%chk=000246643.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000246643

0 1
O -3.100056 1.942719 0.516171
O -2.347027 1.345237 -1.542209
N 0.369143 3.987803 -0.740415
C 0.090551 0.587724 0.098709
C 1.530595 0.754487 0.551084
C -0.561804 -0.574211 0.829761
C -0.771500 1.871366 0.282375
C 2.550389 -0.062891 -0.058783
C -1.289333 -1.577301 0.096295
C 1.877652 1.652451 1.535900
C -0.445850 -0.677770 2.198551
C 3.900077 0.103855 0.351737
C -1.844493 -2.676037 0.805560
C -2.127945 1.676326 -0.404294
C 2.264167 -1.046144 -1.060159
C -1.485541 -1.517413 -1.321424
C 3.232570 1.811283 1.943243
C -1.020615 -1.771560 2.904003
C 4.222850 1.061555 1.365083
C -1.697810 -2.752478 2.226729
C -0.132980 3.048329 -0.295613
C 4.927518 -0.691885 -0.249993
C -2.550429 -3.696452 0.089632
C 3.265232 -1.799827 -1.619430
C -2.168838 -2.504208 -1.984624
C 4.618366 -1.619102 -1.212104
C -2.704546 -3.615341 -1.270553
C -4.502974 1.827708 0.096133
C -4.886492 3.023553 -0.746216
H 0.103508 0.374824 -1.012966
H -0.947947 2.050663 1.385043
H 1.131211 2.274282 2.027854
H 0.105375 0.068619 2.771670
H 1.229667 -1.199441 -1.371454
H -1.101966 -0.650262 -1.870632
H 3.461161 2.543129 2.717223
H -0.903246 -1.814529 3.986128
H 5.263565 1.179083 1.663293
H -2.132269 -3.600695 2.753828
H 5.956902 -0.544001 0.073597
H -2.960097 -4.535991 0.649552
H 3.041625 -2.547214 -2.379475
H -2.318008 -2.450536 -3.062512
H 5.393102 -2.227964 -1.675426
H -3.237242 -4.387742 -1.822992
H -4.626815 0.867800 -0.436114
H -5.004625 1.802213 1.081185
H -5.964237 3.042347 -0.949467
H -4.624247 3.969399 -0.253875
H -4.370094 3.011543 -1.718808


%chk=000246643-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000246643

0 1
O -3.092448 1.877692 0.592728
O -2.369555 1.491752 -1.595094
N 0.348497 4.102078 -0.969777
C 0.142777 0.650339 0.001079
C 1.596333 0.817261 0.473195
C -0.554756 -0.535805 0.705640
C -0.723082 1.954890 0.199799
C 2.614031 -0.080027 -0.038134
C -1.298534 -1.544585 -0.021738
C 1.963410 1.793330 1.408300
C -0.458498 -0.630022 2.100912
C 3.983367 0.071882 0.419262
C -1.907720 -2.634884 0.724874
C -2.132351 1.747396 -0.395479
C 2.335118 -1.125666 -0.983106
C -1.466425 -1.540733 -1.450693
C 3.310651 1.936493 1.860048
C -1.074834 -1.689068 2.828993
C 4.305260 1.092539 1.373062
C -1.784350 -2.679434 2.150984
C -0.118640 3.138774 -0.444216
C 5.000952 -0.802119 -0.088147
C -2.630324 -3.658398 0.025021
C 3.347076 -1.963093 -1.458972
C -2.173830 -2.552314 -2.102659
C 4.694861 -1.801927 -1.011913
C -2.760734 -3.626178 -1.362980
C -4.521749 1.691029 0.164306
C -5.085910 2.992680 -0.408946
H 0.158382 0.477944 -1.088655
H -0.849400 2.159441 1.277518
H 1.219105 2.491392 1.804791
H 0.131073 0.113655 2.648869
H 1.313375 -1.288498 -1.336567
H -1.067133 -0.716271 -2.048550
H 3.552440 2.721005 2.584731
H -0.974671 -1.724939 3.919018
H 5.343676 1.198479 1.708437
H -2.251483 -3.507293 2.697596
H 6.030232 -0.668726 0.265985
H -3.079415 -4.472170 0.607173
H 3.105790 -2.752631 -2.179035
H -2.288148 -2.517448 -3.191444
H 5.479283 -2.464168 -1.394041
H -3.312243 -4.413496 -1.888186
H -4.553591 0.871224 -0.574208
H -5.024544 1.387885 1.095664
H -6.158576 2.858358 -0.641202
H -4.991401 3.818682 0.316579
H -4.565140 3.270995 -1.340021


