%chk=000146789.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000146789

0 1
 O   -2.287800      -2.386400      -2.858700    
 O    3.817900      -2.360900     -0.6056000    
 O    5.216100     -0.4046000      0.7878000    
 N   -2.953400      -2.324400      0.7905000    
 N  -0.7755000     -0.4190000      -1.450100    
 N    1.423200       2.461300      0.6559000    
 N   -2.310700       5.483400      0.6192000    
 C   -2.761200      -1.827500      -1.632000    
 C   -2.406200      -2.776300     -0.4812000    
 C   -2.199100     -0.4095000      -1.500800    
 C  -2.9800000E-02  0.5574000     -0.7360000    
 C   -4.398300      -2.109700      0.6850000    
 C   -2.661500      -3.290600       1.851700    
 C    1.291300      0.2866000     -0.3650000    
 C  -0.6235000       1.780900     -0.4102000    
 C    1.990400       1.281100      0.3397000    
 C   0.1505000       2.717000      0.2963000    
 C    1.913000     -0.9345000     -0.6791000    
 C   -4.970100      -1.573100       1.986300    
 C   -1.166700      -3.530000       1.980300    
 C   -1.949200       2.079600     -0.7701000    
 C    3.306000       1.017500      0.7118000    
 C  -0.4351000       3.936900      0.6236000    
 C    3.229300      -1.173100     -0.2955000    
 C    3.926900     -0.1948000      0.4014000    
 C   -1.752300       4.237000      0.2674000    
 C   -2.511300       3.306700     -0.4309000    
 C    3.688400      -3.417000      0.3448000    
 C    6.238700     -1.3800000E-02 -0.1265000    
 H   -3.842300      -1.764900      -1.784800    
 H   -1.313700      -2.853900     -0.4516000    
 H   -2.768600      -3.784100     -0.7291000    
 H   -2.671300     -6.3699998E-02 -0.5774000    
 H   -2.525200      8.6599998E-02  -2.422800    
 H  -0.2809000      -1.129000      -1.973400    
 H   -4.930400      -3.022900      0.3907000    
 H   -4.639000      -1.333300     -4.5299999E-02
 H   -2.983100      -2.903800       2.824100    
 H   -3.174500      -4.246800       1.688200    
 H    1.401400      -1.730800      -1.211300    
 H   -5.988700      -1.205600       1.816400    
 H   -4.381700     -0.7337000       2.372900    
 H   -5.043900      -2.343100       2.760300    
 H  -0.9604000      -4.064600       2.914600    
 H  -0.6052000      -2.589700       2.013000    
 H  -0.7710000      -4.153200       1.172300    
 H   -2.694000      -3.264200      -2.960000    
 H   -2.602300       1.620400      -1.480500    
 H    3.867400       1.773200       1.259600    
 H   0.1504000       4.674500       1.171600    
 H   -3.522300       3.546100     -0.7516000    
 H   -3.263300       5.702700      0.3597000    
 H   -1.756900       6.161800       1.125000    
 H    2.634200      -3.673200      0.4919000    
 H    4.143300      -3.134100       1.299200    
 H    4.210800      -4.294800     -4.5299999E-02
 H    7.207500     -0.2501000      0.3217000    
 H    6.193400       1.063600     -0.3147000    
 H    6.144900     -0.5643000      -1.067900    


%chk=000146789-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000146789

0 1
O -1.675310 -2.581841 -2.746070
O 3.668701 -2.575225 -1.039573
O 5.232119 -0.755782 0.610938
N -3.184398 -2.350888 0.730080
N -0.868704 -0.248423 -1.683560
N 1.449711 2.209888 0.979119
N -2.089643 5.491080 1.344893
C -2.546630 -2.049861 -1.673303
C -2.208718 -2.719909 -0.318680
C -2.311751 -0.524313 -1.667536
C -0.139657 0.584184 -0.843236
C -4.418738 -3.184465 0.683625
C -2.588733 -2.276978 2.095975
C 1.205580 0.196276 -0.478472
C -0.647204 1.824877 -0.328774
C 1.955958 1.066447 0.416893
C 0.176328 2.580199 0.616654
C 1.813476 -1.027815 -0.913918
C -5.652714 -2.467605 1.263534
C -1.693510 -1.043161 2.308581
C -1.894414 2.414408 -0.737289
C 3.312616 0.711959 0.739708
C -0.335344 3.793068 1.179006
C 3.118543 -1.358932 -0.560640
C 3.897552 -0.448917 0.250051
C -1.583651 4.309481 0.801980
C -2.353124 3.610370 -0.201374
C 4.005812 -3.551075 0.022925
C 6.175585 -0.803977 -0.530606
H -3.610992 -2.237406 -1.927243
H -1.198083 -2.393257 -0.016150
H -2.156756 -3.831166 -0.469373
H -2.779785 -0.127657 -0.751163
H -2.818896 -0.083966 -2.549864
H -0.355323 -0.953472 -2.219531
H -4.265073 -4.160703 1.209776
H -4.622637 -3.432736 -0.375256
H -3.425158 -2.231433 2.816662
H -2.016761 -3.209204 2.334344
H 1.272084 -1.762819 -1.520705
H -6.546743 -3.114175 1.186836
H -5.843890 -1.530331 0.712422
H -5.516646 -2.210987 2.329276
H -1.322475 -1.017496 3.349848
H -2.261044 -0.115972 2.116967
H -0.809697 -1.038905 1.646178
H -1.687773 -3.571287 -2.723977
H -2.484318 1.941287 -1.526132
H 3.885743 1.391453 1.375827
H 0.307688 4.312947 1.897038
H -3.298695 4.043268 -0.550981
H -2.984788 5.863177 1.042777
H -1.557974 6.012810 2.035458
H 3.086173 -3.873674 0.548729
H 4.717231 -3.114778 0.746875
H 4.460473 -4.408414 -0.497318
H 7.144352 -1.098505 -0.098555
H 6.258963 0.197498 -0.994000
H 5.845666 -1.541867 -1.284197


