%chk=000207811.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207811

0 1
O 0.216577 -2.327022 0.868800
O 2.250402 0.033331 -0.239772
O 1.028749 1.905897 0.179591
N -0.015514 -0.182822 -0.158250
C 0.251747 -1.645310 -0.392722
C -1.372666 0.268081 0.003301
C -2.410825 -0.532125 -0.541599
C -0.853317 -2.299678 -1.174478
C -2.088477 -1.782777 -1.225902
C 1.063927 0.712653 -0.039905
C -1.685360 1.471896 0.662429
C -3.743125 -0.106531 -0.406972
C 3.496112 0.846459 -0.204933
C -3.014651 1.869123 0.780497
C -4.046839 1.083949 0.249126
C 3.855017 1.088638 1.249255
C 4.472552 -0.043636 -0.952911
C 1.425683 -2.255650 1.651625
H 1.256660 -1.749778 -0.875517
H -0.579184 -3.237675 -1.650577
H -2.894037 -2.268148 -1.779262
H -0.891816 2.103584 1.074128
H 3.281219 1.796481 -0.744262
H -4.544518 -0.718981 -0.820140
H -3.252466 2.801534 1.293218
H -5.081114 1.405010 0.349734
H 4.818982 1.601889 1.344984
H 3.097820 1.720848 1.738878
H 3.918518 0.154380 1.819079
H 5.464218 0.420164 -1.013203
H 4.128405 -0.240346 -1.977145
H 4.589091 -1.019814 -0.464221
H 1.710728 -1.215438 1.836851
H 2.229564 -2.799596 1.148386
H 1.133037 -2.754092 2.583690


%chk=000207811-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000207811

0 1
O 0.086409 -2.476590 0.935452
O 2.296022 -0.042123 -0.261516
O 1.020412 1.891157 0.056608
N -0.006613 -0.243357 -0.098146
C 0.210047 -1.705678 -0.315939
C -1.358001 0.233033 0.053267
C -2.396039 -0.516247 -0.587917
C -0.818781 -2.280880 -1.251594
C -2.056076 -1.720060 -1.344707
C 1.083744 0.643554 -0.082274
C -1.685550 1.394776 0.793388
C -3.738038 -0.066536 -0.484846
C 3.537229 0.814774 -0.282260
C -3.029347 1.815116 0.888276
C -4.062401 1.090484 0.247804
C 3.959195 1.123507 1.160871
C 4.565345 0.003169 -1.073183
C 1.190782 -2.260936 1.882800
H 1.233803 -1.816450 -0.711550
H -0.547901 -3.196135 -1.785055
H -2.829823 -2.170338 -1.977748
H -0.897410 1.978578 1.269667
H 3.271544 1.751310 -0.806139
H -4.525404 -0.644140 -0.983910
H -3.266701 2.715177 1.465922
H -5.102215 1.425486 0.322448
H 4.883044 1.730702 1.159596
H 3.174370 1.696547 1.681889
H 4.159695 0.190292 1.717140
H 5.506564 0.575528 -1.159182
H 4.196629 -0.215840 -2.089733
H 4.786284 -0.952612 -0.565693
H 1.191001 -1.225679 2.276759
H 2.173061 -2.468014 1.413072
H 1.010218 -2.967078 2.708233


