%chk=000270470.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270470

0 1
O -1.639017 -0.722951 0.359007
O -0.714936 -2.586302 -0.543618
O 0.838822 3.169269 1.458032
O 4.201581 -2.241390 -1.491602
O 2.963871 3.310510 1.057360
O 5.291031 -0.437247 -0.985795
N 1.896512 2.727499 1.048358
N 4.281051 -1.112987 -1.045022
C -3.964193 -0.173614 0.321301
C -2.984593 -1.362138 0.397970
C -3.600174 0.925049 1.340656
C -4.005895 0.394354 -1.111862
C -3.058674 -2.169361 1.679674
C -4.747477 1.900818 1.581833
C -4.703407 -0.537434 -2.098108
C -0.599936 -1.456100 -0.128123
C 0.659380 -0.657336 -0.073664
C 1.835753 -1.239111 -0.567116
C 0.671096 0.639026 0.456312
C 1.880272 1.353081 0.487527
C 3.030625 -0.503011 -0.523776
C 3.070388 0.795911 0.000880
H -4.978881 -0.573175 0.577206
H -3.058947 -2.017047 -0.501418
H -2.701044 1.471388 0.992616
H -3.305483 0.456818 2.301613
H -4.527521 1.373525 -1.099357
H -2.975109 0.611014 -1.455493
H -4.055322 -2.604389 1.824272
H -2.835021 -1.558035 2.564209
H -2.339950 -3.001275 1.667415
H -5.628148 1.399732 1.999193
H -4.453290 2.687273 2.287306
H -5.061776 2.396894 0.655341
H -4.729625 -0.097512 -3.102555
H -4.192355 -1.503894 -2.184121
H -5.740578 -0.737742 -1.805692
H 1.822565 -2.261708 -0.983704
H -0.256816 1.093880 0.844245
H 4.016118 1.365819 0.030000


%chk=000270470-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000270470

0 1
O -1.615290 -0.647641 0.412353
O -0.682131 -2.554394 -0.569681
O 1.029437 3.256572 1.453798
O 4.198689 -2.405675 -1.571188
O 3.264964 3.310709 0.998175
O 5.423069 -0.546157 -1.068413
N 2.115799 2.729310 1.003898
N 4.320651 -1.211845 -1.104325
C -4.014257 -0.154061 0.339594
C -2.985424 -1.302044 0.468284
C -3.807988 0.965700 1.399591
C -4.033658 0.424865 -1.104075
C -3.064221 -2.140385 1.750768
C -5.071950 1.820351 1.642091
C -4.607336 -0.530645 -2.174343
C -0.575787 -1.389584 -0.114207
C 0.716590 -0.623073 -0.079288
C 1.875203 -1.251847 -0.591555
C 0.790986 0.686963 0.447783
C 2.035428 1.346435 0.449742
C 3.095586 -0.550985 -0.565884
C 3.209842 0.754148 -0.050778
H -5.002777 -0.627639 0.531705
H -3.039782 -1.974901 -0.407425
H -2.973102 1.616630 1.074397
H -3.494366 0.521131 2.363202
H -4.634698 1.353998 -1.101727
H -3.002405 0.725191 -1.378220
H -4.063871 -2.606172 1.824448
H -2.901440 -1.527562 2.653221
H -2.314220 -2.949083 1.732284
H -5.903021 1.199826 2.027718
H -4.873643 2.615532 2.383463
H -5.422276 2.312804 0.716475
H -4.628380 -0.042735 -3.165715
H -4.006859 -1.453251 -2.279382
H -5.643047 -0.829452 -1.924853
H 1.817335 -2.265651 -0.998606
H -0.097304 1.180343 0.847964
H 4.166550 1.282373 -0.039995


