%chk=000298591.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298591

0 1
O 0.510821 1.325454 -3.155380
N -0.352131 1.069570 -1.027403
C -0.751715 -1.315285 -0.991311
C -0.822942 -0.012042 -0.117263
C -0.329247 -0.857773 -2.404961
C 0.019688 0.615607 -2.300842
C 0.220060 -2.309546 -0.403168
C -2.233972 0.237088 0.376643
C 0.027736 2.391765 -0.489570
C 1.397996 2.355586 0.148953
C -0.230780 -3.582079 -0.024585
C 1.572666 -1.974333 -0.229983
C -3.212612 0.801861 -0.452790
C -2.564755 -0.130605 1.689701
C 0.662905 -4.509879 0.519577
C 2.461131 -2.903941 0.314241
C -4.509116 1.002110 0.029378
C -3.863186 0.067945 2.166487
C 1.536610 2.415675 1.541441
C 2.537157 2.257411 -0.664559
C -4.837002 0.635444 1.338341
C 2.008766 -4.173722 0.689843
C 2.811117 2.383940 2.116876
C 3.806920 2.224409 -0.084973
C 3.946015 2.288431 1.306318
H -1.769921 -1.771452 -1.046562
H -0.124694 -0.084345 0.759419
H -1.137088 -1.007993 -3.144589
H 0.537337 -1.427672 -2.793592
H 0.019067 3.125470 -1.335530
H -0.754022 2.724564 0.230644
H -1.277075 -3.854237 -0.152441
H 1.931217 -0.985471 -0.519156
H -2.960118 1.091142 -1.473246
H -1.813165 -0.574454 2.341171
H -5.265062 1.444857 -0.617532
H -4.116104 -0.219532 3.185794
H 0.307308 -5.497061 0.810627
H 3.509219 -2.638421 0.446267
H 0.657410 2.490254 2.178256
H 2.422427 2.205670 -1.751200
H -5.847246 0.791376 1.711921
H 2.703196 -4.896799 1.112867
H 2.917992 2.434227 3.198975
H 4.690145 2.151307 -0.717711
H 4.936644 2.265481 1.755805


%chk=000298591-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000298591

0 1
O 0.707808 1.398155 -3.512181
N -0.144611 1.047651 -1.340721
C -0.428158 -1.327583 -1.312325
C -0.369628 -0.054749 -0.375260
C 0.372059 -0.902734 -2.574933
C 0.335357 0.629383 -2.579192
C 0.048453 -2.601049 -0.629092
C -1.629036 0.121497 0.464529
C -0.101177 2.465087 -0.930202
C 1.102401 2.782429 -0.044505
C -0.841174 -3.685685 -0.429080
C 1.387704 -2.732803 -0.173610
C -2.849094 0.527665 -0.135056
C -1.605989 -0.155284 1.852341
C -0.408783 -4.874648 0.201809
C 1.823612 -3.917148 0.458503
C -4.022753 0.651228 0.638867
C -2.781648 -0.040762 2.629057
C 0.943804 3.030727 1.341199
C 2.405999 2.814371 -0.606264
C -3.993623 0.364456 2.024805
C 0.926538 -4.995127 0.647811
C 2.066618 3.309840 2.155124
C 3.527969 3.090649 0.205039
C 3.361539 3.339789 1.588893
H -1.486698 -1.458456 -1.604019
H 0.501039 -0.135444 0.308825
H -0.045956 -1.307080 -3.510914
H 1.429376 -1.223251 -2.525133
H -0.054199 3.043384 -1.871003
H -1.041802 2.713104 -0.407216
H -1.880549 -3.596591 -0.768687
H 2.098518 -1.908196 -0.314646
H -2.869939 0.756474 -1.208218
H -0.665427 -0.465792 2.324088
H -4.958190 0.971328 0.166060
H -2.751185 -0.263565 3.701481
H -1.112050 -5.702747 0.345130
H 2.860857 -4.001759 0.802183
H -0.060630 3.006553 1.782778
H 2.529544 2.629273 -1.680226
H -4.904815 0.458898 2.626037
H 1.265174 -5.915530 1.136407
H 1.931057 3.504773 3.225068
H 4.529126 3.120370 -0.239819
H 4.232158 3.558902 2.217463


