%chk=000235840.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000235840

0 1
O 0.393803 2.476986 -0.720385
O -1.113069 0.563174 1.814674
N -1.655899 0.005559 -0.345432
C 0.711780 0.376271 0.310584
C 2.944570 -0.602442 0.445276
C -0.743949 0.341899 0.675888
C 3.501067 0.538450 -0.196298
C -1.180058 -0.317991 -1.723390
C 1.538111 -0.652768 0.696694
C -3.072559 -0.115482 -0.083751
C 1.292149 1.513031 -0.339869
C 2.644334 1.608396 -0.590588
C 3.807553 -1.674157 0.837078
C 4.912583 0.582864 -0.434601
C -0.861372 -1.804203 -1.864692
C -3.537114 -0.564030 1.167206
C -3.995876 0.212929 -1.096003
C 5.156619 -1.605899 0.595805
C 5.713796 -0.461833 -0.048034
C -4.909100 -0.683805 1.391278
C -5.364078 0.082290 -0.855009
C -5.827305 -0.367816 0.384717
H -1.961668 -0.019535 -2.461659
H -0.288487 0.303160 -1.965009
H 1.127273 -1.524486 1.213384
H 3.073044 2.478835 -1.076390
H 3.371794 -2.541799 1.332365
H 5.332332 1.459744 -0.924264
H -0.034309 -2.107725 -1.211698
H -1.725696 -2.429283 -1.604132
H -0.575353 -2.049299 -2.893924
H -2.832248 -0.791983 1.970474
H -3.648430 0.576664 -2.062013
H 5.820540 -2.416220 0.891423
H 6.789177 -0.434902 -0.224912
H -5.264470 -1.026003 2.363120
H -6.074311 0.338743 -1.640058
H -6.894226 -0.465995 0.567487
H 0.840550 3.287559 -1.075243


%chk=000235840-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000235840

0 1
O 0.281564 2.097476 -1.047079
O -0.939788 0.011133 1.897144
N -1.592213 -0.238528 -0.348237
C 0.811060 0.138969 0.261876
C 3.166345 -0.537902 0.620924
C -0.643546 -0.027829 0.662007
C 3.616022 0.571060 -0.196174
C -1.191616 -0.476636 -1.764285
C 1.762153 -0.709021 0.837359
C -3.009761 -0.220357 -0.052822
C 1.276649 1.245925 -0.531500
C 2.639649 1.455937 -0.754999
C 4.137839 -1.421242 1.196402
C 5.023054 0.749690 -0.408370
C -1.724543 -1.816075 -2.310664
C -3.535162 -0.849453 1.105784
C -3.897533 0.424910 -0.953226
C 5.502480 -1.223727 0.973430
C 5.946228 -0.129660 0.163209
C -4.924764 -0.823059 1.353205
C -5.285726 0.441108 -0.700254
C -5.808833 -0.182284 0.455458
H -1.522553 0.367749 -2.395801
H -0.092013 -0.482507 -1.800928
H 1.415398 -1.519414 1.488373
H 2.976718 2.309333 -1.358995
H 3.792477 -2.255370 1.818606
H 5.367369 1.588413 -1.025324
H -1.351676 -2.662379 -1.706690
H -2.827238 -1.850172 -2.307383
H -1.378930 -1.954951 -3.351463
H -2.858736 -1.335143 1.810231
H -3.507008 0.930484 -1.842207
H 6.238746 -1.902116 1.417405
H 7.019000 0.016087 -0.005190
H -5.315907 -1.309895 2.253615
H -5.955636 0.948426 -1.403653
H -6.886156 -0.167190 0.653433
H 0.688082 2.887108 -1.483116


