%chk=000271478.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000271478

0 1
O -1.548213 -0.648195 1.503400
O -0.020708 0.042562 3.059604
O 3.223387 -1.982293 -0.267109
N -4.321616 -2.258126 -0.537536
C -0.611323 1.048006 0.067983
C -1.473456 -0.269331 0.094907
C -2.971704 -0.031224 -0.287515
C -0.952781 1.972952 -1.117270
C -0.932699 1.658765 1.456341
C -0.843389 -1.438823 -0.656457
C 0.894248 0.778410 -0.005407
C -3.131818 0.805938 -1.567020
C -2.447630 2.159226 -1.375550
C -1.178691 0.444989 2.367093
C 0.560190 -1.734794 -0.130480
C 1.421307 -0.509731 -0.107129
C 1.771358 1.885920 0.036139
C -3.711766 -1.283340 -0.424697
C 2.834694 -0.662525 -0.171946
C 3.148453 1.710641 -0.028386
C 3.702760 0.427925 -0.135223
C 4.640881 -2.266492 -0.352774
H -3.434103 0.532552 0.574887
H -0.473361 1.562817 -2.032271
H -0.481842 2.963903 -0.956780
H -1.817084 2.314955 1.410821
H -0.111320 2.283104 1.850524
H -0.815930 -1.210203 -1.739762
H -1.464089 -2.352993 -0.543327
H -4.206107 0.943837 -1.800250
H -2.701391 0.271256 -2.436646
H -2.594197 2.788308 -2.276175
H -2.920407 2.716827 -0.543557
H -1.954436 0.535269 3.148057
H 1.036017 -2.533042 -0.741484
H 0.489934 -2.153431 0.900566
H 1.365156 2.891901 0.121934
H 0.673433 -0.292047 2.445715
H 3.810512 2.576047 0.005502
H 4.778788 0.305030 -0.184943
H 4.643344 -3.362677 -0.420212
H 5.151526 -1.929558 0.553909
H 5.066172 -1.817016 -1.254374


%chk=000271478-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000271478

0 1
O -1.447575 -0.703800 1.521664
O 0.177012 0.180940 3.071507
O 3.268812 -2.047869 -0.301922
N -4.442804 -2.249590 -0.327188
C -0.637350 1.047351 0.050258
C -1.485025 -0.275953 0.088924
C -2.999708 -0.006868 -0.254104
C -0.974811 1.953967 -1.175542
C -1.017928 1.665919 1.434302
C -0.883484 -1.407637 -0.757029
C 0.886933 0.755743 0.021257
C -3.205590 0.805810 -1.566405
C -2.479883 2.158685 -1.442136
C -1.065901 0.444893 2.385737
C 0.529776 -1.771807 -0.279340
C 1.418435 -0.550745 -0.139222
C 1.777333 1.861165 0.145213
C -3.780969 -1.257846 -0.278900
C 2.838221 -0.717806 -0.156616
C 3.169655 1.676093 0.115397
C 3.716645 0.380979 -0.034533
C 4.711495 -2.301057 -0.327586
H -3.411237 0.597566 0.579780
H -0.513363 1.495703 -2.073044
H -0.479041 2.933684 -1.044285
H -2.009023 2.152661 1.387297
H -0.292347 2.410673 1.795984
H -0.857964 -1.088510 -1.817777
H -1.534101 -2.297801 -0.695359
H -4.287534 0.953232 -1.736755
H -2.815988 0.236203 -2.431383
H -2.606564 2.741301 -2.374100
H -2.945483 2.756508 -0.632786
H -1.805126 0.518534 3.197927
H 0.999189 -2.491809 -0.971768
H 0.455788 -2.285305 0.698288
H 1.377080 2.873188 0.270804
H 0.908357 0.118080 2.400998
H 3.839129 2.537414 0.213469
H 4.801674 0.245652 -0.050032
H 4.808179 -3.390297 -0.444624
H 5.191534 -1.983462 0.618231
H 5.195653 -1.788483 -1.181496


