%chk=000269385.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000269385

0 1
O 2.324334 -1.979206 0.740282
O 1.852989 1.417382 0.763731
O 1.891343 -1.320112 -1.385814
O 3.069123 3.311697 0.505045
O -2.829430 -4.702241 2.750294
O -2.906878 1.979889 -3.121854
O -0.756964 -4.516172 3.342749
O -1.812522 0.399426 -2.133219
N -1.686322 -4.312528 2.579160
N -1.997453 1.573959 -2.420825
C 3.790304 -0.006783 0.475947
C 3.706226 -1.518441 0.650153
C 2.947943 0.765004 1.485738
C 0.146140 -2.334000 -0.046765
C 0.906858 3.088183 -0.569145
C 1.502512 -1.817791 -0.354388
C 2.069574 2.677888 0.260771
C -0.105003 -3.070098 1.117828
C 0.023158 2.132101 -1.084213
C -0.891068 -2.066765 -0.957865
C 0.723905 4.453541 -0.845090
C -1.406158 -3.533843 1.354223
C -1.051981 2.566807 -1.872863
C -2.184768 -2.534386 -0.703187
C -0.353998 4.868728 -1.634194
C -2.451706 -3.270178 0.450272
C -1.247512 3.931383 -2.152607
H 3.451753 0.258026 -0.556668
H 4.850920 0.314010 0.520823
H 4.192334 -2.055694 -0.184092
H 4.097045 -1.870945 1.623543
H 3.523252 1.527402 2.039132
H 2.383518 0.111660 2.179216
H 0.701307 -3.280509 1.835475
H 0.172082 1.061212 -0.877052
H -0.682940 -1.482959 -1.866707
H 1.433418 5.185363 -0.441025
H -2.986674 -2.310291 -1.411815
H -0.495006 5.930366 -1.847156
H -3.460459 -3.644069 0.663933
H -2.096295 4.242287 -2.774172


%chk=000269385-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000269385

0 1
O 2.012924 -2.275242 0.718387
O 0.919108 1.866898 0.022107
O 2.116577 -3.211683 -1.419465
O 2.803639 3.164886 0.488342
O -2.469016 -5.658621 3.620861
O -2.918027 5.833439 -3.057583
O -1.061118 -3.923659 4.078611
O -2.886146 3.654467 -2.384888
N -1.542611 -4.823719 3.289986
N -2.354224 4.825328 -2.481729
C 2.484538 -0.040053 -0.284902
C 3.087569 -1.306556 0.336837
C 1.562248 0.701386 0.694843
C 0.534985 -4.092091 0.215031
C 0.914083 4.147413 -0.701702
C 1.615133 -3.178347 -0.269791
C 1.657321 3.048347 -0.011252
C 0.021345 -4.008415 1.529892
C -0.370507 3.943685 -1.257276
C 0.026501 -5.061697 -0.688734
C 1.535377 5.420542 -0.790362
C -0.996122 -4.904911 1.907857
C -1.002887 5.029603 -1.892020
C -0.993760 -5.947497 -0.282287
C 0.877024 6.491394 -1.431316
C -1.517381 -5.877201 1.025962
C -0.404393 6.305147 -1.991291
H 1.930481 -0.304965 -1.202905
H 3.319596 0.624669 -0.576527
H 3.771539 -1.800464 -0.374040
H 3.604205 -1.100623 1.288629
H 2.124015 1.065120 1.574084
H 0.714660 0.075713 1.012849
H 0.401725 -3.272546 2.241166
H -0.865122 2.971965 -1.198112
H 0.444783 -5.101680 -1.699683
H 2.530057 5.546117 -0.350472
H -1.382344 -6.692460 -0.983126
H 1.360532 7.470846 -1.495417
H -2.307884 -6.548339 1.372085
H -0.941523 7.113108 -2.495051


