%chk=000226489.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000226489

0 1
 O   -2.604100      -2.630100      0.3103000    
 O    1.443800       1.164100     -0.5241000    
 O   -2.623700       2.600700     -0.2462000    
 O  -0.6531000      -2.782600     -0.9174000    
 O  -0.4341000       3.228700      0.1384000    
 N    1.633200      -1.341600      0.8100000    
 C   -1.673200      6.7599997E-02  0.7408000    
 C  -0.8402000      -1.216100      0.8960000    
 C  -0.9883000      0.9406000     -0.3273000    
 C   0.5292000     -0.7329000      0.5549000    
 C   0.4540000      0.5696000     -0.1533000    
 C   -1.324200      -2.294100     -1.8400000E-02
 C   -1.283800       2.385400     -0.1147000    
 C    2.805400     -0.6974000      0.3732000    
 C   -3.195300      -3.657600     -0.4914000    
 C   -3.049600       3.954900     -6.5200001E-02
 C    3.454400      0.1977000       1.216400    
 C    3.303400     -0.9614000     -0.8979000    
 C   -4.605500      -3.913200     -4.0000002E-03
 C   -4.551300       4.027400     -0.2417000    
 C    4.616300      0.8365000      0.7832000    
 C    4.465300     -0.3225000      -1.331100    
 C    5.121700      0.5764000     -0.4905000    
 H   -2.718300     -0.1219000      0.4716000    
 H   -1.689800      0.5971000       1.703900    
 H  -0.8538000      -1.590400       1.924800    
 H   -1.286600      0.6425000      -1.338500    
 H   -3.218100      -3.335600      -1.538500    
 H   -2.601900      -4.574700     -0.4056000    
 H   -2.778600       4.291200      0.9418000    
 H   -2.558200       4.594500     -0.8069000    
 H    3.067800      0.4057000       2.210400    
 H    2.798400      -1.660700      -1.558800    
 H   -5.206100      -2.999800     -6.6500001E-02
 H   -4.600400      -4.218800       1.047500    
 H   -5.088600      -4.695000     -0.5967000    
 H   -5.056000       3.378200      0.4815000    
 H   -4.839400       3.677000      -1.238400    
 H   -4.911800       5.051200     -0.1093000    
 H    5.127200       1.536700       1.437600    
 H    4.858600     -0.5248000      -2.323000    
 H    6.026100       1.074000     -0.8279000    


%chk=000226489-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000226489

0 1
O -1.784050 -3.138827 0.719234
O 0.063393 1.867822 -0.721696
O -2.816838 3.450757 -0.602494
O -2.898347 -1.586340 -0.613534
O -2.316653 3.374412 1.673807
N 0.876821 -0.902336 0.659812
C -2.425388 0.408816 1.499111
C -1.500393 -0.816482 1.283360
C -2.144548 1.336446 0.293931
C -0.243970 -0.234413 0.592313
C -0.652631 1.089376 -0.041136
C -2.148038 -1.849567 0.359306
C -2.429848 2.804852 0.562595
C 2.180845 -0.684874 0.172005
C -2.286551 -4.239614 -0.167053
C -3.027544 4.930531 -0.499498
C 3.098961 -1.717291 0.541257
C 2.654591 0.408286 -0.621313
C -1.749959 -5.544569 0.410033
C -3.383484 5.419906 -1.898728
C 4.445969 -1.667737 0.138722
C 4.005486 0.445864 -1.021356
C 4.904638 -0.582322 -0.646854
H -3.489487 0.130348 1.560069
H -2.146789 0.932447 2.430624
H -1.202605 -1.324499 2.212299
H -2.722007 1.009488 -0.592014
H -3.390656 -4.197812 -0.176840
H -1.924051 -4.045496 -1.192472
H -3.832296 5.113511 0.235490
H -2.096033 5.381987 -0.113763
H 2.709920 -2.542108 1.146153
H 1.962822 1.203573 -0.910107
H -2.113600 -5.700278 1.440002
H -0.646931 -5.542451 0.426474
H -2.088076 -6.394269 -0.210737
H -4.305113 4.935797 -2.264328
H -2.568948 5.199732 -2.609230
H -3.546984 6.512940 -1.881964
H 5.135969 -2.466226 0.431541
H 4.360618 1.285157 -1.629598
H 5.952585 -0.538041 -0.964418


