%chk=000235246.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000235246

0 1
O 0.889763 0.540547 2.003463
N 2.208695 -1.973960 0.638278
C 0.500987 0.990565 0.691245
C 1.363412 0.157727 -0.314217
C -0.986386 0.698795 0.488727
C 2.807214 0.617801 -0.337388
C 0.789726 2.491035 0.584439
C 1.234613 -1.336402 -0.063416
C -1.702295 1.294048 -0.523202
C -1.629760 -0.228396 1.365898
C -3.092649 1.006765 -0.698709
C 3.372327 1.043651 -1.548322
C 3.582018 0.631119 0.833257
C -3.730640 0.095442 0.182109
C -2.961312 -0.519298 1.220529
C 0.121026 -2.032492 -0.587513
C -3.857486 1.619301 -1.742712
C 4.699374 1.484218 -1.584399
C 4.905921 1.070884 0.791164
C -5.122654 -0.187701 0.006807
C 0.015981 -3.405213 -0.367723
C 5.466914 1.501057 -0.416870
C 2.091036 -3.311954 0.843449
C -5.190764 1.329278 -1.888510
C 1.012136 -4.066070 0.359241
C -5.831798 0.414198 -1.002138
H 0.920204 0.355525 -1.331096
H 0.801647 2.840133 -0.453780
H 1.781373 2.722803 1.001994
H 0.051643 3.091675 1.126110
H -1.232243 1.998118 -1.208626
H -1.025585 -0.707531 2.142192
H 0.530282 1.132557 2.694272
H 2.788945 1.026703 -2.465559
H 3.135358 0.274992 1.768208
H -3.453688 -1.224622 1.888704
H -0.650642 -1.502720 -1.142352
H -3.360678 2.317676 -2.414144
H 5.134416 1.810977 -2.526377
H 5.504790 1.072134 1.699709
H -5.603210 -0.887260 0.689038
H -0.836316 -3.959184 -0.760253
H 6.498942 1.842052 -0.447095
H 2.901728 -3.776230 1.416724
H -5.780336 1.790673 -2.679185
H 0.954530 -5.134255 0.543775
H -6.891157 0.205336 -1.143048


%chk=000235246-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000235246

0 1
O 0.940938 0.727779 2.094251
N 1.948524 -1.937274 0.889882
C 0.515193 1.086287 0.723319
C 1.399232 0.210589 -0.264588
C -0.979752 0.744045 0.537228
C 2.871376 0.623652 -0.292911
C 0.791167 2.591382 0.501345
C 1.194230 -1.296306 -0.054745
C -1.745574 1.307055 -0.491901
C -1.602998 -0.195666 1.426995
C -3.128611 0.973334 -0.668803
C 3.420493 1.130609 -1.498575
C 3.712017 0.516902 0.847145
C -3.749106 0.032526 0.241960
C -2.947939 -0.535872 1.285628
C 0.249573 -1.996935 -0.850127
C -3.921824 1.545509 -1.719333
C 4.774667 1.530137 -1.573160
C 5.063648 0.919735 0.774298
C -5.134040 -0.297970 0.068264
C 0.072173 -3.384558 -0.663284
C 5.601969 1.427764 -0.431978
C 1.766167 -3.275646 1.065283
C -5.268182 1.203860 -1.866054
C 0.844927 -4.044859 0.318016
C -5.880438 0.274039 -0.964435
H 0.976352 0.440751 -1.262383
H 0.639976 2.894555 -0.549802
H 1.835870 2.818566 0.769088
H 0.113932 3.201958 1.128228
H -1.298905 2.028383 -1.187338
H -0.989400 -0.641673 2.215475
H 0.545154 1.388368 2.719296
H 2.784552 1.209813 -2.390335
H 3.292634 0.110275 1.768602
H -3.407855 -1.255544 1.973833
H -0.339745 -1.457519 -1.599080
H -3.454596 2.260102 -2.408073
H 5.180114 1.917405 -2.515137
H 5.701802 0.831669 1.661427
H -5.599464 -1.010037 0.760638
H -0.652454 -3.936524 -1.271544
H 6.652644 1.736426 -0.482987
H 2.393378 -3.744456 1.833260
H -5.864200 1.646620 -2.671698
H 0.745388 -5.120135 0.498011
H -6.937605 0.015376 -1.090504


