%chk=000173318.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000173318

0 1
 O   -1.702000     -0.2193000       1.059800    
 O   -1.271600     -5.9500001E-02  -1.905000    
 O   -4.212500       1.156500     -0.2120000    
 O   -2.341600      -2.922400       1.272800    
 O   0.1492000       3.353400      0.2667000    
 O    4.181300       1.159900      7.3700003E-02
 N   0.1159000       1.019000      0.2502000    
 N    2.151900       2.240900      0.1711000    
 C   -1.989700      0.8183000      -1.045800    
 C   -3.302300      0.1611000     -0.6740000    
 C   -1.313000      0.9394000      0.3108000    
 C   -2.929900     -0.7368000      0.5072000    
 C   -2.688300      -2.186800      0.1122000    
 C   0.8785000     -0.1460000      0.2089000    
 C   0.7551000       2.280300      0.2321000    
 C    2.216600     -0.1840000      0.1509000    
 C    2.954900       1.110600      0.1281000    
 C    2.941200      -1.428100      0.1106000    
 C    2.374500      -2.509700     -0.4602000    
 C    3.031800      -3.846800     -0.5581000    
 H   -2.089900       1.790800      -1.537600    
 H   -3.782900     -0.3847000      -1.491100    
 H   -1.702400       1.811300      0.8505000    
 H   -3.678000     -0.6953000       1.307700    
 H   -1.859600      -2.279900     -0.5959000    
 H   -3.588900      -2.627000     -0.3269000    
 H   -1.778800     -0.1385000      -2.730900    
 H   -3.852000       1.569700      0.5900000    
 H   0.2985000      -1.060700      0.2416000    
 H    2.629100       3.138000      0.1566000    
 H   -2.194700      -3.842800      0.9956000    
 H    3.933700      -1.475300      0.5451000    
 H    1.395500      -2.468500     -0.9305000    
 H    3.140100      -4.134000      -1.608500    
 H    2.418800      -4.601300     -5.5700000E-02
 H    4.025000      -3.852600     -9.8300003E-02


%chk=000173318-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000173318

0 1
O -1.827507 -0.294991 1.197387
O -2.030280 1.363331 -1.801527
O -4.596579 0.710419 0.730721
O -1.317889 -2.765261 -0.268796
O -0.083077 3.045396 -0.708342
O 3.935423 0.694116 -1.115285
N 0.003665 0.836583 0.090994
N 1.912295 1.821032 -0.862110
C -2.486848 1.399930 -0.422456
C -3.587074 0.310229 -0.251563
C -1.395524 0.979774 0.643930
C -2.799296 -0.922465 0.231924
C -2.121998 -1.703338 -0.896744
C 0.724245 -0.342750 0.275668
C 0.574500 1.971316 -0.505473
C 2.042071 -0.496698 -0.119731
C 2.733393 0.656933 -0.726017
C 2.815713 -1.739780 0.032604
C 2.356559 -2.939155 0.495469
C 3.212858 -4.174115 0.636876
H -2.893176 2.392278 -0.159364
H -4.133436 0.167343 -1.194534
H -1.343936 1.704195 1.474782
H -3.407612 -1.600026 0.852073
H -1.504581 -1.033367 -1.525960
H -2.924958 -2.139124 -1.528444
H -1.468739 2.174360 -1.940650
H -4.188871 0.685484 1.635903
H 0.152548 -1.146204 0.744848
H 2.355376 2.639782 -1.291851
H -0.861430 -3.288053 -0.974903
H 3.865240 -1.647964 -0.277844
H 1.303634 -3.044114 0.801103
H 2.811188 -5.014794 0.036562
H 3.235805 -4.523912 1.688099
H 4.251798 -3.987191 0.314354


