%chk=000281040.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000281040

0 1
O -2.424437 -3.160414 2.772806
O -3.246904 0.693622 -1.998396
O -2.920835 0.917909 0.254236
N -0.827735 -1.564434 1.030392
N -1.397583 -0.265447 -1.055465
N -0.006323 -1.398012 -2.319290
N -1.076200 -0.775534 -2.311135
C -0.311284 -0.651652 -0.004457
C 0.681581 -1.436911 -0.977542
C -1.673536 -0.930425 2.096083
C -1.524274 -2.792526 0.520712
C 0.358682 0.567328 0.610446
C 2.075047 -0.871385 -1.067262
C -1.814888 -1.939468 3.244387
C -1.679790 -3.768030 1.700896
C 0.183454 1.861617 0.106697
C 1.233535 0.364265 1.694926
C -2.564807 0.499710 -0.827439
C 2.369768 0.237295 -1.873598
C 3.097381 -1.486970 -0.326855
C 0.853820 2.941789 0.693243
C 1.900143 1.443205 2.275507
C 1.709199 2.737278 1.777372
C 3.678491 0.724566 -1.937782
C 4.402029 -0.992287 -0.393081
C 4.695321 0.113009 -1.198640
C -4.481227 1.487386 -1.912000
C -4.149278 2.952068 -1.734768
H 0.738751 -2.519577 -0.672938
H -2.682029 -0.638396 1.716070
H -1.202105 0.007130 2.459761
H -0.922262 -3.270059 -0.281840
H -2.522414 -2.559452 0.087201
H -0.843565 -2.180246 3.709617
H -2.534484 -1.596954 4.009416
H -0.701128 -4.102856 2.087332
H -2.307993 -4.637576 1.436843
H -0.468579 2.051860 -0.744785
H 1.392877 -0.644737 2.080738
H 1.584292 0.720499 -2.454212
H 2.878142 -2.347857 0.302313
H 0.705227 3.945356 0.297477
H 2.573937 1.276936 3.114427
H 2.229071 3.579025 2.231547
H 3.904087 1.584310 -2.567131
H 5.192495 -1.470568 0.182982
H 5.712985 0.495234 -1.250403
H -5.102448 1.084072 -1.093273
H -4.921603 1.250979 -2.899894
H -3.419756 3.294731 -2.480551
H -3.716785 3.146498 -0.740726
H -5.043262 3.580296 -1.831065


%chk=000281040-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000281040

0 1
O -2.616203 -3.342016 2.791423
O -3.055270 0.721897 -2.016270
O -2.717200 1.140406 0.267365
N -0.926363 -1.629457 1.142417
N -1.275337 -0.267291 -0.936475
N -0.054884 -1.823424 -2.006635
N -1.122970 -1.104544 -2.100943
C -0.308867 -0.696351 0.183664
C 0.720883 -1.496118 -0.744333
C -1.842571 -1.064691 2.184013
C -1.539854 -2.869997 0.586986
C 0.362525 0.486895 0.886764
C 2.022968 -0.799926 -1.124868
C -2.019125 -2.096337 3.305866
C -1.768488 -3.885895 1.722990
C 0.420428 1.772247 0.300670
C 1.039389 0.263562 2.112493
C -2.389057 0.575288 -0.807000
C 2.092085 0.100338 -2.216678
C 3.198161 -1.075764 -0.383767
C 1.115025 2.821134 0.939712
C 1.733389 1.311308 2.753194
C 1.771376 2.598880 2.170985
C 3.313973 0.723566 -2.550584
C 4.419115 -0.448668 -0.712719
C 4.480573 0.454939 -1.798279
C -4.251748 1.622248 -1.979703
C -3.838129 3.085881 -2.149687
H 0.969921 -2.443618 -0.237222
H -2.834422 -0.820330 1.751485
H -1.423690 -0.130473 2.587074
H -0.883834 -3.335920 -0.167386
H -2.511170 -2.645319 0.088675
H -1.036724 -2.318951 3.777609
H -2.722840 -1.728608 4.070664
H -0.784733 -4.191066 2.143334
H -2.300876 -4.775009 1.346206
H -0.071813 1.960577 -0.658528
H 1.015217 -0.737071 2.557873
H 1.200035 0.298377 -2.820880
H 3.156274 -1.779918 0.456352
H 1.144728 3.811986 0.473335
H 2.247265 1.121092 3.702170
H 2.308583 3.415117 2.666604
H 3.357445 1.413292 -3.400879
H 5.319871 -0.667679 -0.128706
H 5.428607 0.938092 -2.059834
H -4.786808 1.462515 -1.027208
H -4.858579 1.259894 -2.824303
H -3.246317 3.222115 -3.071221
H -3.246342 3.428309 -1.284233
H -4.740822 3.720689 -2.222681


