%chk=000197245.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000197245

0 1
O 3.932744 -1.116422 1.726706
O 6.934022 0.348319 -1.384031
N 0.000850 -2.458170 0.790226
N 3.232018 0.597568 0.344992
N -5.607494 -0.793309 -0.415774
N 5.474540 -0.281941 0.241253
C -1.100823 -1.461838 0.533932
C 1.022066 -0.455840 -0.244027
C -0.470787 -0.232885 -0.097428
C 1.213865 -1.964457 0.060337
C -2.126569 -2.123457 -0.414421
C 1.805612 0.448666 0.729894
C -1.097760 0.881507 -0.495130
C -3.393732 -1.353146 -0.425567
C -3.492563 0.088988 -0.415676
C 0.259088 -2.643686 2.246645
C -2.541204 1.134996 -0.425366
C -4.892301 0.411651 -0.403448
C -4.682185 -1.863092 -0.425420
C 3.586479 1.568061 -0.722679
C -3.014229 2.447190 -0.403878
C 4.165301 -0.325808 0.828272
C 4.620656 0.995048 -1.694136
C -5.357439 1.742245 -0.380179
C -4.399120 2.740193 -0.375909
C 5.793510 0.364424 -0.979270
H -1.622422 -1.171665 1.482365
H 1.336249 -0.242188 -1.291587
H 1.269944 -2.544427 -0.885501
H 2.151123 -2.167396 0.617795
H -2.293520 -3.174249 -0.094421
H -1.708305 -2.195384 -1.440658
H 1.762570 0.026625 1.765178
H 1.348202 1.461737 0.782069
H -0.521268 1.703668 -0.930135
H 1.058261 -3.393940 2.373596
H -0.647082 -3.054181 2.720223
H 0.559768 -1.735243 2.788487
H 3.992906 2.485464 -0.230292
H 2.671259 1.873663 -1.277402
H -5.010324 -2.886250 -0.432175
H -6.602569 -0.888259 -0.415619
H -2.313079 3.278130 -0.406812
H 4.992928 1.791159 -2.376553
H 4.165269 0.232121 -2.364524
H -6.417699 1.965147 -0.366415
H -4.707297 3.785556 -0.354366
H 6.215741 -0.797696 0.736529


%chk=000197245-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000197245

0 1
O 3.396312 -0.776019 2.190493
O 7.277140 0.336073 -0.115145
N 0.186595 -2.372317 0.160520
N 3.145384 0.519709 0.242100
N -5.667253 -0.646645 0.567966
N 5.303519 -0.050069 1.055578
C -0.958538 -1.429932 0.294193
C 0.950340 -0.270951 -0.773936
C -0.559736 -0.206270 -0.537559
C 1.260104 -1.787962 -0.685687
C -2.289406 -2.119015 -0.135976
C 1.671709 0.543918 0.345925
C -1.328760 0.846330 -0.952858
C -3.518810 -1.282408 0.104100
C -3.664048 0.126881 -0.200641
C 0.602922 -3.082023 1.381616
C -2.755027 1.105306 -0.714289
C -5.024730 0.497766 0.083151
C -4.756761 -1.715391 0.580321
C 3.805888 1.412655 -0.736408
C -3.277475 2.400838 -0.968247
C 3.884214 -0.135185 1.213107
C 5.127084 0.803091 -1.237008
C -5.525665 1.798148 -0.145875
C -4.627871 2.742318 -0.687479
C 6.018958 0.366199 -0.077565
H -1.083272 -1.112345 1.358935
H 1.223434 0.151315 -1.761101
H 1.256470 -2.237014 -1.700259
H 2.255848 -1.977916 -0.240678
H -2.363978 -3.079115 0.409056
H -2.188706 -2.376464 -1.208203
H 1.408104 0.130931 1.334067
H 1.326989 1.595947 0.310350
H -0.810475 1.644782 -1.507518
H 1.271744 -3.922076 1.120626
H -0.285076 -3.515884 1.876746
H 1.138197 -2.436663 2.118245
H 3.993853 2.405943 -0.276300
H 3.116833 1.564321 -1.584644
H -5.058392 -2.707050 0.913499
H -6.641041 -0.697933 0.857249
H -2.608827 3.169219 -1.375628
H 5.691088 1.524034 -1.850518
H 4.925719 -0.086786 -1.864573
H -6.563934 2.067820 0.076281
H -4.976546 3.760762 -0.890974
H 5.841079 -0.443677 1.834644


