461 -3.239218 -0.034614
N 0.606471 1.356349 -2.048046
C 0.163858 -0.410805 0.152157
C 1.417503 -1.057567 -0.048852
C -0.999469 -1.219788 0.268916
C 0.012734 1.074962 0.301328
C 1.458057 -2.485367 -0.138388
C -0.887521 -2.637954 0.157840
C 0.209593 1.974434 -0.786282
C -0.387606 1.611843 1.548769
C 2.734400 -3.270585 -0.337359
C -2.085177 -3.560690 0.211484
C 2.697146 -0.294221 -0.178177
C -2.348126 -0.572799 0.377654
C 0.017192 3.373035 -0.632221
C -0.570943 3.001753 1.706683
C -0.369710 3.887614 0.615474
C 3.959559 1.639952 0.596918
C -4.392172 -0.442686 1.698979
H -0.534704 0.938237 2.399519
H 2.509289 -4.340146 -0.212056
H 3.146374 -3.095111 -1.346402
H 3.524889 -2.968449 0.372350
H -2.526087 -3.573020 1.223911
H -1.760139 -4.577253 -0.055350
H -2.880313 -3.238349 -0.485553
H 0.171667 4.015473 -1.506341
H -0.870505 3.399487 2.682773
H -0.522428 4.963976 0.748781
H 4.059962 2.054374 -0.420290
H 3.809089 2.435904 1.339286
H 4.852888 1.037203 0.831495
H -4.351258 0.658217 1.749224
H -4.751016 -0.872955 2.644089
H -5.035044 -0.741040 0.853915


