%chk=000170921.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000170921

0 1
 O   -1.228300       1.606100       2.176000    
 O    1.225300      -2.432100       1.260500    
 O    3.557800       1.066700      -1.564100    
 O   -3.543100      0.9783000      -1.637000    
 O    3.978200     -0.6330000     -0.2034000    
 O   -3.986800     -0.6223000     -0.1677000    
 N  -2.0300001E-02   1.438600      0.1943000    
 N   2.0400001E-02  -1.387300     -0.4339000    
 N    1.929400      0.1165000     -0.4413000    
 N   -1.928700      8.0499999E-02 -0.4544000    
 N    3.256100      0.1889000     -0.7605000    
 N   -3.254500      0.1508000     -0.7778000    
 C    1.265600       1.420200     -0.5204000    
 C   -1.242200       1.364800     -0.6171000    
 C    1.244000     -0.9774000      -1.134800    
 C   -1.263900      -1.067400      -1.076400    
 C  -0.1468000       1.591500       1.581800    
 C   0.1439000      -2.113300      0.7587000    
 C    1.132300       1.739900       2.368700    
 C   -1.138200      -2.509900       1.448900    
 H    1.104700       1.736600      -1.559200    
 H    1.885000       2.195700     -5.3500000E-02
 H   -1.873300       2.186300     -0.2494000    
 H   -1.013000       1.580700      -1.668100    
 H    1.880600      -1.872000      -1.165300    
 H    1.023300     -0.7173000      -2.177200    
 H   -1.111600     -0.9052000      -2.150900    
 H   -1.886900      -1.965600     -0.9943000    
 H    1.793300      0.8874000       2.200000    
 H   0.8962000       1.775300       3.436900    
 H    1.635000       2.672700       2.101500    
 H   -1.706400      -3.206000      0.8276000    
 H   -1.738400      -1.628900       1.684700    
 H  -0.8989000      -3.014400       2.390500    


%chk=000170921-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000170921

0 1
O -1.266642 1.403830 1.920965
O 1.254081 -2.002977 1.290469
O 3.770527 1.262188 0.185423
O -3.905083 1.038449 -0.025097
O 3.908853 -0.954252 -0.368120
O -3.769378 -1.227935 -0.313477
N -0.040238 1.512677 -0.034483
N 0.042979 -1.386787 -0.578434
N 1.933181 0.197596 -0.761326
N -1.926752 0.104516 -0.799624
N 3.280407 0.159778 -0.277929
N -3.276899 -0.033480 -0.342203
C 1.225417 1.492819 -0.782244
C -1.312085 1.447155 -0.775706
C 1.321333 -1.060392 -1.233998
C -1.216435 -1.097900 -1.279021
C -0.126689 1.502108 1.379637
C 0.117961 -1.889165 0.744354
C 1.155469 1.567689 2.187922
C -1.172030 -2.229657 1.465979
H 0.993765 1.749715 -1.833721
H 1.937594 2.236441 -0.394115
H -2.054633 2.109251 -0.303383
H -1.121980 1.780279 -1.813488
H 2.059779 -1.850735 -1.027002
H 1.142668 -0.993946 -2.323876
H -0.977520 -0.961776 -2.351189
H -1.930835 -1.930077 -1.188714
H 1.599561 0.557201 2.265508
H 0.891919 1.901373 3.202558
H 1.924533 2.235345 1.768085
H -1.935090 -2.706959 0.830593
H -1.618836 -1.308920 1.886722
H -0.919102 -2.898052 2.302338


