%chk=000170640.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000170640

0 1
 O    3.602800      0.3454000      0.5105000    
 N   -2.705900     -0.2444000      0.3674000    
 C  -0.4191000      0.1420000     -0.4500000    
 C   -1.879900      5.0299998E-02 -0.8031000    
 C   0.1413000       1.356800     -7.7600002E-02
 C   0.3526000      -1.011600     -0.5056000    
 C    1.708200     -0.9488000     -0.1830000    
 C    1.496900       1.419600      0.2447000    
 C    2.280400      0.2668000      0.1922000    
 C  -0.6775000       2.604200     -1.3800000E-02
 C   -2.310700      -1.519900      0.9636000    
 C   -4.121400     -0.2680000      1.2000001E-03
 C    2.532200      -2.192400     -0.2464000    
 H   -2.210800      0.9800000      -1.281200    
 H   -2.014300     -0.7180000      -1.579000    
 H  -8.7600000E-02  -1.956600     -0.8132000    
 H    1.952900       2.362300      0.5374000    
 H  -0.1100000       3.435000      0.4207000    
 H  -0.9863000       2.914000      -1.017300    
 H   -1.560500       2.465700      0.6180000    
 H   -1.344100      -1.457700       1.472400    
 H   -2.298800      -2.342000      0.2386000    
 H   -3.018400      -1.798100       1.754900    
 H   -4.746200     -0.4361000      0.8855000    
 H   -4.346300      -1.049400     -0.7339000    
 H   -4.427500      0.6977000     -0.4168000    
 H    2.953200      -2.426800      0.7370000    
 H    1.935600      -3.058100     -0.5549000    
 H    3.340900      -2.082600     -0.9765000    
 H    4.032300     -0.5206000      0.4337000    


%chk=000170640-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000170640

0 1
O 3.683060 0.449819 0.573421
N -2.788519 -0.154718 0.282616
C -0.394036 -0.010296 -0.489056
C -1.855057 -0.182645 -0.879611
C 0.097803 1.234584 0.012625
C 0.504706 -1.092662 -0.637079
C 1.877009 -1.005370 -0.302328
C 1.463663 1.336578 0.357038
C 2.338066 0.239676 0.202517
C -0.817490 2.436067 0.165417
C -2.560414 -1.265670 1.227817
C -4.197016 -0.077335 -0.153284
C 2.825131 -2.180343 -0.469647
H -2.164877 0.641378 -1.552927
H -1.967915 -1.134195 -1.462459
H 0.121130 -2.045201 -1.026117
H 1.872138 2.274561 0.747290
H -0.325110 3.247451 0.727879
H -1.108477 2.843720 -0.823630
H -1.748473 2.143253 0.682338
H -1.514662 -1.249740 1.576918
H -2.761161 -2.272119 0.776406
H -3.221056 -1.145641 2.105234
H -4.855114 0.016366 0.729222
H -4.532124 -0.973487 -0.737039
H -4.344439 0.816155 -0.786879
H 3.280662 -2.494769 0.491971
H 2.290076 -3.057330 -0.870236
H 3.650415 -1.957561 -1.176779
H 4.216078 -0.371823 0.433861


