%chk=000285835.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000285835

0 1
O -0.716985 -0.175509 0.342369
O 3.150893 2.393993 -0.231612
N -1.692353 1.836388 -0.153402
N 1.346557 1.247232 -1.044185
N 5.213595 -1.348474 0.022053
N -5.577750 -1.390571 -0.410589
C -0.452025 2.631342 0.013706
C 0.526419 2.470522 -1.171086
C -1.719326 0.462549 0.053059
C 2.594744 1.321194 -0.405200
C -3.076317 -0.165423 -0.113462
C 3.204918 0.006253 -0.050010
C 2.469799 -1.020019 0.557728
C -3.297694 -1.055280 -1.168756
C -4.101705 0.108971 0.796920
C 4.580914 -0.191738 -0.292233
C 3.118397 -2.212034 0.890259
C -4.568415 -1.646881 -1.281491
C -5.340394 -0.529884 0.612274
C 4.487159 -2.340479 0.604439
H -0.732433 3.701147 0.131311
H 0.054045 2.327813 0.963440
H -0.017534 2.432011 -2.140185
H 1.204622 3.360828 -1.213897
H -2.514532 2.333725 -0.481888
H 0.811922 0.372071 -1.008435
H 1.401998 -0.892860 0.777219
H -2.506540 -1.296934 -1.877198
H -3.946736 0.785309 1.635457
H 5.193190 0.600507 -0.746743
H 2.573156 -3.025255 1.364123
H -4.796689 -2.352847 -2.090388
H -6.177996 -0.355228 1.299557
H 5.037598 -3.258337 0.844645


%chk=000285835-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000285835

0 1
O -0.887406 -0.021579 0.888573
O 3.226173 2.164387 -1.218045
N -1.770030 1.956487 0.042124
N 1.310827 1.456946 -0.122948
N 5.213661 -1.488545 -0.592394
N -5.443140 -1.573282 -0.825441
C -0.656944 2.818571 0.506088
C 0.630371 2.740101 -0.339177
C -1.846517 0.609182 0.322183
C 2.588442 1.250832 -0.596134
C -3.112475 -0.101729 -0.079849
C 3.195762 -0.106858 -0.337056
C 2.522341 -1.188068 0.289747
C -3.065097 -1.507516 -0.246101
C -4.355983 0.551751 -0.276140
C 4.536367 -0.315725 -0.757801
C 3.209229 -2.408388 0.468821
C -4.240847 -2.192957 -0.620566
C -5.481515 -0.219984 -0.644534
C 4.544650 -2.514201 0.016491
H -1.026198 3.858728 0.500392
H -0.425085 2.542895 1.551643
H 0.401379 2.889124 -1.413789
H 1.310264 3.564539 -0.049144
H -2.500168 2.381798 -0.531074
H 0.767899 0.731273 0.368763
H 1.485184 -1.104012 0.634221
H -2.124191 -2.038763 -0.077273
H -4.480636 1.628280 -0.113117
H 5.070831 0.504776 -1.247152
H 2.721581 -3.262527 0.949110
H -4.235167 -3.278601 -0.764678
H -6.457814 0.253310 -0.796574
H 5.108753 -3.446143 0.138629


